data_1wrs_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 1wrs _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.072 0.463 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -144.21 -11.08 0.64 Allowed 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.18 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -90.09 -72.38 0.57 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -49.26 -35.28 17.24 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -51.05 -62.52 1.56 Allowed 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 113.628 -1.624 . . . . 0.0 107.2 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tp -45.79 -38.09 6.76 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 112.938 -1.937 . . . . 0.0 110.316 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' R' ' 22' ' ' PHE . 26.5 mmt180 -55.93 -66.42 0.43 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 117.17 -1.812 . . . . 0.0 107.69 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.454 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -39.35 -43.24 1.15 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.068 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . 0.463 ' O ' ' N ' ' R' ' 26' ' ' LEU . 40.4 t -68.11 -70.67 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 119.384 -0.927 . . . . 0.0 111.108 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' R' ' 23' ' ' VAL . 4.7 t0 -25.98 -48.83 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.19 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . 0.474 ' CD2' ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -77.3 -45.71 25.34 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 117.017 -1.873 . . . . 0.0 109.322 -179.923 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' R' ' 23' ' ' VAL . 0.2 OUTLIER -47.12 -52.74 14.57 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.101 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' R' ' 29' ' ' ALA . 18.4 tptm -66.95 -68.46 0.37 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.103 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -41.86 -20.51 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.241 -0.984 . . . . 0.0 112.071 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . 0.487 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -83.59 -54.22 5.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -43.79 -25.97 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.939 -1.104 . . . . 0.0 110.346 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . 0.413 ' N ' ' C ' ' R' ' 29' ' ' ALA . 2.6 tt0 -50.8 -41.92 57.63 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.548 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -106.1 -72.17 0.72 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.813 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . 0.401 ' H ' HD23 ' R' ' 34' ' ' LEU . 0.7 OUTLIER 170.7 17.43 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.049 -1.06 . . . . 0.0 112.881 -179.746 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . 0.621 ' H ' ' CD2' ' R' ' 34' ' ' LEU . 0.0 OUTLIER -92.69 -10.53 36.86 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.251 -1.379 . . . . 0.0 110.614 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 11.0 p-80 -44.47 -30.88 0.94 Allowed 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.446 -0.901 . . . . 0.0 112.929 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.68 -58.11 5.96 Favored Pre-proline 0 N--CA 1.487 1.409 0 C-N-CA 117.884 -1.526 . . . . 0.0 109.906 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.18 -29.98 89.15 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 C-N-CA 119.923 0.415 . . . . 0.0 111.618 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.53 -45.97 34.91 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.694 -0.803 . . . . 0.0 109.283 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 43' ' ' LEU . 0.2 OUTLIER -45.87 -44.15 14.2 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.777 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -70.21 -16.48 63.07 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.16 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tp -78.62 -48.61 14.76 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.738 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.13 47.39 2.42 Favored 'General case' 0 N--CA 1.511 2.593 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.512 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER 173.26 117.47 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.387 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.544 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -35.86 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.513 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.544 ' CD ' ' H ' ' R' ' 44' ' ' THR . 32.9 Cg_endo -80.91 -101.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.363 0 C-N-CA 121.154 1.236 . . . . 0.0 114.197 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -53.44 -18.92 3.02 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . 0.516 ' OE2' ' NH1' ' S' ' 54' ' ' ARG . 0.4 OUTLIER -63.76 -65.74 0.64 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.395 -1.73 . . . . 0.0 109.832 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . 0.461 ' NH2' ' O ' ' S' ' 15' ' ' ARG . 2.7 mmm180 -51.62 -30.56 21.88 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 118.773 -1.171 . . . . 0.0 110.912 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . 0.435 ' O ' ' OG1' ' R' ' 53' ' ' THR . 4.6 mt-10 -82.89 -72.81 0.43 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -62.19 -43.03 99.74 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . 0.438 ' CD1' ' C ' ' R' ' 51' ' ' LEU . 0.2 OUTLIER -58.51 -46.84 85.92 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 117.986 -1.486 . . . . 0.0 111.248 -179.802 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -53.95 -59.26 10.14 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 107.496 -2.241 . . . . 0.0 107.496 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.464 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -34.3 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.183 -1.008 . . . . 0.0 112.239 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.77 -56.42 2.68 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 14.9 p -67.01 -18.86 24.87 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 114.956 -2.698 . . . . 0.0 110.548 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' R' ' 60' ' ' GLU . 0.0 OUTLIER -93.02 -29.38 15.85 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 118.016 -1.474 . . . . 0.0 112.418 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.462 ' C ' ' CD1' ' R' ' 57' ' ' ILE . 0.2 OUTLIER -76.31 -41.43 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 115.663 -2.415 . . . . 0.0 106.872 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.493 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 7.3 p -66.33 -52.94 41.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 117.391 -1.724 . . . . 0.0 110.822 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . 0.493 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 5.7 tt0 -64.03 -12.99 43.57 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.33 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' R' ' 56' ' ' ARG . 3.4 mm-40 -78.97 -52.3 8.44 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.739 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 pp -89.4 -25.85 21.33 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.067 -1.453 . . . . 0.0 111.554 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp . . . . . 0 N--CA 1.486 1.336 0 C-N-CA 118.321 -1.351 . . . . 0.0 110.696 179.997 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.54 1.01 46.76 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.867 -1.159 . . . . 0.0 113.958 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.56 ' H ' ' CD1' ' R' ' 79' ' ' ILE . 0.1 OUTLIER -122.11 -72.98 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.824 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.534 ' O ' ' N ' ' R' ' 82' ' ' ILE . . . -102.34 -71.28 0.72 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -37.09 -21.13 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -79.75 -31.26 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 118.118 -1.433 . . . . 0.0 112.389 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.35 19.71 16.14 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . 0.479 HH22 ' CD1' ' S' ' 41' ' ' LEU . 0.1 OUTLIER -93.46 -39.74 10.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 117.575 -1.65 . . . . 0.0 107.804 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . 0.418 ' N ' ' CD ' ' R' ' 84' ' ' ARG . . . -40.57 -24.72 0.08 OUTLIER Glycine 0 N--CA 1.481 1.699 0 CA-C-N 113.48 -1.691 . . . . 0.0 110.561 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 86' ' ' SER . . . . . 0.478 ' N ' ' O ' ' R' ' 84' ' ' ARG . 1.8 t -81.48 -70.3 0.55 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.281 -0.968 . . . . 0.0 110.312 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -60.26 -3.59 0.65 Allowed 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.97 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 88' ' ' SER . . . . . 0.469 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.6 OUTLIER -48.48 -26.73 2.29 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.98 -1.088 . . . . 0.0 110.698 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -41.18 -42.12 1.98 Allowed 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.957 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.97 -50.26 3.03 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.799 0.809 . . . . 0.0 110.399 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.26 -55.34 1.71 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.351 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.45 162.77 23.44 Favored Pre-proline 0 N--CA 1.489 1.503 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.814 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -56.82 170.04 1.58 Allowed 'Trans proline' 0 C--N 1.316 -1.143 0 C-N-CA 121.02 1.146 . . . . 0.0 111.593 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . 0.467 ' C ' ' H ' ' R' ' 96' ' ' LEU . 79.5 t -93.98 -31.08 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.797 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.47 3.6 0.93 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.894 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . 0.467 ' H ' ' C ' ' R' ' 94' ' ' VAL . 1.3 tp -84.69 -44.93 12.95 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.593 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -59.07 -24.32 62.8 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.764 -0.775 . . . . 0.0 109.543 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -63.25 -40.08 96.41 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.435 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -101.2 -60.04 1.59 Allowed 'General case' 0 N--CA 1.512 2.672 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.327 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -43.67 -19.74 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 118.386 -1.325 . . . . 0.0 113.57 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.455 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.2 mm-40 -53.23 -37.13 61.79 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . 0.418 ' N ' ' C ' ' R' ' 100' ' ' LEU . 3.7 mt-10 -86.81 -37.66 17.57 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 111.622 -2.535 . . . . 0.0 114.556 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.0 t -82.62 -9.53 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 116.08 -2.248 . . . . 0.0 111.69 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 tp -94.37 -56.2 2.9 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.12 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . 0.445 ' C ' ' CD1' ' R' ' 105' ' ' LEU . 0.4 OUTLIER -68.3 -27.17 66.06 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.847 -1.141 . . . . 0.0 111.548 -179.643 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 27.2 tttp . . . . . 0 N--CA 1.488 1.425 0 C-N-CA 119.111 -1.036 . . . . 0.0 110.438 179.89 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . 0.461 ' O ' ' NH2' ' R' ' 48' ' ' ARG . 4.1 mtt180 . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.798 0.333 . . . . 0.0 110.656 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -157.32 -0.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.223 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.444 ' C ' ' N ' ' S' ' 19' ' ' TRP . 6.1 mt-30 -95.4 -83.33 0.36 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.833 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' S' ' 17' ' ' GLN . 9.2 pt-20 -45.22 -30.52 1.23 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . 0.444 ' N ' ' C ' ' S' ' 17' ' ' GLN . 62.4 t-105 -55.89 -64.01 0.99 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.146 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' S' ' 24' ' ' ASP . 6.5 tp -48.14 -36.71 13.92 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.92 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' S' ' 22' ' ' PHE . 17.6 mmt180 -56.53 -67.39 0.31 Allowed 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 117.383 -1.727 . . . . 0.0 106.361 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.459 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -37.55 -47.29 0.91 Allowed 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.58 178.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 48.6 t -74.27 -74.7 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.594 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' S' ' 20' ' ' LEU . 14.3 t0 -37.1 -41.73 0.38 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.596 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 58.6 tp -60.62 -53.11 61.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.07 -61.51 2.34 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.361 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 21.8 tptp -39.67 -53.97 2.1 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.047 -0.661 . . . . 0.0 112.572 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -65.97 -25.28 67.03 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.473 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . 0.495 ' O ' ' N ' ' S' ' 31' ' ' GLN . . . -82.99 -48.95 10.08 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.875 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . 0.485 ' CE2' ' NE2' ' S' ' 35' ' ' HIS . 9.4 t80 -42.09 -21.7 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.916 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' S' ' 29' ' ' ALA . 0.9 OUTLIER -69.63 -47.18 64.29 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.926 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.8 OUTLIER -74.72 -27.74 60.5 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.504 -0.879 . . . . 0.0 109.293 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.5 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 1.3 t70 86.49 50.72 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.479 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . 0.58 ' N ' ' CD1' ' S' ' 34' ' ' LEU . 0.0 OUTLIER -136.08 14.62 3.3 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.708 1.242 . . . . 0.0 109.223 179.672 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . 0.485 ' NE2' ' CE2' ' S' ' 30' ' ' TYR . 31.1 p-80 -61.73 -19.15 62.11 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 112.904 -1.953 . . . . 0.0 111.526 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.427 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.8 mt -69.61 -59.01 5.09 Favored Pre-proline 0 N--CA 1.483 1.184 0 C-N-CA 118.894 -1.122 . . . . 0.0 109.213 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -54.31 -34.83 81.77 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 N-CA-C 110.115 -0.763 . . . . 0.0 110.115 179.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 19.5 mt -72.13 -40.45 68.07 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 118.991 -1.084 . . . . 0.0 110.523 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . 0.517 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.4 OUTLIER -50.61 -50.8 53.15 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-O 121.523 0.678 . . . . 0.0 109.315 179.644 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . 0.601 ' ND2' HH12 ' S' ' 48' ' ' ARG . 0.7 OUTLIER -56.49 -6.06 0.26 Allowed 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.349 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . 0.517 ' H ' ' C ' ' S' ' 39' ' ' LEU . 1.8 tp -100.43 -67.87 0.84 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.901 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -3.88 20.43 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.658 -1.217 . . . . 0.0 111.172 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . 0.448 ' O ' ' O ' ' S' ' 39' ' ' LEU . 1.5 mp -157.0 132.91 9.52 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.177 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.54 ' H ' ' CD ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -170.42 -30.45 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 115.916 -2.314 . . . . 0.0 116.407 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.54 ' CD ' ' H ' ' S' ' 44' ' ' THR . 34.1 Cg_endo -99.03 -102.97 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.398 0 CA-C-N 119.277 0.777 . . . . 0.0 113.701 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.44 -16.75 2.48 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 118.142 -1.423 . . . . 0.0 107.831 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . 0.457 ' N ' ' C ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -68.27 -67.48 0.46 Allowed 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.554 -1.203 . . . . 0.0 107.804 179.498 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . 0.601 HH12 ' ND2' ' S' ' 40' ' ' ASN . 0.0 OUTLIER -41.56 -33.81 0.5 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.927 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . 0.441 ' O ' ' OG1' ' S' ' 53' ' ' THR . 4.2 mt-10 -84.79 -67.83 0.77 Allowed 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 119.536 -0.866 . . . . 0.0 113.041 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . 0.412 ' C ' ' OG1' ' S' ' 53' ' ' THR . . . -45.88 -23.67 0.31 Allowed 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.195 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . 0.411 ' C ' ' N ' ' S' ' 53' ' ' THR . 4.2 mp -77.46 -56.74 4.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.086 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -21.63 4.07 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 118.635 -1.745 . . . . 0.0 109.434 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.441 ' OG1' ' O ' ' S' ' 49' ' ' GLU . 0.1 OUTLIER -73.64 -78.67 0.09 Allowed 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 114.173 -1.013 . . . . 0.0 111.007 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . 0.516 ' NH1' ' OE2' ' R' ' 47' ' ' GLU . 23.3 mtt85 -41.58 -26.99 0.08 Allowed 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.742 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 98.7 t -80.0 -41.5 21.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 C-N-CA 119.022 -1.071 . . . . 0.0 108.845 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' S' ' 53' ' ' THR . 19.7 mtt180 -58.33 -50.61 73.01 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 116.993 -1.883 . . . . 0.0 107.34 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -66.57 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 C-N-CA 117.035 -1.866 . . . . 0.0 111.293 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 52.0 t -42.93 -64.45 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 C-N-CA 118.424 -1.31 . . . . 0.0 113.318 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -48.55 -46.7 39.23 Favored 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.985 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.74 -30.63 70.16 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 119.297 -0.961 . . . . 0.0 112.227 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.15 -27.46 69.39 Favored 'General case' 0 C--N 1.284 -2.252 0 C-N-CA 118.467 -1.293 . . . . 0.0 110.757 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 4.9 mt -81.87 -62.91 1.5 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 116.479 2.029 . . . . 0.0 116.479 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 . . . . . 0 N--CA 1.504 2.234 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.814 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . 0.773 ' C ' ' H ' ' S' ' 74' ' ' GLU . 14.8 tttt . . . . . 0 N--CA 1.525 3.282 1 N-CA-C 122.063 4.097 . . . . 0.0 122.063 . . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . 0.26 0.2 OUTLIER -74.1 18.18 0.15 Allowed 'General case' 0 N--CA 1.519 2.989 0 O-C-N 118.418 -2.677 . . . . 0.0 108.844 179.455 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . 0.773 ' H ' ' C ' ' S' ' 72' ' ' LYS 0.363 0.0 OUTLIER 40.81 -51.1 0.0 OUTLIER 'General case' 1 N--CA 1.58 6.033 1 N-CA-C 126.846 5.869 . . . . 0.0 126.846 -171.986 . . . . . . . . 6 4 . 1 . 001 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . 0.458 ' H ' ' HG ' ' S' ' 75' ' ' LEU . 3.4 pp -91.29 -20.36 21.97 Favored 'General case' 0 C--N 1.267 -2.982 0 CA-C-N 118.796 0.725 . . . . 0.0 112.039 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.18 -16.38 72.03 Favored Glycine 1 N--CA 1.548 6.125 0 CA-C-N 112.728 -2.033 . . . . 0.0 115.106 178.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -136.72 -69.18 0.47 Allowed 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 115.923 -2.311 . . . . 0.0 113.344 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . 0.439 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 149.12 127.72 1.61 Allowed Glycine 0 CA--C 1.456 -3.644 1 N-CA-C 98.104 -5.999 . . . . 0.0 98.104 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.21 -22.61 27.71 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.211 1 C-N-CA 111.581 -4.047 . . . . 0.0 106.397 -178.572 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.478 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -63.66 -37.32 86.88 Favored 'General case' 0 N--CA 1.511 2.619 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 81' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' S' ' 78' ' ' GLY . 9.1 p -53.67 -55.94 21.62 Favored 'General case' 0 C--N 1.297 -1.683 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.296 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . 0.37 0.3 OUTLIER -63.28 11.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 117.812 2.523 . . . . 0.0 117.812 -178.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -96.55 -62.28 1.29 Allowed 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 118.402 -1.319 . . . . 0.0 108.063 178.686 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -52.34 -23.7 6.34 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 118.357 -1.337 . . . . 0.0 109.006 179.241 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.63 -11.1 59.45 Favored Glycine 0 N--CA 1.498 2.825 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.386 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -100.49 -23.16 14.78 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . 0.514 ' N ' ' ND2' ' S' ' 87' ' ' ASN . 0.6 OUTLIER -105.49 -3.8 22.05 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.573 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.51 ' N ' ' O ' ' S' ' 84' ' ' ARG . 0.2 OUTLIER -62.01 -15.6 45.36 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . 0.462 ' N ' ' C ' ' S' ' 87' ' ' ASN . 3.4 mt -71.72 -78.9 0.08 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.221 -1.809 . . . . 0.0 111.366 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -53.96 -66.61 0.36 Allowed 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.54 0.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 160.04 76.9 Favored Pre-proline 0 N--CA 1.501 2.085 0 C-N-CA 118.482 -1.287 . . . . 0.0 110.359 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -68.27 158.22 58.46 Favored 'Trans proline' 0 C--N 1.324 -0.723 0 N-CA-C 108.29 -1.465 . . . . 0.0 108.29 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' S' ' 96' ' ' LEU . 36.4 t -88.04 -65.12 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.353 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -45.37 -12.39 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 C-N-CA 119.065 -1.054 . . . . 0.0 112.783 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' S' ' 94' ' ' VAL . 0.9 OUTLIER -65.59 -34.95 79.42 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.04 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -54.08 -24.18 16.51 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.559 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -82.81 -28.92 29.9 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 118.516 -1.274 . . . . 0.0 110.814 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . 0.403 ' O ' ' N ' ' S' ' 102' ' ' GLU . 6.2 t90 -90.34 -56.25 3.28 Favored 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.518 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.484 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.6 mm? -40.18 -31.58 0.14 Allowed 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 118.954 -1.098 . . . . 0.0 113.829 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.484 ' C ' ' O ' ' S' ' 100' ' ' LEU . 42.5 mt-10 -46.72 -39.7 12.05 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 105.02 -2.215 . . . . 0.0 105.02 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' S' ' 99' ' ' TRP . 3.2 mt-10 -86.01 -32.76 21.31 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 112.79 -2.004 . . . . 0.0 114.333 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . . . . . . . . . 2.8 t -90.64 -2.43 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 116.64 -2.024 . . . . 0.0 113.125 -179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.06 -49.36 3.14 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.92 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . 0.433 ' N ' ' CD2' ' S' ' 105' ' ' LEU . 3.9 mm? -69.04 -64.2 0.91 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 118.832 -1.147 . . . . 0.0 109.602 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -57.83 10.49 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.646 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 116.371 -1.776 . . . . 0.0 109.858 -179.996 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmm-85 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 120.702 0.287 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -147.94 -2.2 0.55 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.934 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.416 ' C ' ' N ' ' R' ' 19' ' ' TRP . 2.7 mt-30 -83.88 -80.24 0.19 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.022 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' R' ' 17' ' ' GLN . 5.3 mt-10 -44.2 -31.5 1.0 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 122.708 1.242 . . . . 0.0 108.666 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . 0.416 ' N ' ' C ' ' R' ' 17' ' ' GLN . 74.7 t-105 -56.82 -61.5 2.39 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.78 -2.009 . . . . 0.0 110.823 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 tt -48.11 -24.89 1.24 Allowed 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.533 ' O ' ' N ' ' R' ' 23' ' ' VAL . 10.1 mmt180 -69.78 -70.61 0.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.017 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.472 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.35 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.318 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . 0.533 ' N ' ' O ' ' R' ' 21' ' ' ARG . 48.9 t -75.22 -55.88 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.323 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -38.64 -52.84 1.65 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.459 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.38 -55.85 18.33 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.698 -1.201 . . . . 0.0 110.432 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.54 -7.05 6.04 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.149 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -83.66 -36.15 24.01 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 118.882 -1.127 . . . . 0.0 112.821 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -113.08 -0.14 14.8 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 119.69 -0.804 . . . . 0.0 113.098 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 30' ' ' TYR . . . -80.2 -53.17 6.92 Favored 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 118.884 -1.127 . . . . 0.0 112.647 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . 0.502 ' CZ ' ' NZ ' ' S' ' 27' ' ' LYS . 14.8 t80 -30.75 -46.63 0.08 Allowed 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . 0.462 HE21 ' CA ' ' R' ' 31' ' ' GLN . 0.0 OUTLIER -58.7 -52.43 65.71 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.346 -0.942 . . . . 0.0 111.191 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . 0.507 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 15.9 m120 -78.03 -12.14 59.96 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.245 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.9 t70 78.91 36.24 0.18 Allowed 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.233 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -99.48 -15.04 18.83 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.022 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . 0.415 ' N ' ' HB2' ' R' ' 29' ' ' ALA . 29.4 p-80 -52.42 -31.67 35.4 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.358 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.425 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.8 mt -69.95 -61.52 2.88 Favored Pre-proline 0 C--N 1.303 -1.431 0 C-N-CA 117.849 -1.541 . . . . 0.0 111.768 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 1.5 Cg_endo -54.3 -25.44 38.88 Favored 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 120.493 0.795 . . . . 0.0 111.208 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 46.5 mt -85.26 -35.81 21.3 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.123 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -36.15 62.42 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.514 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . 0.591 ' N ' HD21 ' R' ' 40' ' ' ASN . 1.7 m120 -73.31 4.57 4.46 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.012 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 50.3 mt -110.68 -67.32 1.0 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.857 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.0 OUTLIER -83.8 40.29 0.73 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.778 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -154.92 165.84 35.43 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.626 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.533 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.293 0.2 OUTLIER -121.76 -151.69 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.353 -179.785 . . . . . . . . 4 4 . 1 . 002 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 9.8 Cg_endo -101.09 -37.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.33 -0.444 0 N-CA-C 109.953 -0.826 . . . . 0.0 109.953 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -26.2 63.8 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.709 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . 0.422 ' O ' ' CB ' ' R' ' 51' ' ' LEU . 4.7 mm-40 -64.46 -51.0 65.27 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -51.73 -38.76 56.65 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 119.141 -1.023 . . . . 0.0 110.327 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . 0.447 ' O ' ' OG1' ' R' ' 53' ' ' THR . 1.2 tt0 -74.66 -67.84 0.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.164 -1.015 . . . . 0.0 112.101 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.454 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -56.36 -41.35 76.02 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.042 -0.663 . . . . 0.0 112.718 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . 0.422 ' CB ' ' O ' ' R' ' 47' ' ' GLU . 0.9 OUTLIER -53.5 -66.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.67 -44.62 6.89 Favored Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.295 -1.431 . . . . 0.0 109.941 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.546 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -49.02 -80.45 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.964 179.893 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 38.1 mtt-85 -37.53 -34.36 0.09 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.849 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -77.56 -32.62 18.51 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 118.197 -1.401 . . . . 0.0 110.446 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -79.8 -35.47 38.42 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.258 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.453 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.84 -36.37 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 117.641 -1.624 . . . . 0.0 108.941 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.453 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 2.3 t -61.76 -61.44 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 118.295 -1.362 . . . . 0.0 109.141 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -45.9 -44.42 14.57 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.813 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -52.93 -52.26 58.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.106 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 65.8 mt -76.4 -1.66 28.06 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.619 -0.832 . . . . 0.0 111.53 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.489 1.478 0 C-N-CA 119.701 -0.799 . . . . 0.0 112.138 179.978 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.796 0.331 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.99 143.09 7.64 Favored Glycine 0 N--CA 1.493 2.464 0 C-N-CA 119.364 -1.398 . . . . 0.0 111.159 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.465 ' CD1' ' C ' ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.47 -42.23 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.226 -179.914 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.471 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.33 -65.98 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.594 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 50.3 m -36.15 -45.82 0.47 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 22.6 pt -72.87 -36.68 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 118.962 -1.095 . . . . 0.0 112.612 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.471 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -52.51 -72.31 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.814 -1.154 . . . . 0.0 111.145 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . 0.451 ' O ' ' OG ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -54.89 -14.9 1.62 Allowed 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.486 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.18 -59.48 7.86 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.342 -1.408 . . . . 0.0 110.229 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 86' ' ' SER . . . . . 0.51 ' C ' ' H ' ' R' ' 88' ' ' SER . 100.0 p -88.0 -43.88 11.41 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.781 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.64 8.65 0.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.49 -0.884 . . . . 0.0 110.847 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 88' ' ' SER . . . . . 0.526 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.4 OUTLIER -68.92 -23.59 64.19 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.622 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . 0.465 ' C ' ' O ' ' R' ' 88' ' ' SER . 10.2 mt -30.87 -34.9 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.69 0.619 . . . . 0.0 112.022 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . 0.526 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -110.14 -64.82 1.22 Allowed 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.63 0.728 . . . . 0.0 111.413 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.23 -37.86 0.06 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.025 -1.443 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.58 159.21 7.04 Favored Pre-proline 0 N--CA 1.49 1.561 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.859 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -59.62 169.55 4.19 Favored 'Trans proline' 0 C--N 1.325 -0.672 0 C-N-CA 121.257 1.304 . . . . 0.0 111.333 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 63.9 t -108.98 -21.43 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.182 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -94.11 -1.15 54.74 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 119.363 -0.935 . . . . 0.0 111.12 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.55 -31.03 12.53 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.879 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -37.65 71.29 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.442 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -66.38 -10.32 42.21 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.311 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -97.87 -62.24 1.27 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.553 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.516 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -39.43 -38.09 0.53 Allowed 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.516 ' C ' ' O ' ' R' ' 100' ' ' LEU . 1.1 mm-40 -41.57 -38.61 1.38 Allowed 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 117.928 -1.509 . . . . 0.0 107.806 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -90.6 -27.2 19.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.484 -1.689 . . . . 0.0 112.868 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 t -87.97 -9.19 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 117.26 -1.776 . . . . 0.0 111.023 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -98.61 -52.97 3.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.018 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . 0.438 ' CD2' ' N ' ' R' ' 105' ' ' LEU . 4.5 mm? -70.29 -68.51 0.42 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.74 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 13.9 tptt . . . . . 0 N--CA 1.487 1.415 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.875 -179.912 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . 0.483 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 121.013 0.435 . . . . 0.0 110.157 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -7.33 0.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.384 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.483 ' H ' ' C ' ' S' ' 15' ' ' ARG . 0.0 OUTLIER -76.89 -86.24 0.05 Allowed 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.775 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -43.24 -34.77 1.24 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.279 1.038 . . . . 0.0 109.176 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -51.97 -57.55 9.13 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 113.815 -1.538 . . . . 0.0 109.075 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mt -59.37 -30.71 68.61 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.105 -1.407 . . . . 0.0 111.493 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.557 ' O ' ' N ' ' S' ' 24' ' ' ASP . 9.0 mmt85 -56.24 -65.23 0.64 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 117.902 -1.519 . . . . 0.0 109.519 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.482 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -36.62 -39.49 0.21 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.076 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 23.0 t -74.2 -36.69 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.136 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.557 ' N ' ' O ' ' S' ' 21' ' ' ARG . 54.7 t0 -58.83 -64.01 1.09 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.577 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.66 -56.03 8.13 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 118.956 -1.098 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . 0.46 ' C ' ' CD1' ' S' ' 26' ' ' LEU . 2.3 tm? -38.68 -46.4 1.22 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.244 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . 0.502 ' NZ ' ' CZ ' ' R' ' 30' ' ' TYR . 26.0 mtmm -66.16 -77.37 0.07 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.523 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -39.13 -47.76 1.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.91 -27.37 64.73 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.641 -0.824 . . . . 0.0 113.132 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -41.31 98.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 118.582 -1.247 . . . . 0.0 111.089 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -50.13 -30.97 12.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.791 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.448 ' O ' ' OD1' ' S' ' 33' ' ' ASP . 87.7 m-20 -101.77 -83.5 0.46 Allowed 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.482 -0.887 . . . . 0.0 111.402 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' S' ' 32' ' ' ASN . 0.3 OUTLIER 172.74 24.47 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.787 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . 0.59 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 2.1 mm? -98.07 -13.34 21.07 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -51.15 -18.0 0.78 Allowed 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 119.249 -0.98 . . . . 0.0 111.055 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.476 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.1 mt -78.51 -65.86 0.31 Allowed Pre-proline 0 N--CA 1.482 1.14 0 C-N-CA 118.592 -1.243 . . . . 0.0 110.278 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.476 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 6.1 Cg_exo -49.22 -33.44 28.02 Favored 'Trans proline' 0 C--N 1.318 -1.079 0 N-CA-C 110.161 -0.746 . . . . 0.0 110.161 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.21 -38.59 75.3 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 119.48 -0.888 . . . . 0.0 110.05 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.65 -22.55 46.36 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.079 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.58 15.69 19.2 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.696 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -115.52 -63.85 1.4 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.24 -21.82 61.33 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.704 -1.198 . . . . 0.0 112.532 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -152.84 160.2 43.07 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.854 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.532 ' N ' ' CD ' ' S' ' 45' ' ' PRO . 0.6 OUTLIER 178.93 -41.65 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 118.306 -1.357 . . . . 0.0 114.32 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.532 ' CD ' ' N ' ' S' ' 44' ' ' THR . 10.6 Cg_endo -75.88 -98.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.255 1.303 . . . . 0.0 113.064 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.59 -24.88 1.48 Allowed 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.875 -1.13 . . . . 0.0 110.351 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -59.31 -69.17 0.21 Allowed 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.778 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -29.45 4.48 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.7 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -82.56 -67.88 0.75 Allowed 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 118.759 -1.176 . . . . 0.0 112.203 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.11 -51.09 71.1 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 3.9 tp -39.47 -58.32 1.28 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.214 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . 0.4 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -53.98 -44.0 72.2 Favored Glycine 0 N--CA 1.492 2.383 0 C-N-CA 119.28 -1.438 . . . . 0.0 109.912 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -47.6 -75.87 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.64 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . 0.626 ' HE ' ' CA ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -48.74 -24.87 1.55 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.437 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -79.06 -27.61 13.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.342 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -81.79 -37.91 26.41 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.307 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . 0.452 ' CD1' ' C ' ' S' ' 57' ' ' ILE . 0.0 OUTLIER -73.61 -35.07 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 117.326 -1.75 . . . . 0.0 107.931 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 11.8 t -60.56 -56.02 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 117.925 -1.51 . . . . 0.0 109.292 179.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.83 -27.06 49.54 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.462 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -71.79 -52.19 18.81 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.017 -1.073 . . . . 0.0 112.821 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . 0.445 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -60.74 -24.69 65.91 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 117.738 -1.585 . . . . 0.0 110.269 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . 0.43 ' O ' ' C ' ' S' ' 63' ' ' ARG . 5.3 tp -85.38 25.48 1.02 Allowed 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.539 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' S' ' 61' ' ' LEU . 6.6 mtp-105 . . . . . 0 N--CA 1.501 2.1 0 O-C-N 124.696 1.248 . . . . 0.0 114.315 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 29.1 tttm . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.955 0.407 . . . . 0.0 111.863 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -104.19 -103.06 0.31 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.539 0.685 . . . . 0.0 110.696 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -147.85 -40.67 0.17 Allowed 'General case' 0 C--N 1.28 -2.434 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.816 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.2 tp -130.17 18.97 5.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.484 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -73.58 -57.89 4.8 Favored Glycine 0 N--CA 1.491 2.353 0 C-N-CA 119.577 -1.297 . . . . 0.0 110.89 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.44 -67.31 0.16 Allowed 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.199 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . 0.469 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 152.74 161.64 10.41 Favored Glycine 0 N--CA 1.491 2.333 0 C-N-CA 119.193 -1.48 . . . . 0.0 110.945 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.445 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -65.57 -40.68 88.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 C-N-CA 120.024 -0.671 . . . . 0.0 111.055 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.439 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -67.29 -37.11 82.87 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.274 -0.971 . . . . 0.0 111.617 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 81' ' ' THR . . . . . 0.642 ' HG1' ' N ' ' S' ' 82' ' ' ILE . 77.7 p -60.2 -56.42 21.84 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.337 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . 0.642 ' N ' ' HG1' ' S' ' 81' ' ' THR . 18.5 pt -57.25 -0.63 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.515 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.51 ' H ' ' C ' ' S' ' 81' ' ' THR . 0.0 OUTLIER -98.49 -69.98 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.257 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -3.84 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 118.859 -1.136 . . . . 0.0 110.922 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . 0.507 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -95.69 -22.59 20.74 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.341 -1.409 . . . . 0.0 110.292 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 65.2 p -87.32 -12.83 45.3 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.279 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' S' ' 89' ' ' LEU . 9.2 m120 -102.87 3.72 36.9 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -40.32 -24.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.852 -0.739 . . . . 0.0 111.22 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' S' ' 87' ' ' ASN . 7.3 mt -55.84 -49.58 72.93 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.922 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -103.92 -34.96 8.31 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.092 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.0 -71.42 0.07 Allowed 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.2 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.7 159.22 85.9 Favored Pre-proline 0 N--CA 1.488 1.436 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.351 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -57.12 176.79 0.22 Allowed 'Trans proline' 0 C--N 1.323 -0.791 0 C-N-CA 121.668 1.579 . . . . 0.0 112.038 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 65.7 t -96.08 -9.64 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.628 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -77.12 -22.29 52.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.584 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -37.9 79.45 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.847 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 -47.9 82.3 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.747 -0.781 . . . . 0.0 111.439 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -80.2 -8.15 59.3 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.908 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -101.37 -65.63 0.96 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 118.925 -1.11 . . . . 0.0 112.398 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.554 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -59.15 -39.9 83.87 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -179.67 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.554 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.0 OUTLIER -40.98 -29.91 0.12 Allowed 'General case' 0 C--N 1.296 -1.748 0 C-N-CA 117.563 -1.655 . . . . 0.0 106.95 179.738 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.545 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 mt-10 -91.88 -24.6 19.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 112.9 -1.955 . . . . 0.0 112.348 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . 0.527 ' N ' ' O ' ' S' ' 100' ' ' LEU . 18.9 t -87.96 -21.19 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 116.536 -2.066 . . . . 0.0 109.833 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tp -86.94 -57.78 2.84 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.949 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.35 -75.09 0.2 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 118.728 -1.189 . . . . 0.0 110.343 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -76.63 47.39 0.49 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.381 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.305 -1.352 0 CA-C-O 116.324 -1.798 . . . . 0.0 110.921 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' R' ' 17' ' ' GLN . 23.5 ttt180 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 120.284 0.087 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -38.74 83.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' R' ' 15' ' ' ARG . 1.5 mt-30 -123.15 -91.42 0.55 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.301 -0.56 . . . . 0.0 109.795 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -57.24 -24.1 52.47 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . 0.4 ' N ' ' C ' ' R' ' 17' ' ' GLN . 9.4 t-105 -59.17 -46.99 86.95 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 112.559 -2.11 . . . . 0.0 106.214 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.0 tp -56.34 -47.22 79.25 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.562 -2.108 . . . . 0.0 110.411 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.0 OUTLIER -47.99 -70.0 0.11 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 119.05 -1.06 . . . . 0.0 110.416 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.5 OUTLIER -27.38 -51.14 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.329 179.675 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . 0.423 ' O ' ' N ' ' R' ' 26' ' ' LEU . 1.2 t -68.73 -46.29 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.326 -0.949 . . . . 0.0 110.991 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . 0.504 ' N ' ' O ' ' R' ' 21' ' ' ARG . 64.0 t0 -39.03 -45.37 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.709 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 mt -75.88 -34.91 60.0 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.06 -1.056 . . . . 0.0 109.986 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . 0.423 ' N ' ' O ' ' R' ' 23' ' ' VAL . 1.0 OUTLIER -55.57 -31.81 62.49 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.048 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -79.93 -39.53 30.1 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 118.931 -1.108 . . . . 0.0 112.244 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -85.86 -18.18 33.53 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.898 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.36 -58.84 2.76 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 118.968 -1.093 . . . . 0.0 111.766 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -45.47 -32.15 2.06 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.596 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' R' ' 31' ' ' GLN . 0.3 OUTLIER -46.79 -40.75 14.22 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.099 -1.04 . . . . 0.0 109.667 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . 0.4 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 63.6 t30 -106.51 -73.53 0.68 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.561 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . 0.4 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.5 OUTLIER 170.6 18.17 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 119.134 -1.026 . . . . 0.0 112.63 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . 0.458 ' H ' HD21 ' R' ' 34' ' ' LEU . 0.9 OUTLIER -88.8 -13.44 39.41 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.05 -1.06 . . . . 0.0 109.19 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -51.55 -27.52 11.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.385 -1.279 . . . . 0.0 113.024 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.456 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.9 mt -70.17 -62.52 2.21 Favored Pre-proline 0 N--CA 1.486 1.365 0 C-N-CA 117.872 -1.531 . . . . 0.0 110.815 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.1 Cg_exo -51.63 -25.21 19.34 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 C-N-CA 120.743 0.962 . . . . 0.0 110.667 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 24.5 mt -81.08 -38.83 26.68 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.096 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.94 -21.09 60.7 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.163 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . 0.546 ' O ' ' ND2' ' R' ' 40' ' ' ASN . 0.1 OUTLIER -103.69 11.68 35.68 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.374 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 39.4 tp -107.0 -69.81 0.82 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.635 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 1.1 mtt -77.36 7.74 4.97 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 118.121 -1.432 . . . . 0.0 112.81 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 9.0 mp -116.5 -176.2 2.91 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.443 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.275 0.0 OUTLIER -126.2 -153.33 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 118.543 -1.263 . . . . 0.0 109.62 179.996 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.443 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -97.99 -38.27 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.612 0 CA-C-N 119.95 1.018 . . . . 0.0 111.351 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . 0.439 ' OD1' ' OE1' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -56.42 -18.96 12.84 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.092 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . 0.439 ' OE1' ' OD1' ' R' ' 46' ' ' ASP . 3.6 mp0 -60.67 -71.33 0.14 Allowed 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.327 -0.949 . . . . 0.0 109.727 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -43.67 -44.45 6.44 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.674 -0.81 . . . . 0.0 109.867 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . 0.466 ' O ' ' OG1' ' R' ' 53' ' ' THR . 8.0 mm-40 -56.47 -77.32 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.06 -1.056 . . . . 0.0 111.58 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -66.73 -60.07 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.286 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . 0.452 ' C ' ' O ' ' R' ' 50' ' ' ALA . 4.5 tt -34.02 -58.53 0.45 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.122 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.2 -48.09 59.87 Favored Glycine 0 N--CA 1.488 2.11 0 C-N-CA 119.042 -1.551 . . . . 0.0 109.44 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.506 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.3 OUTLIER -48.46 -79.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.895 -0.722 . . . . 0.0 112.453 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . 0.53 ' H ' ' CD ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -39.88 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.826 -179.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' R' ' 53' ' ' THR . 1.5 t -88.43 -30.18 5.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 C-N-CA 118.488 -1.285 . . . . 0.0 111.236 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -76.58 -37.41 56.56 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.146 -1.022 . . . . 0.0 110.163 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -76.79 -52.42 17.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 C-N-CA 118.834 -1.147 . . . . 0.0 109.651 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.5 p -51.99 -44.42 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 117.692 -1.603 . . . . 0.0 110.742 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . 0.503 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 1.5 tm-20 -66.73 -29.56 69.57 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.625 -0.83 . . . . 0.0 111.251 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -48.81 20.88 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.985 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 97.8 mt -70.69 -22.69 62.44 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.681 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 tp . . . . . 0 C--N 1.301 -1.501 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.297 179.94 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 121.119 0.485 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . 0.517 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 171.19 157.8 13.86 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.771 -1.332 . . . . 0.0 109.771 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.569 ' N ' ' CD1' ' R' ' 79' ' ' ILE . 0.7 OUTLIER -73.56 28.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 C-N-CA 119.754 -0.778 . . . . 0.0 112.51 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.517 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.99 -37.4 5.61 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 81' ' ' THR . . . . . 0.487 ' O ' ' N ' ' R' ' 83' ' ' THR . 17.4 p -95.87 -56.44 2.66 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.182 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 pp -47.43 -13.99 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.393 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.487 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -66.25 -80.43 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.642 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . 0.723 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -54.18 -20.5 6.92 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.808 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.99 -46.7 91.05 Favored Glycine 0 N--CA 1.489 2.194 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.101 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -27.95 7.55 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.187 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . 0.644 ' C ' ' H ' ' R' ' 89' ' ' LEU . 1.9 t-20 -88.3 -56.27 3.39 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.793 -1.163 . . . . 0.0 111.446 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 88' ' ' SER . . . . . 0.597 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.8 -2.91 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.605 -1.238 . . . . 0.0 110.459 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . 0.749 ' O ' ' N ' ' R' ' 91' ' ' ALA . 1.2 mm? 28.79 32.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.805 1.316 . . . . 0.0 110.929 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' R' ' 88' ' ' SER . 6.9 tptt 20.19 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 114.163 -1.381 . . . . 0.0 113.927 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . 0.749 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -88.13 -3.09 58.93 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.749 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.89 171.13 8.99 Favored Pre-proline 0 N--CA 1.487 1.416 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.83 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -59.33 120.35 8.15 Favored 'Trans proline' 0 C--N 1.324 -0.758 0 C-N-CA 121.112 1.208 . . . . 0.0 111.618 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 43.1 t -60.99 -37.61 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 118.966 -1.094 . . . . 0.0 109.979 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -60.4 -10.05 4.36 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.709 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.3 -55.03 7.82 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.678 -0.809 . . . . 0.0 110.074 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . 0.488 ' O ' ' CG ' ' R' ' 101' ' ' GLU . 0.0 OUTLIER -63.13 -12.06 24.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.088 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -80.96 -34.2 33.32 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.049 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . 0.616 ' HE1' ' ND2' ' S' ' 32' ' ' ASN . 46.2 t90 -80.52 -58.84 2.93 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 121.952 0.882 . . . . 0.0 111.129 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.587 ' C ' ' N ' ' R' ' 102' ' ' GLU . 0.3 OUTLIER -70.43 -15.2 62.8 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 117.416 -1.714 . . . . 0.0 115.26 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' R' ' 97' ' ' ARG . 3.0 mm-40 -57.94 -18.71 25.1 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . 0.587 ' N ' ' C ' ' R' ' 100' ' ' LEU . 5.0 mt-10 -99.13 -35.63 9.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 112.378 -2.192 . . . . 0.0 114.195 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 5.1 t -73.55 -14.18 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 113.958 -3.097 . . . . 0.0 108.761 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 mt -88.65 -58.6 2.49 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.399 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 15.8 mt -62.5 -77.87 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.887 -1.125 . . . . 0.0 110.38 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.8 tptm . . . . . 0 C--N 1.302 -1.469 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.718 179.835 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.745 0.307 . . . . 0.0 111.446 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.49 15.72 6.55 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.174 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.473 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.5 mp0 -88.58 -90.07 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.906 -0.717 . . . . 0.0 110.461 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.514 ' N ' ' CD ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -43.45 -26.54 0.21 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.443 1.116 . . . . 0.0 109.198 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . 0.473 ' N ' ' C ' ' S' ' 17' ' ' GLN . 53.9 t-105 -57.11 -60.96 2.82 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 113.114 -1.857 . . . . 0.0 109.724 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 4.9 tp -43.49 -35.35 1.61 Allowed 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.851 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' S' ' 23' ' ' VAL . 29.7 mtt180 -64.01 -71.95 0.16 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.945 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.513 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -25.89 -40.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.461 0.476 . . . . 0.0 111.791 179.604 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . 0.552 ' N ' ' O ' ' S' ' 21' ' ' ARG . 89.4 t -73.65 -71.65 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 C-N-CA 119.959 -0.696 . . . . 0.0 111.718 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.417 ' C ' ' O ' ' S' ' 23' ' ' VAL . 33.1 t70 -28.28 -35.83 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . 0.52 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.5 mt -87.3 -44.07 11.69 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.015 -1.074 . . . . 0.0 111.069 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -57.15 -63.13 1.32 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.156 -1.017 . . . . 0.0 111.74 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -50.55 -49.17 56.7 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -67.46 -35.61 79.53 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.737 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -27.91 69.46 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 118.896 -1.121 . . . . 0.0 111.771 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -51.19 -53.57 33.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 118.694 -1.202 . . . . 0.0 110.519 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.12 -14.82 4.35 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.404 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.616 ' ND2' ' HE1' ' R' ' 99' ' ' TRP . 0.6 OUTLIER -105.43 -17.16 14.52 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.544 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.485 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.7 t0 75.13 25.35 1.35 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.847 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . 0.427 ' N ' HD21 ' S' ' 34' ' ' LEU . 0.4 OUTLIER -101.5 -13.97 17.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.881 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 12.2 p-80 -47.11 -19.8 0.14 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.926 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -80.16 -65.71 0.27 Allowed Pre-proline 0 N--CA 1.484 1.254 0 C-N-CA 117.593 -1.643 . . . . 0.0 110.43 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -50.25 -24.52 11.7 Favored 'Trans proline' 0 C--N 1.32 -0.95 0 N-CA-C 110.066 -0.782 . . . . 0.0 110.066 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . 0.51 ' O ' ' SD ' ' S' ' 42' ' ' MET . 73.1 mt -82.5 -39.1 22.91 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.929 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . 0.473 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.2 OUTLIER -52.36 -38.26 58.31 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.898 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . 0.425 ' ND2' HH22 ' S' ' 48' ' ' ARG . 0.3 OUTLIER -76.23 13.13 0.97 Allowed 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 118.748 -1.181 . . . . 0.0 110.16 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . 0.473 ' H ' ' C ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER -116.2 -54.9 2.44 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.568 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 42' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.0 OUTLIER -82.85 -8.02 59.61 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 118.13 -1.428 . . . . 0.0 112.057 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -112.78 173.47 6.36 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.476 ' CB ' ' CD ' ' S' ' 45' ' ' PRO 0.295 0.3 OUTLIER -129.12 -140.63 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.57 0 CA-C-O 117.37 -1.3 . . . . 0.0 109.497 179.941 . . . . . . . . 4 4 . 1 . 003 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.476 ' CD ' ' CB ' ' S' ' 44' ' ' THR . 12.1 Cg_endo -98.95 -44.4 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.501 0 CA-C-N 122.282 1.851 . . . . 0.0 111.102 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -23.03 5.49 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.102 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -68.5 -51.01 47.92 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.022 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . 0.425 HH22 ' ND2' ' S' ' 40' ' ' ASN . 4.8 mpt_? -55.76 -46.96 77.76 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.459 -0.792 . . . . 0.0 112.442 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.49 -66.08 0.6 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . 0.486 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -60.32 -61.59 2.49 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . 0.437 ' C ' ' CD1' ' S' ' 51' ' ' LEU . 0.2 OUTLIER -45.48 -38.11 5.91 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.529 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.22 -40.66 99.33 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 108.279 -1.928 . . . . 0.0 108.279 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.531 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -54.74 -73.89 0.05 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.291 -0.954 . . . . 0.0 110.921 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . 0.422 ' CD ' ' H ' ' S' ' 54' ' ' ARG . 1.3 mmt180 -37.43 -39.15 0.28 Allowed 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.262 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.1 t -64.11 -40.86 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 C-N-CA 117.742 -1.583 . . . . 0.0 109.246 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' S' ' 53' ' ' THR . 30.2 mtt180 -62.27 -51.59 67.11 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.691 -1.203 . . . . 0.0 109.325 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 2.0 mt -54.76 -64.96 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.784 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 86.2 t -43.29 -70.68 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.915 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -52.79 -31.13 36.98 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -34.38 64.25 Favored 'General case' 0 C--N 1.308 -1.225 0 C-N-CA 118.238 -1.385 . . . . 0.0 111.438 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 15.3 mt -75.5 -39.39 58.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.292 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mt -60.04 -31.53 70.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.284 -0.967 . . . . 0.0 110.197 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 C-N-CA 119.405 -0.918 . . . . 0.0 110.629 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 111.219 0.081 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . 0.497 ' O ' ' C ' ' S' ' 74' ' ' GLU . 52.7 t30 -129.09 6.16 5.39 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.292 -0.963 . . . . 0.0 113.405 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 73' ' ' ASN . 2.5 mm-40 -42.77 -46.85 5.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.094 -1.817 . . . . 0.0 106.094 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.3 tp -143.32 24.58 1.76 Allowed 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 112.919 -1.946 . . . . 0.0 108.514 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -127.42 -99.79 1.06 Allowed Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.896 -1.621 . . . . 0.0 113.023 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . 0.404 ' O ' ' CG ' ' S' ' 73' ' ' ASN . . . -150.59 -67.66 0.19 Allowed 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.062 -1.055 . . . . 0.0 112.765 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.57 160.08 33.11 Favored Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.093 -1.527 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.455 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -61.97 -39.87 85.23 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.273 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.21 -58.48 6.89 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.329 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 81' ' ' THR . . . . . 0.41 ' C ' ' H ' ' S' ' 83' ' ' THR . 73.1 p -42.2 -59.29 1.84 Allowed 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 34.1 pt -60.14 -3.16 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 119.093 -1.043 . . . . 0.0 112.925 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -107.81 -37.77 6.03 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.749 -0.78 . . . . 0.0 111.396 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . 0.456 ' O ' ' OG ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -81.34 19.19 1.0 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.482 -179.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.9 -38.88 2.81 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.595 -1.288 . . . . 0.0 110.424 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 86' ' ' SER . . . . . 0.401 ' C ' ' H ' ' S' ' 88' ' ' SER . 0.3 OUTLIER -87.19 -51.55 5.92 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.688 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -79.37 11.18 3.1 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.321 -0.951 . . . . 0.0 110.107 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.456 ' OG ' ' O ' ' S' ' 84' ' ' ARG . 0.1 OUTLIER -72.9 -31.5 64.71 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.331 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' S' ' 88' ' ' SER . 7.3 mt -34.95 -50.49 0.48 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.539 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -40.01 -66.72 0.28 Allowed 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.576 0.703 . . . . 0.0 112.358 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.27 -46.47 17.71 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.442 -1.253 . . . . 0.0 112.572 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -42.49 153.69 0.3 Allowed Pre-proline 0 N--CA 1.49 1.571 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.252 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -58.26 141.42 96.74 Favored 'Trans proline' 0 C--O 1.216 -0.6 0 C-N-CA 121.53 1.487 . . . . 0.0 112.139 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . 0.451 ' CG1' ' O ' ' S' ' 94' ' ' VAL . 63.4 t -109.71 11.13 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.087 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -99.21 -0.17 42.02 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.816 -0.753 . . . . 0.0 111.005 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 70.0 mt -101.64 -21.0 14.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.171 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.11 -24.05 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.679 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -101.57 -22.32 14.51 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.88 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . 0.428 ' CZ3' HG22 ' S' ' 103' ' ' VAL . 17.7 t90 -82.13 -60.45 2.22 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.999 -1.081 . . . . 0.0 112.959 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.527 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.4 OUTLIER -50.41 -36.27 32.12 Favored 'General case' 0 C--N 1.286 -2.188 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.998 -179.493 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.4 mt-10 -40.87 -32.14 0.21 Allowed 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.842 -1.543 . . . . 0.0 107.439 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.527 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -88.56 -28.19 20.9 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.042 -1.89 . . . . 0.0 112.381 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . 0.507 ' N ' ' O ' ' S' ' 100' ' ' LEU . 2.1 t -79.9 -35.91 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 115.233 -2.587 . . . . 0.0 108.331 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.5 -52.68 63.49 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.951 -1.1 . . . . 0.0 108.054 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 12.7 tp -56.48 -57.08 13.85 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 119.469 -0.892 . . . . 0.0 109.909 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -95.91 80.57 3.34 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.502 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.304 -1.411 0 CA-C-O 116.186 -1.864 . . . . 0.0 111.029 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.019 0.438 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -103.83 55.91 0.73 Allowed 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.556 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.6 tt0 -113.09 -82.27 0.59 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.272 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.1 OUTLIER -49.52 -21.66 1.02 Allowed 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 123.445 1.593 . . . . 0.0 106.937 179.571 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . 0.556 ' N ' ' C ' ' R' ' 17' ' ' GLN 0.257 43.2 t-105 -55.49 -51.66 66.25 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.607 -2.542 . . . . 0.0 109.042 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.07 -21.95 48.17 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.24 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.475 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.0 mmt85 -71.28 -72.07 0.23 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.354 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.475 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -35.5 -32.66 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.193 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . 0.473 ' N ' ' O ' ' R' ' 21' ' ' ARG . 89.0 t -81.95 -58.16 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.805 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . 0.439 ' HA ' ' HZ1' ' R' ' 27' ' ' LYS . 23.5 t0 -34.94 -45.2 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.385 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' R' ' 26' ' ' LEU . 0.7 OUTLIER -82.83 -40.2 20.67 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.726 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' R' ' 25' ' ' LEU . 4.8 tp -37.75 -52.63 1.28 Allowed 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.789 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . 0.439 ' HZ1' ' HA ' ' R' ' 24' ' ' ASP . 0.1 OUTLIER -70.12 -51.85 28.3 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.615 -1.234 . . . . 0.0 112.501 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -51.02 -31.4 18.13 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.855 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.39 -53.45 5.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.0 -1.08 . . . . 0.0 112.692 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . 0.411 ' O ' ' C ' ' R' ' 31' ' ' GLN . 61.5 t80 -36.51 -51.19 0.82 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' R' ' 30' ' ' TYR . 1.9 tt0 -38.45 -35.69 0.19 Allowed 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.576 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -101.77 -80.82 0.5 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.796 -0.762 . . . . 0.0 110.638 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 168.35 35.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.689 0.757 . . . . 0.0 109.106 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . 0.413 ' N ' ' CD2' ' R' ' 34' ' ' LEU . 2.1 mm? -100.86 -19.3 16.0 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.434 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . 0.406 ' CG ' ' N ' ' R' ' 36' ' ' LEU . 6.3 p-80 -48.09 -41.2 25.61 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 114.842 -1.072 . . . . 0.0 112.754 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.1 mt -58.06 -64.07 3.18 Favored Pre-proline 0 C--N 1.302 -1.494 0 C-N-CA 117.988 -1.485 . . . . 0.0 111.146 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.9 Cg_endo -56.35 -17.26 20.46 Favored 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.955 1.103 . . . . 0.0 111.27 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.82 -56.46 3.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.099 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . 0.476 ' C ' ' H ' ' R' ' 41' ' ' LEU . 2.6 mm? -51.71 -33.78 35.93 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 117.988 -1.485 . . . . 0.0 108.049 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -12.94 0.07 Allowed 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.058 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . 0.476 ' H ' ' C ' ' R' ' 39' ' ' LEU . 11.6 mt -112.0 -58.01 2.19 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 120.0 -0.68 . . . . 0.0 111.349 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 42' ' ' MET . . . . . 0.498 ' N ' ' SD ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -87.03 39.11 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 118.235 -1.386 . . . . 0.0 110.279 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -160.48 170.62 20.58 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.275 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.461 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.314 0.1 OUTLIER -132.86 -153.68 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.619 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.817 -179.955 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -95.21 -40.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.217 -0.531 0 N-CA-C 110.01 -0.804 . . . . 0.0 110.01 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -58.93 -34.19 71.45 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.111 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . 0.47 ' N ' ' OE1' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -63.23 -48.06 79.86 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.945 179.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -37.94 28.94 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.016 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -77.64 -73.27 0.31 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.972 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.42 -48.03 37.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.906 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -61.69 1.59 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.176 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.57 -44.95 68.26 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 119.69 -1.243 . . . . 0.0 111.451 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.482 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.1 OUTLIER -52.57 -83.42 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.61 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 10.1 mtt85 -42.33 -21.77 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.798 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . 0.482 ' N ' ' O ' ' R' ' 53' ' ' THR . 2.3 t -82.04 -40.61 17.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.027 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.4 -30.93 33.45 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 118.594 -1.242 . . . . 0.0 112.825 -179.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -78.66 -42.51 25.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 C-N-CA 118.007 -1.477 . . . . 0.0 109.228 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.535 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.9 p -62.1 -49.42 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.68 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . 0.535 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 3.9 pt-20 -66.91 -28.15 68.07 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 117.93 -1.508 . . . . 0.0 111.351 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -72.18 -44.9 62.32 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 119.067 -1.053 . . . . 0.0 112.253 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 40.0 mt -82.61 -7.15 59.66 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.497 -1.281 . . . . 0.0 111.983 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp . . . . . 0 N--CA 1.49 1.551 0 C-N-CA 118.708 -1.197 . . . . 0.0 110.871 179.837 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 120.849 0.357 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . 0.551 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 178.09 155.82 15.14 Favored Glycine 0 N--CA 1.488 2.165 0 C-N-CA 119.527 -1.32 . . . . 0.0 110.557 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.54 ' N ' ' CD1' ' R' ' 79' ' ' ILE . 0.8 OUTLIER -71.48 25.63 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 C-N-CA 119.887 -0.725 . . . . 0.0 112.168 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.551 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.2 -39.69 5.17 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 81' ' ' THR . . . . . 0.529 ' H ' ' HG1' ' R' ' 81' ' ' THR . 18.2 p -94.91 -61.16 1.54 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.857 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 1.8 pp -43.43 -22.29 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 119.319 -0.953 . . . . 0.0 110.998 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.465 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -60.24 -81.98 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.036 -179.922 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . 0.761 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -50.12 -26.01 4.06 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 118.738 -1.185 . . . . 0.0 110.015 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.95 -47.37 19.65 Favored Glycine 0 N--CA 1.486 1.981 0 C-N-CA 119.493 -1.337 . . . . 0.0 110.307 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.51 -56.18 2.43 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.103 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . 0.654 ' C ' ' H ' ' R' ' 89' ' ' LEU . 2.5 m-80 -43.41 -49.82 7.01 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.656 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 88' ' ' SER . . . . . 0.61 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.78 -1.05 0.5 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.377 -1.329 . . . . 0.0 109.954 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . 0.744 ' O ' ' N ' ' R' ' 91' ' ' ALA . 0.3 OUTLIER 27.59 33.37 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.172 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' R' ' 88' ' ' SER . 5.1 tptp 21.52 25.85 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 CA-C-N 114.249 -1.341 . . . . 0.0 113.404 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . 0.744 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -79.9 -20.65 45.33 Favored 'General case' 0 C--N 1.286 -2.171 0 C-N-CA 117.133 -1.827 . . . . 0.0 111.03 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.12 161.02 18.21 Favored Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.93 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -58.31 168.48 3.76 Favored 'Trans proline' 0 C--N 1.323 -0.8 0 C-N-CA 121.543 1.495 . . . . 0.0 111.525 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 12.5 t -91.46 -24.03 5.66 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.532 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.26 -9.23 38.56 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.515 -0.874 . . . . 0.0 110.996 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.33 -47.65 72.83 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.806 -0.758 . . . . 0.0 111.463 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -31.55 68.48 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.229 -0.989 . . . . 0.0 111.157 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -73.99 -19.69 60.57 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.206 -0.998 . . . . 0.0 111.298 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . 0.401 ' O ' ' C ' ' R' ' 100' ' ' LEU . 1.8 t90 -96.14 -70.22 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.311 -0.955 . . . . 0.0 112.629 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.586 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.1 mm? -36.6 -52.35 0.87 Allowed 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.586 ' C ' ' O ' ' R' ' 100' ' ' LEU . 47.9 mt-10 -33.85 -42.06 0.11 Allowed 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.087 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' R' ' 100' ' ' LEU . 0.4 OUTLIER -85.17 -29.74 24.51 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 113.455 -1.702 . . . . 0.0 112.874 -179.949 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . 0.53 ' N ' ' O ' ' R' ' 100' ' ' LEU . 4.7 t -80.79 -35.97 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 116.603 -2.039 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.37 -58.38 3.8 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 4.7 mt -47.51 -70.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 118.642 -1.223 . . . . 0.0 111.533 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? . . . . . 0 N--CA 1.489 1.513 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.993 -179.917 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.987 0.422 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . 0.451 ' O ' ' CG ' ' S' ' 16' ' ' HIS . 58.1 t-80 -142.68 12.69 1.9 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.926 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.449 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.3 mt-30 -88.94 -83.92 0.22 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.928 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' S' ' 17' ' ' GLN . 24.5 mt-10 -43.58 -32.74 1.0 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . 0.449 ' N ' ' C ' ' S' ' 17' ' ' GLN . 65.2 t-105 -48.5 -56.33 8.59 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 112.881 -1.963 . . . . 0.0 109.65 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.48 -35.9 42.05 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 113.693 -1.594 . . . . 0.0 111.679 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.559 ' O ' ' C ' ' S' ' 22' ' ' PHE . 50.4 mtt-85 -63.35 -73.24 0.12 Allowed 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.566 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.559 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.5 t80 -24.92 -50.68 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.643 0.735 . . . . 0.0 111.34 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . 0.414 ' O ' ' C ' ' S' ' 24' ' ' ASP . 24.8 t -70.56 -46.78 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.787 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' S' ' 21' ' ' ARG . 16.8 t0 -36.64 -62.95 0.44 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.919 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.0 -49.88 70.7 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 118.658 -1.217 . . . . 0.0 110.391 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -40.1 -63.27 0.63 Allowed 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.879 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -57.04 6.39 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.404 -0.918 . . . . 0.0 112.606 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -64.36 -16.84 63.02 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.099 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' S' ' 31' ' ' GLN . . . -90.36 -47.9 7.46 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 118.933 -1.107 . . . . 0.0 112.491 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . 0.413 ' C ' ' O ' ' S' ' 29' ' ' ALA . 0.4 OUTLIER -40.19 -26.8 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.376 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.3 tt0 -75.71 -37.93 59.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.384 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 18.1 t-20 -95.1 -8.33 36.85 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.6 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.5 t0 84.71 23.05 0.1 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 123.626 0.579 . . . . 0.0 110.794 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.88 -16.46 31.88 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.025 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . 0.414 ' N ' ' HB2' ' S' ' 29' ' ' ALA . 26.4 p-80 -54.95 -25.3 28.6 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 113.97 -1.468 . . . . 0.0 113.018 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 5.6 mt -70.75 -63.34 1.63 Allowed Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.417 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.7 Cg_endo -54.61 -36.54 89.6 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 C-N-CA 120.636 0.89 . . . . 0.0 111.57 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . 0.511 ' O ' ' SD ' ' S' ' 42' ' ' MET . 19.7 mt -74.8 -37.52 62.33 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.656 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.07 -38.31 62.4 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.384 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -76.27 7.62 4.12 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.95 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.57 -55.62 2.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.724 -0.79 . . . . 0.0 112.457 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 42' ' ' MET . . . . . 0.561 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -78.67 6.38 8.96 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 118.496 -1.282 . . . . 0.0 111.474 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 68.6 mt -127.38 -175.62 3.5 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.519 ' CB ' ' CD ' ' S' ' 45' ' ' PRO 0.299 0.3 OUTLIER -129.23 -147.34 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.364 0 C-N-CA 118.681 -1.207 . . . . 0.0 109.51 -179.91 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.519 ' CD ' ' CB ' ' S' ' 44' ' ' THR . 8.0 Cg_endo -96.55 -42.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.218 -0.492 0 CA-C-N 120.147 1.088 . . . . 0.0 110.566 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -52.27 -29.94 25.48 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.891 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -59.92 -54.21 48.8 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.645 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.1 -39.82 60.37 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.471 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . 0.431 ' O ' ' OG1' ' S' ' 53' ' ' THR . 85.6 mt-10 -82.34 -68.65 0.68 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.831 -1.148 . . . . 0.0 112.49 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -49.68 -50.01 45.25 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . 0.449 ' C ' ' CD1' ' S' ' 51' ' ' LEU . 0.4 OUTLIER -60.08 -40.97 91.43 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 118.155 -1.418 . . . . 0.0 110.7 -179.947 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . 0.463 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -61.4 -30.96 75.65 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.518 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -65.16 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 114.748 -0.726 . . . . 0.0 110.733 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -41.35 -24.11 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . 0.485 ' N ' ' O ' ' S' ' 53' ' ' THR . 12.9 t -71.42 -44.28 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 117.957 -1.497 . . . . 0.0 107.627 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.3 OUTLIER -59.55 -48.65 80.81 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.997 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 mt -57.44 -63.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.968 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 79.5 t -46.5 -59.92 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 C-N-CA 118.243 -1.383 . . . . 0.0 111.467 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -61.02 -18.8 59.75 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.502 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -79.95 -39.38 30.32 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.657 -1.217 . . . . 0.0 111.002 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.15 -29.7 64.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.95 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.97 -66.59 0.36 Allowed 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 118.981 -1.088 . . . . 0.0 109.719 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.305 -1.366 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . 0.43 ' CG ' ' H ' ' S' ' 73' ' ' ASN . 1.1 tptm . . . . . 0 N--CA 1.497 1.877 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' S' ' 77' ' ' ALA . 14.4 t-20 -107.74 6.51 27.69 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.319 -0.952 . . . . 0.0 112.281 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . 0.482 ' C ' ' O ' ' S' ' 73' ' ' ASN . 1.4 mt-10 -44.99 -44.67 10.09 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 tp -145.0 21.4 1.59 Allowed 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.929 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -129.94 -100.02 0.9 Allowed Glycine 0 N--CA 1.499 2.841 0 C-N-CA 118.829 -1.653 . . . . 0.0 112.96 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . 0.52 ' O ' ' ND2' ' S' ' 73' ' ' ASN . . . -147.29 -59.34 0.27 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.202 -0.999 . . . . 0.0 112.688 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 179.24 161.06 26.09 Favored Glycine 0 N--CA 1.491 2.331 0 C-N-CA 118.666 -1.731 . . . . 0.0 111.593 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.491 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.1 OUTLIER -59.73 -28.69 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 115.093 -0.554 . . . . 0.0 111.249 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.448 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.38 -55.29 16.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.508 -0.877 . . . . 0.0 113.248 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 80.9 p -46.52 -51.61 15.03 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 7.3 pt -70.81 11.47 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 C-N-CA 119.165 -1.014 . . . . 0.0 113.304 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -120.9 -46.48 2.34 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.062 179.89 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . 0.501 ' C ' ' H ' ' S' ' 86' ' ' SER . 3.0 ptm180 -63.89 -23.02 67.19 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.974 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.55 -4.9 1.54 Allowed Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.217 -1.468 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 86' ' ' SER . . . . . 0.501 ' H ' ' C ' ' S' ' 84' ' ' ARG . 1.0 OUTLIER -157.24 -12.92 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.542 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -92.91 -22.6 19.14 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.72 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.414 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.4 OUTLIER -75.85 -37.51 58.91 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.58 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' S' ' 88' ' ' SER . 26.4 mt -37.62 -43.7 0.64 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 120.229 -0.589 . . . . 0.0 111.844 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -42.66 -64.3 0.64 Allowed 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.47 15.69 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.825 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.28 164.84 4.38 Favored Pre-proline 0 N--CA 1.489 1.492 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.035 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -45.55 133.39 12.99 Favored 'Trans proline' 0 C--N 1.321 -0.913 0 C-N-CA 121.871 1.714 . . . . 0.0 112.49 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 4.1 t -108.92 -5.25 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.251 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.94 -7.16 1.58 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.932 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 2.7 mt -75.8 -32.96 60.1 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.716 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -37.47 72.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.456 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -72.47 -30.47 64.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.051 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 16.7 t90 -88.2 -61.77 1.64 Allowed 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.526 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.3 OUTLIER -52.36 -32.61 39.23 Favored 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 115.435 1.642 . . . . 0.0 115.435 -179.64 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' S' ' 100' ' ' LEU . 0.4 OUTLIER -43.78 -27.95 0.38 Allowed 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 117.751 -1.58 . . . . 0.0 106.953 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.526 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.8 mt-10 -94.98 -28.24 15.24 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.122 -1.853 . . . . 0.0 112.942 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . . . . . . . . . 2.1 t -77.65 -28.65 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 114.893 -2.723 . . . . 0.0 108.322 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.66 -56.82 4.32 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.458 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 6.5 mt -60.78 -69.42 0.23 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.709 -1.196 . . . . 0.0 110.957 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' S' ' 107' ' ' SER . 1.7 ttmm -96.86 162.38 13.44 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.406 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' S' S ' 107' ' ' SER . . . . . 0.466 ' N ' ' CG ' ' S' ' 106' ' ' LYS . 81.8 p . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 116.243 -1.837 . . . . 0.0 110.844 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.296 0.57 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -157.1 -4.74 0.1 Allowed 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.076 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -91.42 -85.56 0.23 Allowed 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.231 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . 0.436 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.5 OUTLIER -45.52 -33.96 3.02 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 123.106 1.431 . . . . 0.0 107.66 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -52.71 -58.55 6.46 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 112.925 -1.943 . . . . 0.0 108.175 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.68 -28.66 65.96 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.695 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.535 ' O ' ' C ' ' R' ' 22' ' ' PHE . 10.4 mmt-85 -56.3 -68.02 0.25 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 117.885 -1.526 . . . . 0.0 110.144 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.535 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -33.3 -40.09 0.06 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.049 179.613 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . 0.428 ' N ' ' O ' ' R' ' 21' ' ' ARG . 14.9 t -72.05 -47.47 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 C-N-CA 119.469 -0.893 . . . . 0.0 110.44 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' R' ' 21' ' ' ARG . 36.0 t70 -45.5 -21.34 0.09 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.241 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 -43.37 6.36 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.994 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 tt -47.74 -38.0 14.46 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.325 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttp -76.64 -38.55 54.46 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -82.88 -2.2 54.17 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.113 -1.035 . . . . 0.0 113.63 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.47 -30.97 6.06 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.144 -1.022 . . . . 0.0 113.426 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -44.01 -38.95 3.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.111 -1.035 . . . . 0.0 112.164 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.76 -29.71 58.9 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.524 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.5 m-20 -87.86 -11.32 48.14 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 118.981 -1.088 . . . . 0.0 111.377 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 2.5 t70 81.19 24.69 0.27 Allowed 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.773 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -95.7 -22.15 17.73 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.821 0.82 . . . . 0.0 109.828 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -52.82 -18.26 1.79 Allowed 'General case' 0 C--N 1.295 -1.804 0 CA-C-N 114.227 -1.352 . . . . 0.0 113.068 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.474 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.5 mt -78.82 -65.69 0.31 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 118.503 -1.279 . . . . 0.0 111.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.474 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.1 Cg_endo -50.93 -28.13 23.0 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 120.541 0.828 . . . . 0.0 110.227 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 7.2 mt -82.54 -34.83 27.72 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 119.354 -0.939 . . . . 0.0 111.482 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -26.36 62.58 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.775 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.87 15.28 8.67 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 118.825 -1.15 . . . . 0.0 109.204 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . 0.494 ' C ' ' H ' ' R' ' 43' ' ' LEU . 1.8 tp -114.2 -63.6 1.43 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.376 -0.829 . . . . 0.0 113.007 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.6 OUTLIER -62.56 7.46 0.07 Allowed 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 117.443 -1.703 . . . . 0.0 112.253 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' R' ' 41' ' ' LEU . 2.3 pp -150.95 -177.25 5.9 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.389 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.533 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.312 0.3 OUTLIER -119.04 -150.82 0.01 OUTLIER Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.327 -179.846 . . . . . . . . 4 4 . 1 . 005 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 9.6 Cg_endo -93.37 -42.69 0.03 OUTLIER 'Trans proline' 0 C--O 1.213 -0.745 0 CA-C-N 119.228 0.76 . . . . 0.0 110.614 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.35 -21.98 6.64 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.391 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . 0.425 ' HG3' ' H ' ' R' ' 44' ' ' THR . 2.3 mt-10 -76.71 -41.89 43.48 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.018 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -62.63 -30.43 71.35 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.63 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -73.6 -62.97 1.3 Allowed 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.915 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.473 ' C ' HH21 ' R' ' 54' ' ' ARG . . . -52.73 -31.37 37.52 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.574 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.0 mt -56.36 -61.27 2.52 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.97 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.28 -53.37 9.47 Favored Glycine 0 N--CA 1.484 1.843 0 C-N-CA 119.119 -1.515 . . . . 0.0 110.009 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -39.71 -80.1 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.559 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . 0.473 HH21 ' C ' ' R' ' 50' ' ' ALA . 20.7 mtt180 -38.11 -53.74 1.39 Allowed 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.51 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 5.8 t -63.21 -31.18 51.77 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.75 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.95 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -78.67 -33.59 46.94 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.161 -1.416 . . . . 0.0 111.468 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.441 ' CD1' ' C ' ' R' ' 57' ' ' ILE . 0.0 OUTLIER -82.67 -34.99 12.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 117.754 -1.578 . . . . 0.0 108.264 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.414 ' N ' HD11 ' R' ' 57' ' ' ILE . 2.6 t -59.61 -53.49 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.419 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -58.65 -46.84 86.26 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.012 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -48.36 -31.1 5.65 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.768 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 96.3 mt -96.92 -24.68 15.73 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.189 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.489 1.524 0 C-N-CA 119.365 -0.934 . . . . 0.0 111.484 -179.991 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.763 0.315 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -178.66 155.46 16.52 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 119.221 -1.466 . . . . 0.0 110.723 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.49 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.1 OUTLIER -46.74 -47.67 7.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.466 -179.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.423 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -59.83 -62.15 2.09 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 118.768 -1.173 . . . . 0.0 110.637 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 43.9 m -39.23 -47.76 1.7 Allowed 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 pt -77.32 -13.11 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.524 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -87.72 -58.94 2.39 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.607 -1.237 . . . . 0.0 112.099 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.92 6.6 0.35 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.362 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . 0.524 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -102.51 -33.82 4.35 Favored Glycine 0 N--CA 1.492 2.378 0 C-N-CA 119.69 -1.243 . . . . 0.0 110.412 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 1.5 t -83.07 -30.59 27.9 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.477 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -93.63 8.42 40.94 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.956 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.41 -27.26 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.29 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 90.2 mt -44.11 -28.09 0.46 Allowed 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.202 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . 0.409 ' O ' ' C ' ' R' ' 91' ' ' ALA . 18.3 mttt -80.9 -71.45 0.47 Allowed 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.309 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -36.72 -63.18 0.43 Allowed 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.163 -1.38 . . . . 0.0 111.959 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -40.72 109.06 0.59 Allowed Pre-proline 0 N--CA 1.488 1.438 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.915 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -55.92 156.41 19.68 Favored 'Trans proline' 0 C--O 1.215 -0.629 0 C-N-CA 120.667 0.911 . . . . 0.0 111.83 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.5 -41.41 90.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.38 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -66.44 -27.93 68.2 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.803 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -39.05 83.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.545 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -27.83 63.39 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.467 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.31 -22.37 57.74 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.104 -1.039 . . . . 0.0 109.96 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 2.9 t90 -95.56 -66.48 0.91 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.909 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.509 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.2 mm? -41.16 -38.01 1.0 Allowed 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.509 ' C ' ' O ' ' R' ' 100' ' ' LEU . 7.3 mt-10 -41.31 -39.16 1.33 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 117.874 -1.53 . . . . 0.0 107.702 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . 0.403 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.1 mt-10 -90.01 -27.63 19.63 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 113.428 -1.715 . . . . 0.0 112.427 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.05 -7.94 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 117.361 -1.736 . . . . 0.0 110.746 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 8.6 tp -97.93 -54.03 3.21 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.507 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -69.28 -68.3 0.41 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 118.76 -1.176 . . . . 0.0 110.765 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 2.7 tttp . . . . . 0 N--CA 1.487 1.376 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.91 -179.967 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.963 0.411 . . . . 0.0 110.392 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.23 -25.17 0.06 Allowed 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.326 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.429 ' O ' ' C ' ' S' ' 18' ' ' GLU . 0.3 OUTLIER -85.53 -69.57 0.65 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.693 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.429 ' C ' ' O ' ' S' ' 17' ' ' GLN . 3.3 mp0 -43.55 -41.39 4.47 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 123.133 1.444 . . . . 0.0 107.862 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.265 42.3 t-105 -52.73 -53.72 43.79 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 111.958 -2.383 . . . . 0.0 108.899 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.11 -37.54 72.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 113.8 -1.545 . . . . 0.0 110.759 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.507 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.6 mmt180 -51.0 -70.75 0.08 Allowed 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 118.283 -1.367 . . . . 0.0 109.28 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.507 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.53 -42.93 0.06 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.333 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 3.6 t -81.6 -33.15 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.119 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.498 ' N ' ' O ' ' S' ' 21' ' ' ARG . 55.6 t0 -53.42 -34.64 58.58 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 120.075 -0.65 . . . . 0.0 112.273 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.96 -44.55 7.65 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.664 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.01 -49.5 11.27 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.298 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.95 -71.18 0.07 Allowed 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.37 -0.932 . . . . 0.0 112.743 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.19 -5.86 1.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.791 -0.764 . . . . 0.0 113.054 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.55 -46.16 7.09 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.712 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -45.71 -52.5 10.84 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.618 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -42.0 -30.72 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.849 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.43 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 56.5 m-20 -99.5 -84.72 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 119.625 -0.83 . . . . 0.0 110.658 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.43 ' OD2' ' O ' ' S' ' 32' ' ' ASN . 0.5 OUTLIER 170.95 23.43 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 119.253 -0.979 . . . . 0.0 112.151 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . 0.583 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 1.3 mm? -94.43 -14.63 25.03 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.0 -1.08 . . . . 0.0 109.856 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 38.4 p-80 -48.76 -28.56 3.72 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.735 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.453 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.8 mt -72.74 -63.33 1.14 Allowed Pre-proline 0 C--N 1.303 -1.439 0 C-N-CA 118.285 -1.366 . . . . 0.0 111.419 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -52.28 -21.62 13.75 Favored 'Trans proline' 0 C--N 1.321 -0.882 0 C-N-CA 121.088 1.192 . . . . 0.0 111.376 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 23.5 mt -86.12 -44.51 12.18 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.9 OUTLIER -49.39 -45.55 46.25 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.12 -1.032 . . . . 0.0 109.858 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -4.0 0.89 Allowed 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.618 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 mp -103.66 -59.25 1.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.091 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 42' ' ' MET . . . . . 0.48 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -95.64 22.66 6.9 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.586 -179.805 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.1 OUTLIER -169.39 123.85 0.81 Allowed 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.52 ' N ' ' CD ' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.75 -41.54 0.0 OUTLIER Pre-proline 0 N--CA 1.484 1.261 0 C-N-CA 117.084 -1.846 . . . . 0.0 114.855 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.52 ' CD ' ' N ' ' S' ' 44' ' ' THR . 19.1 Cg_endo -79.43 -109.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 121.12 1.213 . . . . 0.0 113.196 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -50.66 -12.8 0.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.488 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . 0.489 ' H ' ' C ' ' S' ' 45' ' ' PRO . 8.9 mm-40 -75.94 -71.82 0.36 Allowed 'General case' 0 C--N 1.297 -1.676 0 C-N-CA 119.544 -0.862 . . . . 0.0 110.582 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -49.55 -15.43 0.16 Allowed 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.894 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' C ' ' S' ' 47' ' ' GLU . 9.8 mm-40 -91.45 -69.11 0.75 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.433 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.04 -27.69 69.28 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.211 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.54 -63.59 1.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.629 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . 0.436 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -45.72 -48.15 13.05 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.013 -1.635 . . . . 0.0 109.013 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.509 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -45.43 -74.54 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.616 0.722 . . . . 0.0 111.86 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . 0.438 HH21 HD21 ' R' ' 41' ' ' LEU . 0.0 OUTLIER -35.24 -58.99 0.54 Allowed 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.71 -1.132 . . . . 0.0 112.873 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 16.1 t -59.62 -25.28 31.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 C-N-CA 117.465 -1.694 . . . . 0.0 110.971 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -79.3 -38.72 34.63 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.296 -1.362 . . . . 0.0 111.443 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . 0.444 ' CD1' ' C ' ' S' ' 57' ' ' ILE . 0.0 OUTLIER -79.08 -34.65 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 117.801 -1.56 . . . . 0.0 108.827 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . 0.401 ' N ' HD11 ' S' ' 57' ' ' ILE . 78.1 t -68.68 -63.11 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.183 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -50.19 -31.14 13.02 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.412 -1.315 . . . . 0.0 110.193 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . 0.415 ' CG ' ' O ' ' S' ' 56' ' ' ARG . 7.7 mm-40 -62.12 -62.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.551 -0.86 . . . . 0.0 112.089 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . 0.53 ' C ' ' H ' ' S' ' 63' ' ' ARG . 4.6 pp -62.45 -8.63 6.46 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 117.738 -1.585 . . . . 0.0 109.716 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . 0.421 ' O ' ' C ' ' S' ' 63' ' ' ARG . 2.3 tp -79.97 33.02 0.27 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.717 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . 0.53 ' H ' ' C ' ' S' ' 61' ' ' LEU . 19.7 mtm180 . . . . . 0 N--CA 1.499 1.979 0 O-C-N 124.555 1.16 . . . . 0.0 113.736 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.492 0 CA-C-O 121.108 0.48 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -99.2 -103.13 0.22 Allowed 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.83 0.824 . . . . 0.0 110.839 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -140.61 -56.97 0.52 Allowed 'General case' 0 C--N 1.283 -2.3 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.139 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 tp -121.01 13.37 11.32 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.25 -55.83 27.98 Favored Glycine 0 N--CA 1.492 2.416 0 C-N-CA 119.816 -1.183 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -163.71 -68.98 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.984 -1.087 . . . . 0.0 111.225 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . 149.38 131.18 1.93 Allowed Glycine 0 N--CA 1.488 2.134 0 C-N-CA 119.372 -1.394 . . . . 0.0 110.371 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.458 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.78 -36.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.237 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.91 -44.26 73.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.583 -0.847 . . . . 0.0 112.314 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 81' ' ' THR . . . . . 0.479 ' HG1' ' N ' ' S' ' 82' ' ' ILE . 25.3 p -62.54 -40.9 98.29 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . 0.479 ' N ' ' HG1' ' S' ' 81' ' ' THR . 23.0 pt -73.35 -15.07 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 119.344 -0.943 . . . . 0.0 112.758 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.444 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -81.51 -57.21 3.57 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.492 -1.283 . . . . 0.0 111.391 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -68.68 -4.55 16.11 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.008 -1.077 . . . . 0.0 110.747 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.86 -25.55 60.0 Favored Glycine 0 N--CA 1.488 2.104 0 C-N-CA 119.321 -1.418 . . . . 0.0 110.124 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 86' ' ' SER . . . . . 0.424 ' C ' ' H ' ' S' ' 88' ' ' SER . 41.8 p -105.94 -34.91 7.46 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.657 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' S' ' 89' ' ' LEU . 24.3 m120 -77.0 12.99 1.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.909 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.424 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.6 OUTLIER -38.71 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.294 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' S' ' 87' ' ' ASN . 1.0 OUTLIER -42.02 -66.37 0.36 Allowed 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.646 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.49 -62.09 1.78 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.687 -1.205 . . . . 0.0 111.669 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.35 -70.85 0.09 Allowed 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.168 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.64 148.54 90.19 Favored Pre-proline 0 N--CA 1.489 1.498 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.908 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -55.0 159.54 9.38 Favored 'Trans proline' 0 C--N 1.325 -0.667 0 C-N-CA 121.066 1.177 . . . . 0.0 110.996 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -83.24 -32.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.917 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -67.46 -20.95 65.55 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.648 -0.821 . . . . 0.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 1.2 tp -62.02 -36.35 81.29 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.576 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -16.29 38.75 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.256 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -101.49 -35.47 9.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.234 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 19.6 t90 -66.6 -62.29 1.53 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.911 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.529 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -57.07 -32.57 66.39 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -179.711 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.529 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.9 mm-40 -42.77 -29.65 0.33 Allowed 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 117.692 -1.603 . . . . 0.0 106.746 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.528 ' N ' ' C ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -94.99 -26.41 16.11 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.987 -1.915 . . . . 0.0 112.157 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . 0.471 ' N ' ' O ' ' S' ' 100' ' ' LEU . 14.0 t -83.28 -14.83 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 C-N-CA 115.964 -2.294 . . . . 0.0 108.102 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 19.9 tp -83.56 -53.48 5.64 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.203 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 86.4 mt -77.8 -80.03 0.11 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' S' ' 102' ' ' GLU . 16.2 mtpt -95.51 -160.05 0.76 Allowed 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.166 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' S' S ' 107' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' S' ' 102' ' ' GLU . 65.5 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 116.445 -1.74 . . . . 0.0 111.533 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 120.894 0.378 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . 0.464 ' O ' ' CG ' ' R' ' 16' ' ' HIS . 22.1 t-80 -111.62 6.74 20.18 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.6 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' R' ' 18' ' ' GLU . 1.0 OUTLIER -91.05 -80.19 0.35 Allowed 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.358 -0.937 . . . . 0.0 111.36 -179.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.0 OUTLIER -44.33 -35.06 2.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 123.231 1.491 . . . . 0.0 107.824 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -52.69 -61.34 2.35 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 112.33 -2.214 . . . . 0.0 109.16 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -47.11 -44.4 21.37 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.459 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 1.0 OUTLIER -47.77 -73.1 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 118.645 -1.222 . . . . 0.0 109.639 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -25.45 -47.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.156 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . 0.435 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.5 t -71.14 -53.32 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 118.956 -1.097 . . . . 0.0 111.478 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 32.9 t0 -35.68 -65.19 0.26 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.647 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.11 -48.43 70.75 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.13 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.37 -46.44 62.76 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.545 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -61.6 -45.0 95.96 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 -74.73 -36.02 62.66 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.25 -29.26 66.02 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.622 -1.231 . . . . 0.0 113.077 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . 0.429 ' CD2' ' N ' ' R' ' 31' ' ' GLN . 23.7 t80 -42.01 -60.25 1.48 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.005 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . 0.429 ' N ' ' CD2' ' R' ' 30' ' ' TYR . 1.8 tt0 -60.43 -28.84 68.6 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.084 -1.046 . . . . 0.0 110.703 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . 0.436 ' OD1' ' NE1' ' S' ' 99' ' ' TRP . 0.2 OUTLIER -80.78 -15.86 55.32 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.534 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 74.15 23.98 2.02 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.949 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . 0.413 ' N ' HD21 ' R' ' 34' ' ' LEU . 0.7 OUTLIER -100.82 -10.52 20.65 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 114.724 -1.125 . . . . 0.0 108.712 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -53.77 -15.57 1.33 Allowed 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.225 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -77.75 -65.4 0.36 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 117.544 -1.663 . . . . 0.0 110.662 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.8 Cg_exo -50.19 -31.76 29.99 Favored 'Trans proline' 0 C--N 1.321 -0.889 0 N-CA-C 109.686 -0.929 . . . . 0.0 109.686 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 5.6 mt -73.39 -40.41 64.35 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.443 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.01 -22.5 62.68 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.205 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -91.53 11.48 23.98 Favored 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.513 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.19 -64.22 1.35 Allowed 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.933 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 42' ' ' MET . . . . . 0.489 ' SD ' ' O ' ' R' ' 22' ' ' PHE . 3.4 ptp -73.71 8.96 1.62 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 117.369 -1.732 . . . . 0.0 112.246 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 65.5 mt -128.77 -174.07 3.15 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.523 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.306 0.3 OUTLIER -134.97 -145.12 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 119.093 -1.043 . . . . 0.0 109.305 179.908 . . . . . . . . 4 4 . 1 . 006 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 10.2 Cg_endo -98.62 -43.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.554 0 CA-C-N 120.614 1.255 . . . . 0.0 111.16 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.53 -27.45 38.51 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.208 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -61.56 -49.8 75.19 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.983 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.98 -34.72 66.01 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.927 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -75.56 -71.46 0.37 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.127 -1.029 . . . . 0.0 112.521 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.445 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.88 -46.49 51.7 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.304 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 tt -52.68 -45.09 66.65 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.776 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.74 -42.04 97.79 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 118.91 -1.614 . . . . 0.0 109.302 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.5 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.3 OUTLIER -49.55 -78.91 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.835 -0.682 . . . . 0.0 112.022 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.1 -37.06 0.8 Allowed 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.088 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 33.3 t -72.31 -34.24 48.55 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.593 -1.243 . . . . 0.0 110.227 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.1 OUTLIER -73.42 -38.31 65.6 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.553 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.511 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -77.19 -39.86 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 117.577 -1.649 . . . . 0.0 109.631 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.511 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 4.2 t -63.21 -68.76 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 117.438 -1.705 . . . . 0.0 109.325 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -43.16 -36.27 1.65 Allowed 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.956 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -65.67 -54.32 29.07 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 118.971 -1.091 . . . . 0.0 112.109 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 34.7 mt -78.88 -6.31 55.8 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.439 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 5.1 tp . . . . . 0 N--CA 1.491 1.617 0 C-N-CA 119.621 -0.831 . . . . 0.0 110.981 -179.948 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.912 0.387 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.16 131.99 2.08 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 119.43 -1.367 . . . . 0.0 110.295 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.449 ' O ' ' OG1' ' R' ' 83' ' ' THR . 0.1 OUTLIER -45.34 -44.54 3.62 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.258 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.41 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -64.9 -62.95 1.25 Allowed 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 118.797 -1.161 . . . . 0.0 109.678 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 23.0 m -33.85 -49.23 0.32 Allowed 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.938 -1.028 . . . . 0.0 113.092 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 30.3 pt -73.73 -34.85 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 119.006 -1.078 . . . . 0.0 113.014 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.529 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.1 OUTLIER -55.55 -67.42 0.28 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.715 -1.194 . . . . 0.0 110.83 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -6.62 1.0 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.889 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -70.5 -48.42 36.7 Favored Glycine 0 N--CA 1.489 2.184 0 C-N-CA 119.414 -1.375 . . . . 0.0 110.3 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.68 -7.53 54.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.718 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.2 OUTLIER -109.89 12.91 23.69 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.99 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -41.36 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.767 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . 0.468 ' N ' ' O ' ' R' ' 87' ' ' ASN . 4.2 mt -50.85 -33.82 25.42 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.737 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.39 -19.26 18.59 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.264 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.46 -62.81 1.42 Allowed 'General case' 0 C--N 1.291 -1.942 0 C-N-CA 118.976 -1.09 . . . . 0.0 112.31 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -99.95 164.98 15.42 Favored Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.305 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -58.83 171.87 1.86 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 C-N-CA 121.465 1.443 . . . . 0.0 111.611 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 75.3 t -82.11 -8.91 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 119.386 -0.926 . . . . 0.0 110.787 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -65.37 -30.36 71.18 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.598 -0.841 . . . . 0.0 111.049 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -44.09 97.02 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.718 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.53 -44.89 26.16 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.17 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -73.03 -24.22 60.7 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.348 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -92.04 -66.19 0.95 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.158 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.456 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.1 mm? -43.17 -28.07 0.27 Allowed 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 118.729 -1.188 . . . . 0.0 112.865 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.456 ' C ' ' O ' ' R' ' 100' ' ' LEU . 3.5 mt-10 -46.98 -38.81 11.31 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 117.491 -1.684 . . . . 0.0 106.823 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -90.67 -30.9 16.85 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.908 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.88 -12.37 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 C-N-CA 117.331 -1.747 . . . . 0.0 111.224 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 18.8 tp -96.98 -55.3 2.91 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.625 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . 0.456 ' CD2' ' N ' ' R' ' 105' ' ' LEU . 4.0 mm? -72.49 -74.55 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.923 -1.111 . . . . 0.0 111.32 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 11.0 ttpt . . . . . 0 N--CA 1.486 1.35 0 C-N-CA 119.513 -0.875 . . . . 0.0 110.955 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 121.308 0.575 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . 0.412 ' H ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER -171.34 -4.07 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' S' ' 18' ' ' GLU . 8.7 tt0 -82.01 -86.01 0.1 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.051 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' S' ' 17' ' ' GLN . 1.0 OUTLIER -40.43 -34.83 0.37 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 122.648 1.213 . . . . 0.0 109.156 179.789 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -51.26 -60.91 2.61 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.041 -1.891 . . . . 0.0 110.457 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.32 -31.97 35.75 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.645 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.506 ' O ' ' C ' ' S' ' 22' ' ' PHE . 11.7 mmm-85 -59.68 -71.56 0.12 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.506 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.1 t80 -32.74 -50.47 0.26 Allowed 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 119.341 -0.944 . . . . 0.0 111.096 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.31 -44.81 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.427 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.419 ' O ' ' C ' ' S' ' 25' ' ' LEU . 25.7 t0 -48.14 -75.88 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.651 -0.82 . . . . 0.0 111.609 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . 0.419 ' C ' ' O ' ' S' ' 24' ' ' ASP . 1.2 mt -39.91 -44.78 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.756 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.41 -57.39 11.49 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.01 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.75 -49.86 0.8 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -85.59 -32.62 21.99 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 118.922 -1.111 . . . . 0.0 113.355 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.75 -39.85 88.08 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.072 -1.051 . . . . 0.0 112.541 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -58.21 -38.32 76.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.93 -1.108 . . . . 0.0 112.028 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.0 -21.79 4.89 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 118.712 -1.195 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.46 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 35.3 m120 -111.57 -76.27 0.6 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.829 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.0 OUTLIER 172.06 1.28 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 118.644 -1.222 . . . . 0.0 113.02 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . 0.64 ' CD2' ' H ' ' S' ' 34' ' ' LEU . 0.9 OUTLIER -75.01 -18.51 60.35 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.609 -0.836 . . . . 0.0 111.558 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -51.12 -22.68 2.63 Favored 'General case' 0 C--N 1.293 -1.866 0 C-N-CA 119.494 -0.882 . . . . 0.0 112.746 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.467 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.4 mt -73.35 -64.03 0.89 Allowed Pre-proline 0 N--CA 1.486 1.338 0 C-N-CA 118.327 -1.349 . . . . 0.0 110.234 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.467 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -53.45 -32.73 64.09 Favored 'Trans proline' 0 C--N 1.322 -0.864 0 C-N-CA 120.769 0.979 . . . . 0.0 110.455 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 21.8 mt -74.12 -39.7 63.17 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.19 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . 0.508 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -52.97 -44.2 66.98 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.332 179.802 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.1 OUTLIER -66.94 -0.92 3.44 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.536 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 tp -105.32 -67.36 0.92 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.623 -0.831 . . . . 0.0 112.964 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 42' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 2.0 mmm -91.04 47.6 1.42 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 118.761 -1.175 . . . . 0.0 111.624 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . 0.508 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.3 OUTLIER 160.72 125.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.532 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -179.33 -41.86 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.376 0 C-N-CA 116.507 -2.077 . . . . 0.0 115.794 -179.694 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.532 ' HD2' ' H ' ' S' ' 44' ' ' THR . 5.5 Cg_endo -65.71 -110.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 120.713 0.942 . . . . 0.0 113.343 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . 0.404 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 0.2 OUTLIER -54.91 -12.14 0.76 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 119.029 -1.068 . . . . 0.0 110.361 -179.735 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . 0.429 ' H ' ' C ' ' S' ' 45' ' ' PRO . 6.4 mm-40 -68.17 -64.39 0.87 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.607 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -57.82 -33.45 68.62 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.255 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -70.41 -63.12 1.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.21 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.09 -37.52 83.01 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.336 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 mt -46.74 -57.57 4.72 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 118.64 -1.224 . . . . 0.0 109.293 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' S' ' 53' ' ' THR . . . -52.2 -64.96 3.57 Favored Glycine 0 N--CA 1.484 1.852 0 N-CA-C 108.486 -1.846 . . . . 0.0 108.486 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.404 ' C ' ' O ' ' S' ' 52' ' ' GLY . 0.2 OUTLIER -34.85 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.641 0.734 . . . . 0.0 112.78 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . . . . . . . . . 8.1 ttp85 -51.57 -46.11 63.31 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.376 -1.284 . . . . 0.0 113.393 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 95.1 t -68.95 -19.08 23.61 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 C-N-CA 117.473 -1.691 . . . . 0.0 109.918 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.411 ' CD ' ' C ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -85.62 -37.06 19.93 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.542 -1.263 . . . . 0.0 110.804 -179.958 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . 0.428 HD11 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -74.54 -38.38 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 117.429 -1.708 . . . . 0.0 107.902 179.942 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . 0.428 ' N ' HD11 ' S' ' 57' ' ' ILE . 0.9 OUTLIER -60.43 -50.95 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 117.156 -1.817 . . . . 0.0 107.399 179.452 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -51.7 -31.88 27.82 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.092 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . 0.428 ' C ' ' H ' ' S' ' 62' ' ' LEU . 24.0 mm-40 -68.99 -57.58 5.28 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 118.98 -1.088 . . . . 0.0 112.178 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . 0.542 ' C ' ' H ' ' S' ' 63' ' ' ARG . 3.6 pp -61.43 -7.47 3.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.912 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . 0.449 ' O ' ' C ' ' S' ' 63' ' ' ARG . 7.0 tp -76.13 28.88 0.12 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 119.494 -0.882 . . . . 0.0 110.586 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . 0.542 ' H ' ' C ' ' S' ' 61' ' ' LEU . 3.9 mtm180 . . . . . 0 N--CA 1.5 2.075 0 O-C-N 124.361 1.038 . . . . 0.0 113.625 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.5 tttm . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.012 0.434 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -81.2 -102.93 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.76 0.79 . . . . 0.0 110.7 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -141.87 -65.63 0.42 Allowed 'General case' 0 C--N 1.279 -2.482 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.505 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 mp -82.42 5.96 18.76 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.684 -0.807 . . . . 0.0 109.162 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -68.87 -56.13 9.85 Favored Glycine 0 N--CA 1.488 2.106 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.196 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . 175.54 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.004 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 175.79 167.89 35.36 Favored Glycine 0 N--CA 1.493 2.443 0 C-N-CA 119.363 -1.399 . . . . 0.0 110.823 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.425 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.1 OUTLIER -62.77 -43.52 98.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.234 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -58.25 -53.83 53.82 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.234 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -43.14 -60.49 1.64 Allowed 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.786 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 15.8 pt -68.46 10.47 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -106.7 -45.42 4.22 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.982 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -32.79 62.82 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.785 -1.166 . . . . 0.0 111.489 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.27 -45.59 90.41 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 119.242 -1.456 . . . . 0.0 110.23 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.45 -29.48 69.62 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.169 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . 0.523 ' O ' ' N ' ' S' ' 89' ' ' LEU . 1.2 m-20 -100.8 15.91 26.83 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.6 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.406 ' C ' ' O ' ' S' ' 87' ' ' ASN . 0.5 OUTLIER -37.85 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 120.249 -0.581 . . . . 0.0 112.004 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . 0.523 ' N ' ' O ' ' S' ' 87' ' ' ASN . 11.8 mt -57.38 -54.65 44.42 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.392 -0.923 . . . . 0.0 111.298 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -94.83 -35.27 12.14 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.689 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.01 -49.12 72.31 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.602 -1.181 . . . . 0.0 112.498 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.53 163.74 40.54 Favored Pre-proline 0 N--CA 1.489 1.516 0 C-N-CA 119.164 -1.014 . . . . 0.0 111.598 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -53.67 175.96 0.1 Allowed 'Trans proline' 0 C--N 1.324 -0.732 0 C-N-CA 121.546 1.497 . . . . 0.0 111.429 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -108.55 -33.67 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.291 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.65 3.29 29.5 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.186 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -31.25 24.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.798 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.8 -23.05 67.21 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.014 -1.074 . . . . 0.0 110.259 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -78.07 -14.34 59.53 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.033 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . 0.436 ' NE1' ' OD1' ' R' ' 32' ' ' ASN . 21.4 t90 -107.36 -59.09 1.87 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.019 0.914 . . . . 0.0 111.513 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.524 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.7 OUTLIER -58.61 -34.04 70.69 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.517 ' C ' ' O ' ' S' ' 100' ' ' LEU . 5.0 mt-10 -43.3 -32.2 0.76 Allowed 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 117.29 -1.764 . . . . 0.0 106.571 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.524 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.7 mt-10 -89.97 -23.78 21.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 112.637 -2.074 . . . . 0.0 112.437 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' S' ' 100' ' ' LEU . 21.9 t -88.17 -22.73 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 C-N-CA 116.255 -2.178 . . . . 0.0 109.975 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 21.6 tp -81.29 -55.23 4.86 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.032 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mt -57.87 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 118.325 -1.35 . . . . 0.0 110.274 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' S' ' 102' ' ' GLU . 0.4 OUTLIER -112.07 -177.83 3.27 Favored 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.512 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 116.417 -1.754 . . . . 0.0 110.838 179.955 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 . . . . . 0 N--CA 1.483 1.222 0 CA-C-O 120.821 0.343 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -71.13 63.29 0.33 Allowed 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.057 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.51 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.2 mt-30 -115.12 -76.86 0.57 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -55.4 -17.93 5.88 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 123.55 1.643 . . . . 0.0 106.666 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . 0.51 ' N ' ' C ' ' R' ' 17' ' ' GLN . 63.0 t-105 -57.22 -61.67 2.3 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 111.421 -2.627 . . . . 0.0 109.666 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tp -50.04 -38.4 37.71 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.558 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.553 ' O ' ' N ' ' R' ' 24' ' ' ASP . 11.7 mtt-85 -54.28 -69.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.273 -1.371 . . . . 0.0 110.121 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.489 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.1 OUTLIER -35.39 -43.1 0.23 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 119.046 -1.061 . . . . 0.0 110.705 179.616 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 85.2 t -68.58 -38.44 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.437 -0.905 . . . . 0.0 110.093 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' R' ' 21' ' ' ARG . 27.6 t70 -48.55 -75.57 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.096 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.6 -45.21 9.39 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.857 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tt -42.39 -58.17 2.32 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.472 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . 0.536 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.5 OUTLIER -69.49 -61.66 1.7 Allowed 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.763 -0.775 . . . . 0.0 112.319 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -46.11 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . 0.536 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -114.16 -29.19 7.04 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 119.302 -0.959 . . . . 0.0 113.127 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -48.54 -41.6 30.85 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 118.875 -1.13 . . . . 0.0 111.31 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.29 -22.54 66.3 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.113 -1.035 . . . . 0.0 111.495 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . 0.529 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 22.1 t-20 -102.16 -10.98 19.15 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.83 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . 0.529 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 81.66 13.2 0.63 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 121.643 0.735 . . . . 0.0 110.195 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -86.91 -15.76 37.99 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.267 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . 0.416 ' HD1' ' N ' ' R' ' 35' ' ' HIS . 4.5 p-80 -52.25 -30.45 27.69 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 113.881 -1.508 . . . . 0.0 113.439 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.465 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 3.3 mt -66.64 -63.46 2.96 Favored Pre-proline 0 C--N 1.304 -1.401 0 C-N-CA 117.92 -1.512 . . . . 0.0 110.557 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.471 ' O ' ' ND2' ' R' ' 40' ' ' ASN . 3.5 Cg_exo -52.75 -27.79 35.44 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 C-N-CA 120.536 0.824 . . . . 0.0 110.556 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . 0.405 ' O ' ' SD ' ' R' ' 42' ' ' MET . 15.1 mt -84.49 -36.43 22.26 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.778 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . 0.481 ' C ' ' H ' ' R' ' 41' ' ' LEU . 0.0 OUTLIER -51.47 -57.45 9.0 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.761 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' R' ' 37' ' ' PRO . 0.1 OUTLIER -64.13 2.51 0.55 Allowed 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.049 -1.06 . . . . 0.0 111.113 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' R' ' 39' ' ' LEU . 3.7 tp -93.32 -64.11 1.13 Allowed 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.509 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 42' ' ' MET . . . . . 0.405 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.0 OUTLIER -79.53 12.57 2.43 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 117.431 -1.708 . . . . 0.0 109.406 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . 0.441 ' H ' ' C ' ' R' ' 41' ' ' LEU . 19.6 mt -132.34 169.96 15.76 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.457 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.29 0.2 OUTLIER -132.24 -135.52 0.0 OUTLIER Pre-proline 0 CA--C 1.57 1.735 0 CA-C-O 116.957 -1.497 . . . . 0.0 109.725 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 18.8 Cg_endo -100.45 -49.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.483 0.874 0 CA-C-N 123.127 2.152 . . . . 0.0 112.051 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.43 -22.05 4.32 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.549 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.31 -52.8 11.19 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.89 -13.14 21.97 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.318 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -88.42 -65.09 1.05 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.144 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.448 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -61.63 -44.18 97.47 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.077 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.45 -60.63 2.39 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.665 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -44.76 42.1 Favored Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.297 -1.43 . . . . 0.0 109.973 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.496 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.2 OUTLIER -48.21 -79.93 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.092 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -39.91 -37.77 0.61 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.199 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 93.5 t -72.64 -35.27 50.06 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.726 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.9 OUTLIER -77.21 -39.45 48.64 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.151 -1.02 . . . . 0.0 111.821 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.458 HD11 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -73.38 -36.14 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 117.713 -1.595 . . . . 0.0 108.383 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.458 ' N ' HD11 ' R' ' 57' ' ' ILE . 3.1 t -56.28 -65.24 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 C-N-CA 118.07 -1.452 . . . . 0.0 109.39 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -47.61 -44.55 26.76 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -46.15 -44.36 15.78 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.874 -0.731 . . . . 0.0 111.758 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 9.8 mt -99.15 -0.1 42.31 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.291 -0.964 . . . . 0.0 111.668 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.493 1.696 0 C-N-CA 119.194 -1.002 . . . . 0.0 111.448 179.981 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 120.922 0.391 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -161.73 155.27 26.46 Favored Glycine 0 N--CA 1.493 2.446 0 C-N-CA 119.48 -1.343 . . . . 0.0 110.279 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.447 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.1 OUTLIER -54.77 -49.5 68.36 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.785 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.464 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -61.14 -56.51 20.02 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.036 -1.066 . . . . 0.0 111.217 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 81' ' ' THR . . . . . 0.453 ' H ' ' HG1' ' R' ' 81' ' ' THR . 4.0 m -38.87 -54.42 1.63 Allowed 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 9.4 pt -64.72 -20.65 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.551 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -75.32 -73.28 0.26 Allowed 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 118.389 -1.324 . . . . 0.0 111.677 -179.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -6.24 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.545 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . 0.551 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -69.25 -46.03 58.97 Favored Glycine 0 N--CA 1.49 2.287 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.741 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 86' ' ' SER . . . . . 0.527 ' C ' ' H ' ' R' ' 88' ' ' SER . 33.8 t -102.77 -42.14 5.97 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.438 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -67.5 9.42 0.25 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.606 -0.837 . . . . 0.0 111.234 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 88' ' ' SER . . . . . 0.527 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.4 OUTLIER -74.22 -22.91 59.15 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.031 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' R' ' 88' ' ' SER . 3.8 mt -37.29 -25.31 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.996 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . 0.527 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -108.71 -56.66 2.24 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.318 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.84 -6.21 2.57 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.663 -1.153 . . . . 0.0 112.585 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 138.68 97.48 Favored Pre-proline 0 N--CA 1.489 1.505 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.567 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -63.01 128.28 22.56 Favored 'Trans proline' 0 C--O 1.214 -0.705 0 C-N-CA 121.016 1.144 . . . . 0.0 111.582 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . 0.4 ' O ' ' CG1' ' R' ' 94' ' ' VAL . 82.7 t -67.68 -5.5 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.487 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -91.93 7.62 41.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.723 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.1 tp -104.35 -41.93 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.163 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.7 -47.2 67.41 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.286 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -60.04 -17.37 38.57 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.674 -0.81 . . . . 0.0 112.567 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -113.66 -65.26 1.2 Allowed 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.489 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.494 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.3 mm? -39.89 -38.56 0.7 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.494 ' C ' ' O ' ' R' ' 100' ' ' LEU . 11.2 mt-10 -43.79 -33.94 1.43 Allowed 'General case' 0 C--N 1.291 -1.966 0 C-N-CA 117.738 -1.585 . . . . 0.0 107.825 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . 0.441 ' N ' ' C ' ' R' ' 100' ' ' LEU . 6.4 mt-10 -91.75 -31.85 15.62 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.939 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 3.2 t -82.44 -10.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 117.288 -1.765 . . . . 0.0 110.287 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 34.0 tp -92.95 -50.44 5.55 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.631 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.5 -66.44 0.38 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 119.16 -1.016 . . . . 0.0 110.252 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm . . . . . 0 N--CA 1.487 1.419 0 C-N-CA 119.681 -0.807 . . . . 0.0 111.179 179.925 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . 0.515 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.764 0.316 . . . . 0.0 110.847 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -66.11 7.73 0.27 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.757 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.515 ' H ' ' C ' ' S' ' 15' ' ' ARG . 1.2 mp0 -92.65 -85.51 0.26 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.76 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.6 mt-10 -42.93 -29.93 0.37 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 122.966 1.365 . . . . 0.0 108.276 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . 0.466 ' N ' ' C ' ' S' ' 17' ' ' GLN . 22.8 t-105 -56.45 -54.43 45.73 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 112.729 -2.032 . . . . 0.0 107.927 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . 0.495 ' N ' ' O ' ' S' ' 17' ' ' GLN . 0.5 OUTLIER -57.64 -36.55 72.0 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 113.573 -1.648 . . . . 0.0 111.455 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -54.82 -74.41 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 118.595 -1.242 . . . . 0.0 110.027 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.547 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.7 OUTLIER -27.13 -48.26 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 119.234 -0.986 . . . . 0.0 111.472 179.626 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' S' ' 21' ' ' ARG . 62.2 t -66.82 -49.75 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.439 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' S' ' 21' ' ' ARG . 15.6 t70 -41.07 -56.25 2.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.583 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . 0.405 ' CD2' ' N ' ' S' ' 25' ' ' LEU . 0.2 OUTLIER -60.61 -45.32 94.45 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.272 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.31 -43.71 33.27 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.389 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.05 -41.04 33.73 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.84 -9.86 18.67 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 119.305 -0.958 . . . . 0.0 113.329 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -46.69 15.02 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.774 -1.171 . . . . 0.0 112.096 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . 0.408 ' C ' ' N ' ' S' ' 32' ' ' ASN . 17.7 t80 -49.93 -46.34 51.98 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.687 -0.805 . . . . 0.0 112.015 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -47.4 -19.68 0.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.138 -1.025 . . . . 0.0 111.212 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.494 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 79.4 m-20 -110.67 -68.58 0.92 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.213 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.556 ' C ' ' HD1' ' S' ' 35' ' ' HIS . 0.1 OUTLIER 160.17 -13.42 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.53 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . 0.435 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 1.4 mm? -54.94 -17.81 4.19 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.941 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . 0.556 ' HD1' ' C ' ' S' ' 33' ' ' ASP . 19.4 p-80 -50.17 -21.12 1.19 Allowed 'General case' 0 C--N 1.292 -1.904 0 C-N-CA 119.486 -0.886 . . . . 0.0 112.338 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.459 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -77.94 -64.1 0.42 Allowed Pre-proline 0 N--CA 1.484 1.239 0 C-N-CA 118.481 -1.288 . . . . 0.0 111.173 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -51.4 -42.31 55.52 Favored 'Trans proline' 0 C--N 1.319 -0.993 0 C-N-CA 120.526 0.817 . . . . 0.0 110.495 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.98 -54.6 44.82 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.589 -0.844 . . . . 0.0 110.416 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . 0.457 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.4 OUTLIER -46.22 -53.21 11.0 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.816 179.864 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -52.36 -10.67 0.15 Allowed 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -107.14 -60.37 1.69 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.726 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 42' ' ' MET . . . . . 0.54 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -89.62 28.51 1.29 Allowed 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.462 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . 0.469 ' C ' ' CD2' ' S' ' 43' ' ' LEU . 5.3 tt -178.13 127.95 0.13 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.468 ' N ' ' CD ' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -178.98 -42.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.484 0 C-N-CA 116.514 -2.074 . . . . 0.0 116.276 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.499 ' C ' ' N ' ' S' ' 47' ' ' GLU . 19.1 Cg_endo -78.72 -107.17 0.01 OUTLIER 'Trans proline' 0 CA--C 1.553 1.464 0 C-N-CA 121.251 1.301 . . . . 0.0 114.12 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -47.52 -16.85 0.07 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.118 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' S' ' 49' ' ' GLU . 22.0 mm-40 -69.42 -76.9 0.09 Allowed 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.149 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' S' ' 47' ' ' GLU . 11.0 ttp85 -38.32 -27.13 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.245 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' S' ' 47' ' ' GLU . 3.3 tt0 -77.47 -62.32 1.7 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 118.239 -1.385 . . . . 0.0 110.821 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . 0.463 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -59.47 -35.64 74.47 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.774 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 95.2 mt -55.41 -72.48 0.07 Allowed 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.419 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.78 -40.32 5.23 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.456 -1.354 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.473 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -50.79 -80.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.616 -0.833 . . . . 0.0 112.496 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . 0.551 HH21 ' CB ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -39.42 -35.34 0.27 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.401 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.3 t -74.66 -31.0 25.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 C-N-CA 118.452 -1.299 . . . . 0.0 111.013 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.473 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.5 -36.89 32.67 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.818 -1.153 . . . . 0.0 111.421 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . 0.406 ' CD1' ' C ' ' S' ' 57' ' ' ILE . 0.0 OUTLIER -72.91 -40.11 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 118.078 -1.449 . . . . 0.0 108.604 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . 0.551 ' CB ' HH21 ' S' ' 54' ' ' ARG . 19.3 t -59.46 -59.25 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 C-N-CA 117.463 -1.695 . . . . 0.0 108.837 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.1 -23.52 5.48 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.544 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.04 -58.09 5.07 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.631 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . 0.614 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -64.85 -9.96 24.75 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 118.564 -1.254 . . . . 0.0 110.737 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . 0.457 ' O ' ' C ' ' S' ' 63' ' ' ARG . 12.6 tp -72.65 28.62 0.06 Allowed 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 119.552 -0.859 . . . . 0.0 109.814 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . 0.614 ' H ' ' C ' ' S' ' 61' ' ' LEU . 47.7 mtt-85 . . . . . 0 N--CA 1.5 2.04 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 tttm . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 120.768 0.318 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -92.01 -103.4 0.11 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.305 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -140.95 -56.65 0.5 Allowed 'General case' 0 C--N 1.279 -2.491 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.884 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.11 5.21 40.29 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.4 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.92 -58.61 12.86 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 119.551 -1.309 . . . . 0.0 110.907 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.85 -82.02 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.126 -1.03 . . . . 0.0 111.003 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 157.23 132.3 1.44 Allowed Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.249 -1.453 . . . . 0.0 110.664 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.472 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -42.26 -45.6 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.127 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.45 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -62.83 -57.33 11.25 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.167 -1.013 . . . . 0.0 111.622 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 23.6 m -47.24 -47.42 24.7 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.764 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 22.1 pt -75.14 -0.61 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.662 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -90.6 -60.84 1.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 118.583 -1.247 . . . . 0.0 111.699 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -13.27 34.64 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.251 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.53 -48.57 83.95 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.373 -1.394 . . . . 0.0 110.699 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -88.46 -25.26 22.71 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.161 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -94.54 8.75 41.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.757 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.07 -28.13 16.38 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.753 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 9.4 mp -42.42 -64.3 0.63 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.864 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' S' ' 91' ' ' ALA . 0.0 OUTLIER -95.77 -51.44 4.49 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.778 -179.869 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . 0.44 ' C ' ' O ' ' S' ' 90' ' ' LYS . . . -34.26 -51.87 0.46 Allowed 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.889 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.83 162.71 54.31 Favored Pre-proline 0 C--N 1.303 -1.432 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.464 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -56.39 144.67 82.28 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 121.475 1.45 . . . . 0.0 111.222 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . 0.447 ' C ' ' H ' ' S' ' 96' ' ' LEU . 6.0 t -85.15 -6.82 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 119.286 -0.965 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.22 4.48 1.64 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.655 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . 0.447 ' H ' ' C ' ' S' ' 94' ' ' VAL . 8.0 mp -97.02 -19.16 18.94 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.498 -0.881 . . . . 0.0 111.011 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . 0.438 ' N ' ' CD ' ' S' ' 97' ' ' ARG . 3.5 mpt_? -64.2 -42.75 96.51 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.438 -0.905 . . . . 0.0 111.003 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -86.51 -1.78 57.9 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 10.7 t90 -115.63 -66.14 1.12 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.573 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.6 OUTLIER -52.67 -38.06 59.83 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.514 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.3 mm-40 -41.95 -26.95 0.1 Allowed 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 117.573 -1.651 . . . . 0.0 107.285 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.573 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -95.57 -25.61 16.1 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 113.462 -1.699 . . . . 0.0 112.127 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . 0.517 ' N ' ' O ' ' S' ' 100' ' ' LEU . 8.2 t -84.22 -20.32 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 116.148 -2.221 . . . . 0.0 108.119 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 19.3 tp -81.43 -57.4 3.49 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.857 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 1.1 mt -49.06 -61.89 1.83 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 118.672 -1.211 . . . . 0.0 109.446 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -74.24 170.21 16.02 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.683 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' S' S ' 107' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' S' ' 107' ' ' SER . 29.5 t . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 116.247 -1.835 . . . . 0.0 110.703 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . 0.538 ' C ' ' H ' ' R' ' 17' ' ' GLN . 4.5 mmt85 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 121.377 0.608 . . . . 0.0 112.326 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . 0.633 ' CD2' ' CD1' ' R' ' 19' ' ' TRP . 10.1 t-80 -69.17 24.81 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.151 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.538 ' H ' ' C ' ' R' ' 15' ' ' ARG . 4.3 mt-30 -85.59 -98.47 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.488 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . 0.496 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.7 mt-10 -32.0 -37.08 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-O 123.259 1.504 . . . . 0.0 108.989 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . 0.633 ' CD1' ' CD2' ' R' ' 16' ' ' HIS . 57.3 t-105 -50.09 -57.96 6.54 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 112.553 -2.112 . . . . 0.0 109.604 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' R' ' 17' ' ' GLN . 7.9 tp -54.64 -46.01 73.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.014 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -45.39 -68.4 0.2 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.456 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.448 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.1 OUTLIER -36.8 -38.81 0.19 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.82 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 97.3 t -73.5 -50.06 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.741 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -41.5 -64.65 0.53 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.877 -0.729 . . . . 0.0 111.24 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . 0.401 ' O ' ' C ' ' R' ' 26' ' ' LEU . 0.8 OUTLIER -54.4 -48.42 71.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.9 -0.72 . . . . 0.0 110.979 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' R' ' 25' ' ' LEU . 1.1 tt -35.31 -62.42 0.39 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.535 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.6 OUTLIER -57.5 -68.03 0.27 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.059 -1.056 . . . . 0.0 112.02 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -44.57 -17.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -95.93 -31.27 13.18 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.521 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . 0.515 ' CE1' ' NZ ' ' S' ' 27' ' ' LYS . 15.1 t80 -55.86 -40.33 72.74 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.716 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -71.1 -21.97 62.15 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.805 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . 0.527 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 26.5 m120 -100.07 -16.1 17.99 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . 0.527 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 5.3 t70 83.73 23.56 0.13 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 123.671 0.607 . . . . 0.0 110.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -98.58 -14.79 19.76 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.769 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . 0.481 ' HD1' ' N ' ' R' ' 35' ' ' HIS . 1.9 p-80 -48.11 -35.12 10.84 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.294 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.446 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.0 mt -64.82 -63.07 3.99 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 118.024 -1.47 . . . . 0.0 111.697 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -48.63 -35.03 28.59 Favored 'Trans proline' 0 C--N 1.315 -1.219 0 C-N-CA 120.917 1.078 . . . . 0.0 111.894 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 72.8 mt -76.81 -40.65 47.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.637 -0.825 . . . . 0.0 110.246 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.81 -22.17 34.32 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.681 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -89.44 6.64 39.86 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.176 -1.009 . . . . 0.0 111.117 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . 0.512 ' C ' ' H ' ' R' ' 43' ' ' LEU . 67.3 mt -114.54 -60.88 1.83 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.227 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 42' ' ' MET . . . . . 0.403 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -71.12 16.24 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.348 -1.341 . . . . 0.0 111.535 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . 0.512 ' H ' ' C ' ' R' ' 41' ' ' LEU . 4.8 mp -141.67 159.18 42.76 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.131 -0.627 . . . . 0.0 109.374 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.517 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.288 0.3 OUTLIER -107.67 -148.94 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.623 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.453 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.517 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 9.4 Cg_endo -98.12 -39.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.474 0.357 0 CA-C-N 119.945 1.016 . . . . 0.0 110.524 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.379 -0.928 . . . . 0.0 110.165 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.9 -41.77 95.33 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.91 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.03 -34.8 73.73 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.57 -0.852 . . . . 0.0 111.245 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.14 -64.42 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.74 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.433 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -53.95 -39.71 66.18 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.181 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -48.61 -67.6 0.26 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.612 -0.835 . . . . 0.0 110.862 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . 0.408 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -45.32 -52.82 8.35 Favored Glycine 0 N--CA 1.486 2.002 0 C-N-CA 119.283 -1.437 . . . . 0.0 110.644 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' R' ' 50' ' ' ALA . 0.2 OUTLIER -37.7 -78.58 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.276 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 9.6 mtt85 -40.94 -51.89 3.16 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.294 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 59.1 t -64.36 -26.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 C-N-CA 118.344 -1.343 . . . . 0.0 111.34 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.411 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -81.23 -39.28 25.62 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.826 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.441 HD11 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -74.33 -34.78 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 117.718 -1.593 . . . . 0.0 108.465 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.441 ' N ' HD11 ' R' ' 57' ' ' ILE . 4.3 t -61.43 -65.27 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 118.004 -1.478 . . . . 0.0 109.414 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -41.28 -50.73 3.67 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.882 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.64 -47.32 82.56 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.823 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 80.9 mt -83.09 6.09 20.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.538 -0.865 . . . . 0.0 112.241 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 tp . . . . . 0 N--CA 1.492 1.675 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.365 179.998 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.736 0.303 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.45 138.36 2.69 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.491 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.467 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.28 -38.99 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.221 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.427 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.93 -61.62 1.95 Allowed 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.891 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 48.9 m -38.75 -38.87 0.45 Allowed 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 13.4 pt -82.27 -22.64 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.45 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -64.85 -55.19 21.0 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 118.693 -1.203 . . . . 0.0 111.663 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.91 -9.71 58.99 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.171 -1.012 . . . . 0.0 111.484 -179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.01 -32.79 52.01 Favored Glycine 0 N--CA 1.49 2.274 0 C-N-CA 119.089 -1.529 . . . . 0.0 110.775 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 86' ' ' SER . . . . . 0.529 ' C ' ' H ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -84.88 -55.82 3.89 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.213 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . 0.402 ' O ' ' C ' ' R' ' 88' ' ' SER . 25.1 m-80 -69.06 11.61 0.2 Allowed 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.324 -0.951 . . . . 0.0 111.264 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 88' ' ' SER . . . . . 0.529 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.3 OUTLIER -42.61 -31.27 0.43 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 1.5 mt -50.22 -45.1 53.54 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.875 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . 0.533 ' O ' ' N ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -107.47 -54.57 2.46 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.772 -0.771 . . . . 0.0 111.112 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.68 -27.78 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.237 -1.347 . . . . 0.0 112.643 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . 0.533 ' N ' ' O ' ' R' ' 90' ' ' LYS . . . -88.0 156.12 52.26 Favored Pre-proline 0 N--CA 1.49 1.535 0 C-N-CA 118.674 -1.21 . . . . 0.0 110.698 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -51.84 129.58 30.86 Favored 'Trans proline' 0 C--N 1.325 -0.7 0 C-N-CA 121.445 1.43 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 4.7 t -62.14 -12.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.992 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -91.45 4.62 52.06 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.514 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -90.24 -49.86 6.31 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.1 -38.8 3.84 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.798 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -58.7 -41.18 85.68 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.516 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -84.85 -63.16 1.38 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.281 -0.967 . . . . 0.0 112.323 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.6 mm? -41.06 -38.2 0.98 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 118.952 -1.099 . . . . 0.0 113.96 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.474 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.6 mm-40 -44.99 -29.65 0.87 Allowed 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 117.851 -1.54 . . . . 0.0 107.856 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . 0.465 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.6 mt-10 -94.58 -30.94 14.11 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 113.304 -1.771 . . . . 0.0 111.818 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 t -89.67 -6.64 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 117.466 -1.694 . . . . 0.0 110.503 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 13.7 tp -104.02 -49.35 3.64 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.25 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.67 -68.5 0.64 Allowed 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.755 -0.778 . . . . 0.0 112.255 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 45.1 tttp . . . . . 0 N--CA 1.492 1.643 0 C-N-CA 119.955 -0.698 . . . . 0.0 111.821 -179.875 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . 0.528 ' C ' ' H ' ' S' ' 17' ' ' GLN . 6.1 mtp180 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 120.492 0.187 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . 0.548 ' O ' ' CG ' ' S' ' 16' ' ' HIS . 43.6 t-80 -69.15 13.55 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.451 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.528 ' H ' ' C ' ' S' ' 15' ' ' ARG . 1.5 tp60 -91.26 -97.19 0.12 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.416 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.403 ' C ' ' O ' ' S' ' 17' ' ' GLN . 0.6 OUTLIER -44.36 -27.99 0.49 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.537 1.161 . . . . 0.0 108.638 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . 0.451 ' N ' ' C ' ' S' ' 17' ' ' GLN . 11.2 t-105 -48.87 -63.92 0.95 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.782 -1.554 . . . . 0.0 108.444 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -44.51 -39.07 4.56 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.266 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.525 ' O ' ' N ' ' S' ' 24' ' ' ASP . 5.8 mmp_? -51.63 -71.12 0.07 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.181 -1.408 . . . . 0.0 109.344 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.522 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -28.92 -44.7 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.797 -0.761 . . . . 0.0 111.202 179.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . 0.424 ' N ' ' O ' ' S' ' 21' ' ' ARG . 99.1 t -70.32 -48.78 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.709 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.525 ' N ' ' O ' ' S' ' 21' ' ' ARG . 63.5 t0 -42.94 -72.83 0.05 Allowed 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.636 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.26 -45.97 6.03 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.711 -0.796 . . . . 0.0 109.952 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -40.82 -59.71 1.35 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.941 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . 0.515 ' NZ ' ' CE1' ' R' ' 30' ' ' TYR . 0.1 OUTLIER -50.36 -70.35 0.09 Allowed 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.682 -0.807 . . . . 0.0 112.461 -179.84 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -49.16 -24.72 1.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.73 -56.03 3.46 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 118.898 -1.121 . . . . 0.0 112.262 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -47.86 -33.41 7.42 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 119.657 -0.817 . . . . 0.0 111.157 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.37 -28.9 21.37 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 118.881 -1.128 . . . . 0.0 110.229 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.492 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 7.4 m120 -111.45 -65.44 1.17 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.599 ' C ' ' HD1' ' S' ' 35' ' ' HIS . 0.0 OUTLIER 164.24 -11.54 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.751 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . 0.514 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 3.7 mm? -59.11 -16.7 20.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.177 -0.609 . . . . 0.0 111.821 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . 0.599 ' HD1' ' C ' ' S' ' 33' ' ' ASP . 11.4 p-80 -48.43 -18.15 0.21 Allowed 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 119.356 -0.938 . . . . 0.0 112.134 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.48 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.2 mt -80.92 -65.63 0.26 Allowed Pre-proline 0 C--N 1.308 -1.219 0 C-N-CA 117.995 -1.482 . . . . 0.0 110.931 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.2 Cg_exo -50.31 -28.79 21.51 Favored 'Trans proline' 0 C--N 1.319 -0.987 0 C-N-CA 120.624 0.882 . . . . 0.0 110.975 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.36 -41.54 39.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.326 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . 0.521 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.3 OUTLIER -52.29 -43.34 64.42 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.376 -0.93 . . . . 0.0 109.756 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -71.39 13.12 0.26 Allowed 'General case' 0 C--N 1.297 -1.684 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.83 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . 0.521 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.1 tp -113.71 -54.38 2.61 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 120.044 -0.662 . . . . 0.0 112.344 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.22 7.12 17.16 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 118.665 -1.214 . . . . 0.0 112.725 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 2.1 pp -177.03 153.35 0.98 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.305 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.49 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.7 OUTLIER -179.05 -42.38 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.175 0 C-N-CA 117.783 -1.567 . . . . 0.0 114.762 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.543 ' C ' ' H ' ' S' ' 47' ' ' GLU . 14.4 Cg_endo -77.15 -105.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 121.037 1.158 . . . . 0.0 112.88 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . 0.4 ' OD1' ' O ' ' S' ' 46' ' ' ASP . 34.8 t0 -55.25 -6.18 0.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.693 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . 0.543 ' H ' ' C ' ' S' ' 45' ' ' PRO . 8.4 mm-40 -82.92 -59.45 2.49 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 119.723 -0.791 . . . . 0.0 109.972 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . 0.621 ' NH1' ' CE3' ' R' ' 19' ' ' TRP . 19.4 tpt180 -54.83 -24.88 24.97 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.918 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . 0.422 ' O ' ' OG1' ' S' ' 53' ' ' THR . 31.8 mt-10 -82.24 -71.13 0.5 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.745 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . 0.437 ' C ' ' HG1' ' S' ' 53' ' ' THR . . . -55.53 -51.13 68.07 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.048 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.26 -61.84 0.84 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.899 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.38 -40.99 78.83 Favored Glycine 0 N--CA 1.489 2.177 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.596 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.477 ' H ' ' HG1' ' S' ' 53' ' ' THR . 0.2 OUTLIER -48.9 -77.27 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.221 179.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . 0.746 ' HE ' ' N ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -44.15 -29.49 0.63 Allowed 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.805 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 96.8 t -81.52 -28.57 10.32 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.527 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.65 -36.03 33.07 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.843 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . 0.428 ' N ' ' HG3' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -74.6 -38.94 46.55 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . 0.415 ' N ' HD11 ' S' ' 57' ' ' ILE . 3.1 t -55.81 -68.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 118.635 -1.226 . . . . 0.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -48.11 -33.24 7.92 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.886 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -67.78 -48.41 66.4 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.078 -1.049 . . . . 0.0 112.18 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . 0.54 ' C ' ' H ' ' S' ' 63' ' ' ARG . 0.5 OUTLIER -61.58 -18.92 61.39 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 118.131 -1.428 . . . . 0.0 108.698 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . 0.435 ' O ' ' C ' ' S' ' 63' ' ' ARG . 1.7 tp -77.92 26.06 0.2 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.858 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . 0.54 ' H ' ' C ' ' S' ' 61' ' ' LEU . 61.5 mtt180 . . . . . 0 N--CA 1.501 2.095 0 O-C-N 124.398 1.061 . . . . 0.0 113.832 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 tttm . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.85 0.357 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -84.59 -101.71 0.05 Allowed 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.782 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -141.12 -26.25 0.72 Allowed 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.834 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 tp -126.68 7.85 6.88 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.027 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -54.39 -71.11 0.76 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 119.577 -1.296 . . . . 0.0 110.897 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.74 -86.14 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.305 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.69 128.02 1.65 Allowed Glycine 0 N--CA 1.49 2.288 0 C-N-CA 118.913 -1.613 . . . . 0.0 111.367 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.465 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -38.71 -41.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.307 0 CA-C-N 115.393 -0.403 . . . . 0.0 111.099 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.462 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.62 -42.72 86.36 Favored 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 118.807 -1.157 . . . . 0.0 110.835 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 19.1 m -53.17 -49.58 66.36 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 24.8 pt -72.8 11.13 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.462 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -105.96 -63.55 1.24 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.881 -1.128 . . . . 0.0 111.965 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -21.57 49.38 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 118.459 -1.297 . . . . 0.0 110.876 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.39 -29.96 72.93 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.345 -1.407 . . . . 0.0 110.714 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -27.32 13.48 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.266 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -101.79 10.29 40.07 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.578 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.423 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.3 OUTLIER -46.48 -21.99 0.23 Allowed 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.265 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' S' ' 88' ' ' SER . 75.8 mt -37.69 -72.05 0.07 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' S' ' 92' ' ' ALA . 0.0 OUTLIER -58.93 -55.68 32.0 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.803 -1.159 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.84 -24.17 0.02 OUTLIER 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.87 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . 0.498 ' N ' ' O ' ' S' ' 90' ' ' LYS . . . -120.37 162.34 34.52 Favored Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.618 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -61.6 -178.33 0.28 Allowed 'Trans proline' 0 C--N 1.319 -0.98 0 C-N-CA 121.236 1.291 . . . . 0.0 111.394 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 24.5 t -100.5 -16.48 7.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.116 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -70.41 -6.07 33.0 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.588 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.3 -24.91 62.23 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.993 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 13.7 mtt85 -78.22 -14.39 59.47 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.58 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -104.77 -10.48 17.39 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.979 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -107.02 -58.14 1.98 Allowed 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 122.201 1.0 . . . . 0.0 112.459 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.534 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.6 OUTLIER -53.64 -37.56 63.22 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -179.585 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.53 ' C ' ' O ' ' S' ' 100' ' ' LEU . 8.1 mt-10 -43.81 -32.14 0.99 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 116.939 -1.904 . . . . 0.0 106.215 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.534 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 tt0 -83.79 -27.48 28.79 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 112.683 -2.053 . . . . 0.0 112.054 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . 0.521 ' N ' ' O ' ' S' ' 100' ' ' LEU . 45.0 t -85.74 -32.12 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 C-N-CA 116.01 -2.276 . . . . 0.0 111.304 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 mp -97.14 -55.83 2.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.417 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 15.5 mt -75.79 -81.27 0.08 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 118.703 -1.199 . . . . 0.0 113.416 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . 0.42 ' O ' ' O ' ' S' ' 102' ' ' GLU . 7.2 tttm -86.61 108.25 18.52 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 119.024 -1.07 . . . . 0.0 112.124 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 116.328 -1.796 . . . . 0.0 110.832 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.273 0.559 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -163.58 -13.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.459 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.424 ' C ' ' N ' ' R' ' 19' ' ' TRP . 4.8 tt0 -88.78 -79.25 0.32 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.626 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.2 mp0 -41.9 -34.57 0.69 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 123.339 1.542 . . . . 0.0 108.3 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CZ3' ' CD ' ' S' ' 48' ' ' ARG . 21.9 t-105 -57.19 -55.66 31.86 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 112.381 -2.19 . . . . 0.0 110.038 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' R' ' 17' ' ' GLN . 6.6 tp -56.55 -27.62 58.12 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.788 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' R' ' 24' ' ' ASP . 0.0 OUTLIER -65.33 -62.71 1.37 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.558 -1.257 . . . . 0.0 109.578 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.499 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.2 OUTLIER -33.85 -43.93 0.15 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.305 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 19.7 t -73.27 -35.57 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 119.549 -0.861 . . . . 0.0 110.2 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . 0.592 ' N ' ' O ' ' R' ' 21' ' ' ARG . 34.7 t0 -59.56 -69.79 0.19 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.645 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.24 -41.29 5.75 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.246 -0.981 . . . . 0.0 109.689 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mt -48.86 -62.39 1.55 Allowed 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.225 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -59.94 -38.21 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.528 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -61.52 -35.33 77.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.502 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.31 -39.73 10.34 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.355 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -47.74 -29.48 3.13 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.474 -0.89 . . . . 0.0 112.035 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -52.32 -30.92 30.67 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.375 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -109.11 -79.68 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.234 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 p30 173.51 31.07 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.097 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -94.64 -21.95 18.47 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.862 0.839 . . . . 0.0 110.202 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 13.8 p-80 -49.61 -23.49 1.71 Allowed 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 114.296 -1.32 . . . . 0.0 113.962 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.3 mt -74.08 -66.02 0.54 Allowed Pre-proline 0 N--CA 1.487 1.412 0 C-N-CA 118.164 -1.414 . . . . 0.0 111.316 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 1.4 Cg_endo -52.74 -29.54 42.62 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 120.619 0.879 . . . . 0.0 110.301 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 9.0 mp -82.04 -29.27 32.02 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.845 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . 0.501 ' C ' ' H ' ' R' ' 41' ' ' LEU . 0.0 OUTLIER -59.34 -30.66 68.53 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.78 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . 0.438 ' CG ' HH12 ' R' ' 48' ' ' ARG . 0.8 OUTLIER -77.06 11.46 1.8 Allowed 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 118.716 -1.194 . . . . 0.0 109.199 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . 0.501 ' H ' ' C ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -111.28 -69.0 0.89 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.335 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 42' ' ' MET . . . . . 0.413 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -90.35 41.47 1.05 Allowed 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 118.437 -1.305 . . . . 0.0 108.878 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . 0.421 ' O ' ' O ' ' R' ' 39' ' ' LEU . 4.5 tt 173.89 135.02 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.511 -1.662 . . . . 0.0 106.511 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.463 ' N ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -171.25 -38.31 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.892 0 C-N-CA 114.799 -2.76 . . . . 0.0 117.47 -179.437 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' R' ' 44' ' ' THR . 71.7 Cg_endo -98.69 -105.31 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 121.564 1.509 . . . . 0.0 114.869 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -45.1 -28.84 0.78 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.058 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . 0.468 ' O ' ' N ' ' R' ' 49' ' ' GLU . 7.7 mm-40 -57.66 -67.18 0.36 Allowed 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 118.348 -1.341 . . . . 0.0 109.409 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . 0.438 HH12 ' CG ' ' R' ' 40' ' ' ASN . 1.9 tpp180 -42.92 -24.68 0.07 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.063 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . 0.468 ' N ' ' O ' ' R' ' 47' ' ' GLU . 11.9 mt-10 -96.03 -69.41 0.76 Allowed 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.125 -1.03 . . . . 0.0 113.509 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.402 ' C ' ' HG1' ' R' ' 53' ' ' THR . . . -58.8 -27.27 64.89 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . 0.566 ' CD2' ' N ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -71.71 -37.92 70.59 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.039 -1.464 . . . . 0.0 112.306 -179.671 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . 0.566 ' N ' ' CD2' ' R' ' 51' ' ' LEU . . . -71.21 -36.25 63.79 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 108.556 -1.817 . . . . 0.0 108.556 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.536 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -64.25 -79.65 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.341 -0.929 . . . . 0.0 109.997 179.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' R' ' 53' ' ' THR . 17.1 mtt-85 -32.44 -55.59 0.34 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.213 -1.358 . . . . 0.0 112.977 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 2.1 p -62.89 -30.31 49.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 117.439 -1.704 . . . . 0.0 111.486 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.614 ' NH1' ' HE ' ' S' ' 21' ' ' ARG . 11.1 mmt180 -76.69 -45.29 30.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.297 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -65.61 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 C-N-CA 118.044 -1.462 . . . . 0.0 110.292 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.548 ' CG1' ' H ' ' R' ' 59' ' ' GLU . 9.4 p -45.71 -58.12 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 C-N-CA 117.963 -1.495 . . . . 0.0 111.203 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . 0.548 ' H ' ' CG1' ' R' ' 58' ' ' VAL . 78.6 mt-10 -54.64 -28.19 45.18 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.723 -1.191 . . . . 0.0 112.706 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -79.38 -51.73 9.02 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.937 -1.105 . . . . 0.0 112.98 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 13.3 mt -67.88 -9.82 48.02 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.655 -1.218 . . . . 0.0 111.532 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.304 -1.399 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . 0.422 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 121.175 0.512 . . . . 0.0 110.186 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' R' ' 77' ' ' ALA . . . -34.65 135.33 0.35 Allowed Glycine 0 N--CA 1.495 2.584 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.974 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.489 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -35.6 -35.98 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.057 -0.571 . . . . 0.0 111.103 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.17 -65.83 0.58 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.826 -1.149 . . . . 0.0 110.366 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 53.2 m -40.42 -42.25 1.56 Allowed 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 2.0 pt -85.71 -6.69 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -78.81 -43.18 25.92 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 118.209 -1.397 . . . . 0.0 111.807 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 1.8 ptp180 -67.22 -23.53 65.74 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.653 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.44 3.75 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.229 -1.462 . . . . 0.0 110.194 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 68.0 m -89.4 -32.33 17.32 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.576 -0.85 . . . . 0.0 111.278 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' R' ' 89' ' ' LEU . 5.2 m-20 -86.27 10.66 14.1 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.291 -0.963 . . . . 0.0 110.88 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -40.68 -21.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.698 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' R' ' 87' ' ' ASN . 72.1 mt -58.19 -67.23 0.37 Allowed 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.94 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.8 -27.09 18.21 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.136 -1.026 . . . . 0.0 113.466 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -50.84 72.08 Favored 'General case' 0 C--N 1.284 -2.271 0 C-N-CA 118.72 -1.192 . . . . 0.0 112.827 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -91.66 162.46 31.3 Favored Pre-proline 0 N--CA 1.489 1.521 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -51.53 142.13 40.19 Favored 'Trans proline' 0 C--N 1.323 -0.781 0 C-N-CA 121.628 1.552 . . . . 0.0 112.038 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 23.6 t -92.61 -15.63 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.541 -0.864 . . . . 0.0 111.122 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -70.9 -3.8 21.1 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.04 -1.064 . . . . 0.0 110.284 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.6 tp -67.6 -44.11 78.9 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.043 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.81 -19.15 0.89 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.382 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -70.59 -34.25 71.97 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.037 -1.065 . . . . 0.0 110.704 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 15.7 t90 -100.38 -57.46 2.11 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.473 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.0 mm? -41.54 -34.97 0.63 Allowed 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.556 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' R' ' 100' ' ' LEU . 0.5 OUTLIER -44.48 -31.0 0.96 Allowed 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 117.851 -1.54 . . . . 0.0 108.449 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' C ' ' R' ' 100' ' ' LEU . 1.8 mt-10 -95.53 -29.5 14.33 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 114.081 -1.418 . . . . 0.0 111.803 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 4.2 t -81.16 -20.92 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 116.792 -1.963 . . . . 0.0 110.678 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.45 -55.35 3.44 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.158 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tp -50.78 -41.91 57.44 Favored 'General case' 0 C--N 1.308 -1.197 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.291 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 tttt . . . . . 0 N--CA 1.494 1.755 0 C-N-CA 119.688 -0.805 . . . . 0.0 111.297 -179.992 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 120.897 0.38 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -129.26 -11.79 4.59 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.321 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.525 ' OE1' ' N ' ' S' ' 17' ' ' GLN . 4.7 mp0 -89.83 -76.94 0.41 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.627 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.5 mt-10 -42.13 -30.99 0.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 122.721 1.248 . . . . 0.0 108.328 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . 0.472 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.254 56.0 t-105 -49.76 -56.04 11.75 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.809 179.76 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 5.3 tp -52.43 -40.21 61.93 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 113.841 -1.527 . . . . 0.0 112.045 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.614 ' HE ' ' NH1' ' R' ' 56' ' ' ARG . 4.3 mtt-85 -59.21 -72.64 0.1 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.14 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.509 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -32.1 -44.47 0.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.17 179.62 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . 0.464 ' O ' ' N ' ' S' ' 26' ' ' LEU . 71.0 t -63.28 -61.9 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.481 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.414 ' C ' ' O ' ' S' ' 23' ' ' VAL . 41.9 t0 -32.55 -55.37 0.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.137 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.78 -42.23 97.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.802 -1.159 . . . . 0.0 110.351 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . 0.464 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -54.2 -56.38 18.86 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 119.668 -0.813 . . . . 0.0 112.06 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -58.46 -56.86 16.7 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -60.9 -49.87 75.72 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.269 -0.973 . . . . 0.0 112.385 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -52.99 -37.93 61.81 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 118.714 -1.194 . . . . 0.0 111.383 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -52.1 -43.42 63.92 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 118.456 -1.297 . . . . 0.0 109.807 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -37.72 74.63 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -89.68 -12.13 40.41 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.366 179.882 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' S' ' 29' ' ' ALA . 3.1 t70 78.57 3.91 2.59 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.3 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . 0.442 ' N ' HD21 ' S' ' 34' ' ' LEU . 0.1 OUTLIER -79.95 -0.06 33.55 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.714 179.937 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . 0.61 ' N ' ' HD1' ' S' ' 35' ' ' HIS . 0.8 OUTLIER -56.91 -15.77 5.52 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.666 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.454 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 9.0 mt -76.68 -63.88 0.52 Allowed Pre-proline 0 C--N 1.304 -1.373 0 C-N-CA 118.37 -1.332 . . . . 0.0 110.299 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.7 Cg_endo -52.32 -37.71 71.71 Favored 'Trans proline' 0 C--N 1.319 -0.991 0 N-CA-C 109.716 -0.917 . . . . 0.0 109.716 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . 0.41 ' C ' ' N ' ' S' ' 40' ' ' ASN . 3.8 mm? -66.65 -41.76 87.71 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.405 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . 0.514 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -59.08 -14.37 9.7 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' S' ' 38' ' ' LEU . 0.6 OUTLIER -91.21 -11.51 38.07 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 114.886 -1.052 . . . . 0.0 112.423 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -101.61 -65.82 0.96 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 119.563 -0.855 . . . . 0.0 112.668 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.16 37.54 0.73 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.38 -1.328 . . . . 0.0 110.29 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . 0.514 ' O ' ' O ' ' S' ' 39' ' ' LEU . 1.9 tp 172.5 132.51 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 CA-C-N 114.614 -1.175 . . . . 0.0 107.995 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.437 ' CB ' ' O ' ' S' ' 43' ' ' LEU . 0.7 OUTLIER -176.47 -48.13 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.335 0 C-N-CA 114.927 -2.709 . . . . 0.0 117.569 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.2 -101.81 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.223 0 N-CA-C 115.284 1.225 . . . . 0.0 115.284 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -52.79 -23.36 6.73 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.837 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . 0.554 ' CD ' ' N ' ' S' ' 47' ' ' GLU . 0.0 OUTLIER -62.78 -55.23 28.34 Favored 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.815 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . 0.441 ' CD ' ' CZ3' ' R' ' 19' ' ' TRP . 14.7 mmm-85 -52.47 -39.78 61.55 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.505 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -71.75 0.23 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.422 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . 0.46 ' C ' ' HG1' ' S' ' 53' ' ' THR . . . -48.31 -25.53 1.61 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.557 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.14 -63.95 1.05 Allowed 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 119.383 -0.927 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.26 -40.91 11.04 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.632 -1.747 . . . . 0.0 109.153 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.46 ' HG1' ' C ' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -54.38 -82.2 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.831 -0.748 . . . . 0.0 112.943 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -43.46 -40.79 3.99 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.668 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.61 -34.07 67.34 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.267 0 C-N-CA 117.73 -1.588 . . . . 0.0 110.588 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.6 OUTLIER -82.98 -36.03 25.41 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 118.023 -1.471 . . . . 0.0 112.578 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . 0.473 ' CD1' ' C ' ' S' ' 57' ' ' ILE . 0.3 OUTLIER -64.67 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 115.861 -2.336 . . . . 0.0 106.597 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 38.5 t -62.63 -67.76 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 118.512 -1.275 . . . . 0.0 109.218 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . 0.452 ' O ' ' OE1' ' S' ' 59' ' ' GLU . 0.0 OUTLIER -45.34 -41.89 9.39 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.287 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . 0.438 ' O ' ' N ' ' S' ' 63' ' ' ARG . 16.6 mm-40 -58.75 -45.52 89.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.931 -1.108 . . . . 0.0 111.074 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 16.2 mt -51.31 -47.63 62.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 118.273 -1.371 . . . . 0.0 108.83 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.52 -23.56 58.46 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.653 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . 0.438 ' N ' ' O ' ' S' ' 60' ' ' GLU . 4.3 tpt180 . . . . . 0 N--CA 1.486 1.329 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.941 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' S' ' 75' ' ' LEU . 29.2 t30 -93.97 18.29 10.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 122.231 1.015 . . . . 0.0 108.866 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 43.04 8.47 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 112.382 -2.19 . . . . 0.0 113.449 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' S' ' 73' ' ' ASN . 8.8 mt -128.99 -46.29 1.25 Allowed 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.284 -0.967 . . . . 0.0 111.465 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -66.62 -31.41 78.49 Favored Glycine 0 N--CA 1.492 2.43 0 C-N-CA 119.7 -1.238 . . . . 0.0 112.451 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' S' ' 78' ' ' GLY . . . -176.74 99.75 0.05 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 118.64 -1.224 . . . . 0.0 111.033 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -36.35 142.05 0.18 Allowed Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.427 -0.892 . . . . 0.0 111.791 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.512 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.1 OUTLIER -36.75 -30.77 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -45.98 -66.9 0.33 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.74 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 1.5 m -40.11 -69.53 0.13 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 19.4 pt -52.62 -14.23 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.576 ' C ' ' H ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -94.28 -60.39 1.74 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.367 -1.333 . . . . 0.0 112.792 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -50.16 -5.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.014 -1.074 . . . . 0.0 111.55 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . 0.576 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -48.6 -58.05 7.83 Favored Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.584 -1.293 . . . . 0.0 110.845 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 86' ' ' SER . . . . . 0.424 ' O ' ' OG ' ' S' ' 86' ' ' SER . 17.3 p -174.25 46.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.063 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -98.56 -27.17 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.267 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.495 ' C ' ' H ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -129.79 -38.35 1.49 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.877 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.0 -2.42 1.22 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.306 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . 0.495 ' H ' ' C ' ' S' ' 88' ' ' SER . 0.8 OUTLIER -68.89 -40.68 79.05 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.017 -0.992 . . . . 0.0 113.026 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.69 -22.66 24.53 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.02 -56.39 22.16 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 117.836 -1.546 . . . . 0.0 112.084 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -83.05 126.41 4.37 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 120.802 1.001 . . . . 0.0 110.03 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . 0.554 ' C ' ' H ' ' S' ' 96' ' ' LEU . 15.4 t -86.44 -37.3 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 118.594 -1.242 . . . . 0.0 111.829 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -3.14 0.27 Allowed 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.901 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . 0.554 ' H ' ' C ' ' S' ' 94' ' ' VAL . 0.2 OUTLIER -85.83 -29.84 23.44 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.486 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -8.43 25.25 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -103.79 -6.12 21.76 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.336 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -113.22 -64.43 1.31 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.854 ' CD2' ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -9.2 -84.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 120.865 3.654 . . . . 0.0 120.865 -179.581 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.854 ' H ' ' CD2' ' S' ' 100' ' ' LEU . 3.5 mm-40 -92.71 -37.52 12.33 Favored 'General case' 0 C--N 1.278 -2.507 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.462 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.419 ' C ' ' O ' ' S' ' 101' ' ' GLU . 2.0 tt0 -53.57 -19.06 3.39 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . 0.591 ' N ' ' C ' ' S' ' 101' ' ' GLU . 95.2 t -108.15 -67.13 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.161 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 9.7 mt -43.93 -55.52 4.54 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 117.936 -1.506 . . . . 0.0 111.331 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 12.9 tp -56.85 -71.05 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.836 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 mmtt -48.45 -38.12 19.0 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.97 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 116.398 -1.763 . . . . 0.0 110.851 179.929 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 60.0 mtt85 . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.954 0.407 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -147.25 -6.04 0.49 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.572 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' R' ' 20' ' ' LEU . 1.5 mt-30 -97.61 -79.59 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.648 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . 0.467 ' H ' ' CD ' ' R' ' 18' ' ' GLU . 1.9 mp0 -47.21 -28.69 1.98 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . 0.48 ' N ' ' C ' ' R' ' 17' ' ' GLN . 10.9 t-105 -62.56 -53.23 57.78 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.308 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' R' ' 17' ' ' GLN . 0.8 OUTLIER -56.77 -38.06 71.94 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.249 179.708 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.518 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mtt180 -52.59 -70.07 0.1 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 118.352 -1.339 . . . . 0.0 108.625 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.518 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -28.55 -47.65 0.05 Allowed 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.552 0.532 . . . . 0.0 110.698 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 22.6 t -68.94 -49.18 65.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.675 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' R' ' 21' ' ' ARG . 21.6 t70 -46.45 -76.45 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.83 -0.748 . . . . 0.0 110.94 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -41.49 -41.53 2.11 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.828 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.35 -59.25 4.17 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.052 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -71.5 -38.21 71.17 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.693 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -15.22 23.01 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.997 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.73 -43.35 5.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.463 -0.895 . . . . 0.0 112.013 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -43.35 -27.76 0.28 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.207 -0.997 . . . . 0.0 110.906 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -51.54 -42.96 62.16 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.524 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . 0.41 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 9.7 m-80 -102.18 -72.14 0.7 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.494 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . 0.445 ' H ' HD23 ' R' ' 34' ' ' LEU . 0.5 OUTLIER 169.77 18.12 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.39 -0.924 . . . . 0.0 112.425 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . 0.631 ' H ' ' CD2' ' R' ' 34' ' ' LEU . 0.1 OUTLIER -92.29 -7.97 46.48 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.126 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -51.72 -13.21 0.24 Allowed 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 119.385 -0.926 . . . . 0.0 111.981 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.5 mt -81.41 -65.55 0.25 Allowed Pre-proline 0 N--CA 1.482 1.131 0 C-N-CA 118.141 -1.424 . . . . 0.0 110.1 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -49.51 -27.62 14.62 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 N-CA-C 109.968 -0.82 . . . . 0.0 109.968 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 8.0 mp -76.41 -41.87 46.21 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.796 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . 0.465 ' O ' ' O ' ' R' ' 43' ' ' LEU . 1.3 tp -50.17 -47.68 54.33 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.464 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -70.78 3.13 3.44 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.056 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 mt -110.76 -62.08 1.59 Allowed 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.764 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -82.57 29.79 0.43 Allowed 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.08 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . 0.465 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.8 OUTLIER 163.39 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.537 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.549 ' N ' ' CD ' ' R' ' 45' ' ' PRO . 0.6 OUTLIER -176.82 -41.22 0.0 OUTLIER Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 117.937 -1.505 . . . . 0.0 114.026 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' R' ' 44' ' ' THR . 14.6 Cg_endo -78.85 -102.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.826 1.017 . . . . 0.0 112.337 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.05 -14.21 2.46 Favored 'General case' 0 C--N 1.308 -1.224 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.172 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . 0.512 ' N ' ' OE1' ' R' ' 47' ' ' GLU . 0.7 OUTLIER -77.64 -55.65 5.17 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.127 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -49.06 -37.83 22.32 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.253 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . 0.442 ' O ' ' OG1' ' R' ' 53' ' ' THR . 6.5 mt-10 -65.52 -67.74 0.42 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.614 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.45 -34.06 15.79 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.036 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 4.2 mp -53.71 -77.65 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.46 -0.896 . . . . 0.0 111.54 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.16 -51.25 11.66 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.784 -1.198 . . . . 0.0 111.548 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' R' ' 49' ' ' GLU . 0.1 OUTLIER -42.08 -81.23 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 121.754 0.788 . . . . 0.0 111.458 -179.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . 0.449 ' C ' ' CD ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -34.36 -52.1 0.47 Allowed 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.036 -1.438 . . . . 0.0 112.823 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.7 t -60.62 -32.91 52.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 C-N-CA 119.191 -1.004 . . . . 0.0 112.519 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.35 -33.09 32.64 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.899 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.522 ' C ' ' CD1' ' R' ' 57' ' ' ILE . 0.0 OUTLIER -78.06 -47.59 24.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 C-N-CA 118.67 -1.212 . . . . 0.0 107.763 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . . . . . . . . . 42.9 t -53.77 -63.26 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 119.077 -1.049 . . . . 0.0 110.325 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.13 -38.31 57.09 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 119.581 -0.847 . . . . 0.0 111.875 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -63.24 -30.57 71.68 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.481 -0.887 . . . . 0.0 112.979 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . 0.461 ' C ' ' CD1' ' R' ' 61' ' ' LEU . 0.4 OUTLIER -85.14 -27.55 26.14 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.413 -1.315 . . . . 0.0 111.451 -179.841 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.407 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.184 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . . . . . . 0 N--CA 1.484 1.272 0 CA-C-O 120.861 0.362 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . -34.71 129.33 0.59 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.439 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.553 ' C ' ' H ' ' R' ' 81' ' ' THR . 0.1 OUTLIER -35.91 -29.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-N 115.391 -0.404 . . . . 0.0 111.289 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -52.83 -1.17 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.328 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 81' ' ' THR . . . . . 0.553 ' H ' ' C ' ' R' ' 79' ' ' ILE . 2.2 t -101.11 -36.68 8.88 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.665 -0.814 . . . . 0.0 112.583 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . 0.4 ' N ' ' CG2' ' R' ' 81' ' ' THR . 12.7 pt -79.99 3.77 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.711 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.527 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.2 OUTLIER -77.25 -51.5 10.8 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.051 -1.06 . . . . 0.0 110.148 179.865 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . 0.401 ' N ' ' OG1' ' R' ' 83' ' ' THR . 3.6 ptm180 -81.33 -12.09 59.13 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.477 -0.889 . . . . 0.0 110.685 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.28 -42.66 4.23 Favored Glycine 0 N--CA 1.488 2.158 0 C-N-CA 119.46 -1.352 . . . . 0.0 110.161 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 10.1 t -54.59 -50.81 67.15 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.468 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.1 OUTLIER -93.18 -78.72 0.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.42 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 88' ' ' SER . . . . . 0.479 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.2 OUTLIER 73.57 -40.57 0.47 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.409 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . 0.495 ' H ' ' C ' ' R' ' 87' ' ' ASN . 8.4 mt -49.64 -21.23 0.96 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.141 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . 0.404 ' N ' ' C ' ' R' ' 88' ' ' SER . 4.5 mmtp -45.09 -62.56 1.19 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.894 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.36 -26.99 65.86 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.037 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . 41.57 65.54 4.55 Favored Pre-proline 0 C--N 1.302 -1.459 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.324 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . 0.524 ' C ' ' H ' ' R' ' 95' ' ' GLU . 11.9 Cg_endo -78.67 100.24 1.34 Allowed 'Trans proline' 0 C--N 1.314 -1.259 0 C-N-CA 121.591 1.528 . . . . 0.0 110.33 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -67.17 10.69 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.63 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . 0.524 ' H ' ' C ' ' R' ' 93' ' ' PRO . 6.6 mt-10 -89.08 -37.64 14.95 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.749 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.12 -56.11 11.37 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.563 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -50.06 -18.0 0.49 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.425 -0.91 . . . . 0.0 111.086 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -93.12 -26.61 17.37 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.574 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . 0.571 ' NE1' ' ND2' ' S' ' 32' ' ' ASN . 4.9 t90 -110.62 -62.43 1.53 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.643 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.472 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.98 -30.3 0.26 Allowed 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.46 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' R' ' 100' ' ' LEU . 18.9 pt-20 -47.08 -36.65 8.43 Favored 'General case' 0 C--N 1.293 -1.861 0 C-N-CA 117.468 -1.693 . . . . 0.0 106.978 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . 0.472 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 4.5 mt-10 -92.04 -28.7 17.01 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.385 -1.734 . . . . 0.0 112.533 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 t -89.74 -7.21 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 C-N-CA 117.423 -1.711 . . . . 0.0 110.417 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' R' ' 100' ' ' LEU . 21.1 tp -99.19 -53.18 3.31 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.907 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . 0.449 ' CD2' ' N ' ' R' ' 105' ' ' LEU . 4.0 mm? -71.22 -66.16 0.65 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.874 -1.13 . . . . 0.0 110.207 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 24.6 tttt . . . . . 0 N--CA 1.487 1.392 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.538 179.961 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 16' ' ' HIS . 14.5 ttm-85 . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 120.856 0.36 . . . . 0.0 111.255 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . 0.419 ' C ' ' O ' ' S' ' 15' ' ' ARG . 20.8 t-160 33.75 66.57 0.24 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.654 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -117.56 -85.09 0.64 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.042 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' S' ' 21' ' ' ARG . 47.4 mt-10 -75.13 -21.4 58.87 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 122.852 1.311 . . . . 0.0 107.639 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.281 32.0 t-105 -42.19 -43.94 3.55 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 112.803 -1.999 . . . . 0.0 108.294 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.43 -44.98 92.81 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 112.213 -2.267 . . . . 0.0 109.6 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' S' ' 23' ' ' VAL . 3.1 mmm180 -49.96 -69.11 0.12 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 118.393 -1.323 . . . . 0.0 109.925 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.488 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.48 -36.2 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.82 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . 0.496 ' N ' ' O ' ' S' ' 21' ' ' ARG . 31.3 t -78.99 -64.99 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.852 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.412 ' C ' ' O ' ' S' ' 23' ' ' VAL . 25.2 t0 -34.29 -48.08 0.32 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.665 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 mt -74.69 -49.11 22.48 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.951 -1.1 . . . . 0.0 110.237 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 4.2 tt -44.83 -28.59 0.66 Allowed 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.248 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -90.11 -68.94 0.75 Allowed 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.913 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . 0.616 ' N ' HD21 ' S' ' 28' ' ' ASN . 1.5 m120 -41.38 -29.03 0.13 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.75 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . 0.464 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -86.11 -31.98 21.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.675 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -43.73 -44.86 6.84 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 119.085 -1.046 . . . . 0.0 110.566 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -32.48 63.11 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.464 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.571 ' ND2' ' NE1' ' R' ' 99' ' ' TRP . 3.8 t-20 -79.05 -10.33 59.8 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.937 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.4 m-20 72.95 9.92 5.39 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.383 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -0.62 57.78 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 118.933 -1.107 . . . . 0.0 109.977 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . 0.538 ' N ' ' HD1' ' S' ' 35' ' ' HIS . 3.8 p-80 -57.23 -23.96 51.48 Favored 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.755 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.463 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.6 mt -70.44 -63.51 1.67 Allowed Pre-proline 0 C--N 1.306 -1.297 0 C-N-CA 118.534 -1.266 . . . . 0.0 110.608 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -51.3 -31.29 36.85 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 120.951 1.101 . . . . 0.0 110.63 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . 0.435 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.4 mp -78.44 -36.89 44.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.432 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.25 -20.92 64.74 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.241 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -2.94 49.68 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.224 -0.991 . . . . 0.0 109.591 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . 0.535 ' C ' ' H ' ' S' ' 43' ' ' LEU . 7.4 mp -106.78 -70.94 0.77 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.854 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 42' ' ' MET . . . . . 0.435 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.0 OUTLIER -78.87 43.68 0.51 Allowed 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.832 -1.147 . . . . 0.0 108.843 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . 0.535 ' H ' ' C ' ' S' ' 41' ' ' LEU . 0.1 OUTLIER 177.38 124.01 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 105.334 -2.098 . . . . 0.0 105.334 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.408 ' CG2' ' HD3' ' S' ' 45' ' ' PRO 0.316 13.7 m -121.29 -96.15 0.0 OUTLIER Pre-proline 0 CA--C 1.587 2.368 0 CA-C-O 115.731 -2.08 . . . . 0.0 113.485 -179.426 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.544 ' CG ' ' H ' ' S' ' 46' ' ' ASP . 57.3 Cg_endo -107.3 -64.78 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.485 0 CA-C-N 125.235 2.905 . . . . 0.0 111.766 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . 0.544 ' H ' ' CG ' ' S' ' 45' ' ' PRO . 0.1 OUTLIER -50.7 -27.66 7.49 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.037 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . 0.528 ' H ' ' CD ' ' S' ' 47' ' ' GLU . 21.0 mp0 -66.79 -45.83 77.21 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.41 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -71.19 -37.32 72.13 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.202 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.12 -68.94 0.22 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.573 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -46.6 -38.62 9.83 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.266 -0.973 . . . . 0.0 110.518 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 1.7 mp -53.54 -51.56 62.49 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.433 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -46.27 93.82 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 118.842 -1.647 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -44.89 -79.82 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.544 0.688 . . . . 0.0 111.113 179.893 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . 0.646 ' HE ' ' N ' ' S' ' 55' ' ' VAL . 0.1 OUTLIER -44.8 -47.18 10.94 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 115.133 -0.939 . . . . 0.0 112.182 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . 0.646 ' N ' ' HE ' ' S' ' 54' ' ' ARG . 54.7 t -56.5 -28.87 27.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 C-N-CA 117.76 -1.576 . . . . 0.0 109.281 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' S' ' 53' ' ' THR . 36.1 mtp85 -84.51 -36.48 22.18 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.805 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . 0.506 ' CD1' ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -70.57 -32.28 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 C-N-CA 116.032 -2.267 . . . . 0.0 106.695 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . 0.506 ' N ' ' CD1' ' S' ' 57' ' ' ILE . 7.1 t -59.95 -63.36 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 118.982 -1.087 . . . . 0.0 108.521 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . 0.471 ' OE2' ' CZ ' ' R' ' 21' ' ' ARG . 23.1 mt-10 -49.07 -29.56 5.26 Favored 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.294 -0.963 . . . . 0.0 110.215 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -34.68 44.36 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.472 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . 0.532 ' C ' ' H ' ' S' ' 63' ' ' ARG . 17.3 mt -57.4 -33.31 67.72 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.221 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 49.3 tp -60.95 -7.92 2.8 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 119.289 -0.964 . . . . 0.0 108.468 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . 0.532 ' H ' ' C ' ' S' ' 61' ' ' LEU . 4.0 ptt180 . . . . . 0 N--CA 1.507 2.413 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . 0.463 ' O ' ' CG ' ' S' ' 72' ' ' LYS . 6.7 ptmm? . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.856 0.36 . . . . 0.0 111.033 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' S' ' 74' ' ' GLU . 38.0 t-20 -125.62 -99.71 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.896 0.855 . . . . 0.0 110.885 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . 0.455 ' N ' ' OD1' ' S' ' 73' ' ' ASN . 0.0 OUTLIER -140.04 -23.35 0.84 Allowed 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.008 -1.451 . . . . 0.0 110.98 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 tp -111.12 -14.51 13.87 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.317 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -53.91 -80.73 0.07 OUTLIER Glycine 0 N--CA 1.49 2.269 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.47 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -178.35 -91.31 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.386 -0.925 . . . . 0.0 111.003 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . 0.481 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -167.94 136.11 3.95 Favored Glycine 0 N--CA 1.491 2.316 0 C-N-CA 119.196 -1.478 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.443 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.43 -28.35 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.434 -0.383 . . . . 0.0 111.289 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -67.46 -65.82 0.64 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.701 -0.8 . . . . 0.0 112.588 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.13 -27.56 2.42 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 15.7 pt -92.48 -21.61 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 C-N-CA 118.701 -1.199 . . . . 0.0 112.706 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.457 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.479 -1.288 . . . . 0.0 110.584 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . 0.753 ' HE ' ' H ' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -76.34 -28.46 56.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.64 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.66 -4.5 4.15 Favored Glycine 0 N--CA 1.485 1.922 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 86' ' ' SER . . . . . 0.498 ' H ' ' C ' ' S' ' 84' ' ' ARG . 0.4 OUTLIER -138.38 -63.33 0.55 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.759 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . 0.521 ' O ' ' N ' ' S' ' 89' ' ' LEU . 32.5 m120 -48.04 -16.66 0.09 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.345 -0.942 . . . . 0.0 110.756 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.543 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -41.07 -21.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.991 -0.684 . . . . 0.0 111.372 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' S' ' 87' ' ' ASN . 5.4 mt -39.56 -21.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.713 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . 0.543 ' N ' ' O ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -75.36 -61.76 1.79 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.812 -1.155 . . . . 0.0 110.51 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -46.69 -62.1 1.53 Allowed 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.689 -1.142 . . . . 0.0 110.752 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 46.03 68.18 3.63 Favored Pre-proline 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.266 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -66.01 107.16 1.08 Allowed 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 121.532 1.488 . . . . 0.0 111.267 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . 0.433 ' C ' ' H ' ' S' ' 96' ' ' LEU . 57.4 t -77.45 -35.76 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -54.84 -10.22 0.44 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.904 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' S' ' 94' ' ' VAL . 79.3 mt -103.46 -21.9 13.72 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.205 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.06 -29.04 27.76 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.254 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -94.74 -16.68 22.85 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 10.6 t90 -91.41 -58.87 2.3 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.827 -0.749 . . . . 0.0 111.143 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.467 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -38.41 -34.07 0.12 Allowed 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.467 ' C ' ' O ' ' S' ' 100' ' ' LEU . 31.2 mt-10 -45.43 -38.66 6.26 Favored 'General case' 0 C--N 1.297 -1.713 0 C-N-CA 117.661 -1.616 . . . . 0.0 107.177 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -86.29 -29.43 23.06 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.506 -1.679 . . . . 0.0 112.579 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . . . . . . . . . 4.0 t -83.31 -18.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 116.787 -1.965 . . . . 0.0 111.862 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tp -101.09 -61.67 1.34 Allowed 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.314 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 34.9 mt -57.58 -74.57 0.05 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.111 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 40.5 tttt -42.0 -50.66 4.59 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.904 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 43.6 t . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 116.375 -1.774 . . . . 0.0 110.704 179.968 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 121.125 0.488 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -159.08 -15.89 0.06 Allowed 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.565 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.407 ' O ' ' C ' ' R' ' 18' ' ' GLU . 9.7 tt0 -86.23 -85.7 0.15 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.879 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . 0.407 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.4 OUTLIER -45.27 -34.32 2.82 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.628 1.204 . . . . 0.0 108.122 179.762 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CH2' ' CD ' ' S' ' 47' ' ' GLU . 22.7 t-105 -55.04 -55.13 34.36 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.151 -1.84 . . . . 0.0 108.59 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . 0.458 ' C ' ' CD1' ' R' ' 20' ' ' LEU . 2.4 tm? -57.25 -38.68 74.21 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.432 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.512 ' O ' ' C ' ' R' ' 22' ' ' PHE . 17.7 mmt180 -50.42 -73.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.416 -1.314 . . . . 0.0 110.553 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.512 ' C ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t80 -31.02 -41.91 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.087 -1.045 . . . . 0.0 111.842 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' R' ' 21' ' ' ARG . 10.9 t -69.76 -57.91 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.403 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -39.71 -60.21 1.02 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.633 -0.827 . . . . 0.0 111.522 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . 0.528 ' CD2' ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -52.72 -53.01 53.68 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.234 -1.386 . . . . 0.0 109.585 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.2 tt -39.83 -64.43 0.49 Allowed 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.351 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . 0.625 ' NZ ' ' CD1' ' S' ' 30' ' ' TYR . 0.4 OUTLIER -53.44 -76.11 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.868 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . 0.434 ' H ' HD21 ' R' ' 28' ' ' ASN . 5.5 m-80 -34.85 -49.33 0.43 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.48 -55.35 24.78 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.409 -0.916 . . . . 0.0 113.078 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -40.7 -37.62 0.77 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.774 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -47.37 -43.8 23.55 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.792 -1.163 . . . . 0.0 109.951 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -95.62 -78.25 0.46 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.9 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 169.81 24.71 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.965 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 1.0 OUTLIER -95.85 -9.66 30.92 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.074 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -54.02 -30.85 49.27 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.476 -179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.456 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 9.0 mt -68.28 -58.69 7.08 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 117.878 -1.529 . . . . 0.0 110.318 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.6 Cg_exo -55.18 -43.28 60.54 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 120.563 0.842 . . . . 0.0 110.685 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -43.45 98.84 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.651 0.739 . . . . 0.0 110.387 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . 0.408 ' C ' ' H ' ' R' ' 41' ' ' LEU . 0.1 OUTLIER -52.3 -48.43 65.37 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.141 179.787 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.57 -5.85 0.25 Allowed 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.656 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . 0.408 ' H ' ' C ' ' R' ' 39' ' ' LEU . 7.9 mp -102.58 -60.18 1.58 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.726 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.14 50.98 1.19 Allowed 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 118.715 -1.194 . . . . 0.0 109.399 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 173.22 144.89 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.561 -1.199 . . . . 0.0 108.057 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -169.21 -43.42 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 115.396 -2.522 . . . . 0.0 117.051 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -104.2 -98.19 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 115.338 1.246 . . . . 0.0 115.338 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.84 -26.19 2.28 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.833 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . 0.417 ' OE2' ' NH2' ' S' ' 54' ' ' ARG . 6.6 mm-40 -51.8 -66.18 0.43 Allowed 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.858 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mmm-85 -58.19 -38.45 76.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.79 -0.764 . . . . 0.0 112.009 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -71.6 -67.18 0.54 Allowed 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.928 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.423 ' O ' ' NE ' ' R' ' 54' ' ' ARG . . . -47.9 -30.28 4.03 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.994 -0.683 . . . . 0.0 112.731 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 4.6 mp -63.88 -67.43 0.43 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 119.237 -0.985 . . . . 0.0 111.65 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.74 -29.55 4.3 Favored Glycine 0 N--CA 1.487 2.089 0 C-N-CA 118.982 -1.58 . . . . 0.0 110.233 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.462 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -65.1 -81.69 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.803 -179.986 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . 0.423 ' NE ' ' O ' ' R' ' 50' ' ' ALA . 10.7 ptp180 -43.31 -43.9 5.21 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.733 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.2 t -62.8 -30.43 49.42 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 C-N-CA 118.341 -1.344 . . . . 0.0 110.296 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' R' ' 53' ' ' THR . 21.1 mtp85 -79.53 -39.62 31.52 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.08 -1.048 . . . . 0.0 111.357 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.513 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.47 -32.77 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 117.008 -1.877 . . . . 0.0 108.289 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.513 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 2.7 t -59.23 -61.21 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 118.75 -1.18 . . . . 0.0 108.484 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -52.12 -30.93 28.61 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.962 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.18 -33.08 75.15 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.416 -0.913 . . . . 0.0 111.471 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . 0.457 ' C ' ' CD1' ' R' ' 61' ' ' LEU . 0.4 OUTLIER -75.1 -28.93 60.47 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.731 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mt . . . . . 0 N--CA 1.486 1.33 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.677 179.842 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.698 0.285 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 172.73 158.54 17.27 Favored Glycine 0 N--CA 1.492 2.407 0 C-N-CA 118.994 -1.574 . . . . 0.0 111.069 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.447 ' O ' ' OG1' ' R' ' 83' ' ' THR . 0.1 OUTLIER -36.59 -27.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 CA-C-N 115.345 -0.428 . . . . 0.0 111.753 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.518 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -65.35 -78.39 0.05 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.401 -0.92 . . . . 0.0 112.683 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -37.47 -31.31 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 22.1 pt -87.06 -28.91 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 C-N-CA 118.418 -1.313 . . . . 0.0 112.85 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.464 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -54.63 -63.69 1.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 118.343 -1.343 . . . . 0.0 110.605 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . 0.725 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -62.58 -24.86 67.77 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 119.323 -0.951 . . . . 0.0 110.312 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.05 4.3 3.43 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.331 -1.414 . . . . 0.0 109.76 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 86' ' ' SER . . . . . 0.514 ' H ' ' C ' ' R' ' 84' ' ' ARG . 33.9 t -138.77 -43.54 0.48 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.618 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -92.96 10.33 31.75 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -42.21 -40.15 2.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.297 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.13 -74.85 0.06 Allowed 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.664 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' R' ' 91' ' ' ALA . 10.9 tptm -41.1 -50.07 3.43 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.525 0.678 . . . . 0.0 111.761 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.64 -62.32 0.36 Allowed 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 113.911 -1.495 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . 0.429 ' O ' ' N ' ' R' ' 94' ' ' VAL . . . -174.34 -54.21 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 118.514 -1.274 . . . . 0.0 113.241 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -57.25 89.38 0.05 OUTLIER 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 120.196 0.597 . . . . 0.0 111.0 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . 0.429 ' N ' ' O ' ' R' ' 92' ' ' ALA . 61.8 t -110.65 -45.59 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.442 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -67.73 -18.1 64.78 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.291 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.15 -43.45 61.24 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.943 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -35.57 59.62 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.296 -0.961 . . . . 0.0 110.707 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.47 -23.18 5.71 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.503 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -106.29 -62.19 1.42 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.179 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.471 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -40.74 -30.85 0.13 Allowed 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.104 -1.038 . . . . 0.0 113.704 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.476 ' CG ' ' N ' ' R' ' 102' ' ' GLU . 11.0 pt-20 -46.46 -36.32 6.5 Favored 'General case' 0 C--N 1.297 -1.712 0 C-N-CA 117.529 -1.669 . . . . 0.0 107.121 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . 0.476 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 3.6 mt-10 -91.37 -28.45 17.69 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-N 113.235 -1.802 . . . . 0.0 112.282 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.1 t -93.15 -1.34 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 117.601 -1.64 . . . . 0.0 110.67 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' R' ' 100' ' ' LEU . 26.4 tp -105.6 -51.55 2.98 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.757 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . 0.451 ' C ' ' CD2' ' R' ' 105' ' ' LEU . 0.1 OUTLIER -72.79 -10.15 59.47 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 119.285 -0.966 . . . . 0.0 111.18 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.519 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.015 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 121.129 0.49 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.82 -20.21 0.41 Allowed 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.043 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.453 ' C ' ' N ' ' S' ' 19' ' ' TRP . 0.9 OUTLIER -92.51 -82.99 0.31 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.389 179.808 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -45.4 -29.32 1.05 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.822 1.296 . . . . 0.0 108.194 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . 0.453 ' N ' ' C ' ' S' ' 17' ' ' GLN . 24.4 t-105 -58.62 -59.87 4.72 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 112.862 -1.972 . . . . 0.0 109.911 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . 0.471 ' C ' ' CD1' ' S' ' 20' ' ' LEU . 0.3 OUTLIER -58.99 -19.03 39.7 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.968 -1.469 . . . . 0.0 111.081 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' S' ' 22' ' ' PHE . 12.1 mmt180 -67.82 -65.14 0.73 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.003 -1.479 . . . . 0.0 108.974 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.438 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.6 t80 -39.5 -41.69 1.03 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.303 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 85.5 t -71.09 -48.36 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.794 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -40.28 -64.44 0.51 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.492 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . 0.508 ' C ' ' H ' ' S' ' 27' ' ' LYS . 1.9 mt -53.02 -53.4 50.64 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 118.73 -1.188 . . . . 0.0 109.184 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.68 -1.08 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.297 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . 0.508 ' H ' ' C ' ' S' ' 25' ' ' LEU . 25.0 tttm -88.05 -68.48 0.76 Allowed 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.389 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.88 -3.2 50.46 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.363 -0.935 . . . . 0.0 112.139 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.32 -53.27 10.01 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.919 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . 0.625 ' CD1' ' NZ ' ' R' ' 27' ' ' LYS . 14.6 t80 -41.65 -42.14 2.42 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.25 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -45.58 -42.3 10.96 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.57 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.414 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 0.0 OUTLIER -97.37 -77.65 0.49 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.177 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' S' ' 32' ' ' ASN . 0.5 OUTLIER 169.66 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 0.8 OUTLIER -92.82 -15.35 26.61 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.062 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -51.15 -20.75 1.63 Allowed 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.186 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.466 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.0 mt -80.21 -65.03 0.29 Allowed Pre-proline 0 C--N 1.306 -1.302 0 C-N-CA 118.335 -1.346 . . . . 0.0 110.647 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.526 ' O ' ' ND2' ' S' ' 40' ' ' ASN . 2.6 Cg_endo -51.88 -21.32 11.64 Favored 'Trans proline' 0 C--N 1.32 -0.938 0 N-CA-C 109.775 -0.894 . . . . 0.0 109.775 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 49.1 mt -79.87 -38.7 32.13 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.609 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.3 OUTLIER -59.7 -24.75 64.23 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.758 179.696 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . 0.526 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.0 OUTLIER -97.06 10.37 39.49 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.744 179.747 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tp -108.47 -67.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -99.33 36.79 1.67 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 119.019 -1.073 . . . . 0.0 112.143 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' S' ' 39' ' ' LEU . 24.1 tp 172.74 146.04 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.449 ' CB ' ' O ' ' S' ' 43' ' ' LEU . 0.7 OUTLIER 177.98 -46.94 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 117.169 -1.812 . . . . 0.0 114.921 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.487 ' C ' ' N ' ' S' ' 47' ' ' GLU . 6.0 Cg_endo -68.42 -83.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 120.361 0.707 . . . . 0.0 111.584 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . 0.508 ' N ' ' OD1' ' S' ' 46' ' ' ASP . 3.0 p-10 -49.73 -14.42 0.13 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 119.005 -1.078 . . . . 0.0 109.715 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . 0.487 ' N ' ' C ' ' S' ' 45' ' ' PRO . 10.5 tt0 -71.77 -74.94 0.14 Allowed 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.281 -0.967 . . . . 0.0 111.284 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.77 -25.03 0.15 Allowed 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 119.592 -0.843 . . . . 0.0 110.945 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' O ' ' S' ' 47' ' ' GLU . 4.2 mm-40 -100.51 -65.03 0.99 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.978 -1.089 . . . . 0.0 112.786 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . 0.466 ' CB ' ' O ' ' S' ' 46' ' ' ASP . . . -61.82 -42.19 98.71 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.075 -1.05 . . . . 0.0 112.985 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 1.8 tp -54.45 -49.73 69.36 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.761 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.82 -35.76 83.9 Favored Glycine 0 N--CA 1.492 2.373 0 C-N-CA 118.797 -1.668 . . . . 0.0 109.744 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.467 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -64.83 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 115.006 -0.597 . . . . 0.0 112.563 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . 0.417 ' NH2' ' OE2' ' R' ' 47' ' ' GLU . 4.5 ptt180 -42.41 -29.4 0.27 Allowed 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.834 -0.746 . . . . 0.0 112.393 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.7 t -76.47 -31.78 20.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 117.817 -1.553 . . . . 0.0 109.407 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' S' ' 53' ' ' THR . 10.8 mtp180 -63.6 -46.7 84.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 118.894 -1.123 . . . . 0.0 109.825 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -57.33 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 C-N-CA 118.024 -1.47 . . . . 0.0 110.219 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 84.8 t -47.26 -64.58 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 C-N-CA 118.288 -1.365 . . . . 0.0 111.459 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.63 -28.72 22.6 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.48 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -80.94 -47.24 13.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 118.474 -1.29 . . . . 0.0 112.789 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 pp -70.09 -5.23 25.42 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 117.859 -1.536 . . . . 0.0 110.613 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.06 -61.97 1.57 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.429 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 . . . . . 0 N--CA 1.493 1.714 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.508 179.891 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . 0.484 ' CG ' ' N ' ' S' ' 74' ' ' GLU . 1.1 t-20 -97.25 -95.7 0.21 Allowed 'General case' 0 C--N 1.297 -1.701 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.551 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' S' ' 73' ' ' ASN . 18.2 mt-10 -163.31 -43.1 0.03 OUTLIER 'General case' 0 C--N 1.278 -2.538 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.36 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -114.72 -30.74 6.38 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.56 -1.655 . . . . 0.0 111.181 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -36.79 -73.59 0.12 Allowed Glycine 0 N--CA 1.497 2.745 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.208 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . 0.542 ' O ' ' O ' ' S' ' 78' ' ' GLY . . . -166.69 64.8 0.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.075 -1.05 . . . . 0.0 111.429 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' S' ' 77' ' ' ALA . . . 29.96 -162.89 0.0 OUTLIER Glycine 0 N--CA 1.5 2.928 0 CA-C-N 114.933 -1.031 . . . . 0.0 112.628 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.63 -18.92 7.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-N 114.679 -0.761 . . . . 0.0 111.96 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.28 86.27 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.338 -1.345 . . . . 0.0 111.135 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 47.1 m -46.68 -61.94 1.61 Allowed 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 8.0 pt -64.75 -2.58 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.27 -41.62 8.57 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.398 -1.321 . . . . 0.0 113.511 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -62.95 -12.98 29.2 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -99.75 25.52 27.94 Favored Glycine 0 N--CA 1.5 2.921 0 C-N-CA 119.148 -1.501 . . . . 0.0 111.023 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -119.44 -31.34 4.64 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.432 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . 0.433 ' ND2' ' N ' ' S' ' 87' ' ' ASN . 0.0 OUTLIER -100.08 -21.01 15.75 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.689 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.35 -23.59 0.97 Allowed 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.683 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 34.9 mt -63.65 -39.01 93.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.361 -0.935 . . . . 0.0 112.113 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.76 -28.32 17.46 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 118.666 -1.214 . . . . 0.0 111.282 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -43.47 -57.77 2.93 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 114.972 -1.013 . . . . 0.0 112.888 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . 0.519 ' O ' ' N ' ' S' ' 94' ' ' VAL . . . -158.8 -58.79 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.766 0 C-N-CA 118.556 -1.258 . . . . 0.0 114.014 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . 0.464 ' HD2' ' H ' ' S' ' 92' ' ' ALA . 6.5 Cg_exo -45.98 89.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.325 -0.684 0 C-N-CA 120.607 0.871 . . . . 0.0 112.224 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . 0.519 ' N ' ' O ' ' S' ' 92' ' ' ALA . 2.4 t -111.2 -28.83 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.479 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.19 -25.31 68.28 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.91 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' S' ' 97' ' ' ARG . 8.7 mp -45.91 -48.78 16.12 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.746 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' S' ' 96' ' ' LEU . 0.3 OUTLIER -42.64 -47.14 5.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.57 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -61.28 -46.11 91.71 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.915 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . 0.409 ' O ' ' N ' ' S' ' 102' ' ' GLU . 9.6 t90 -74.42 -62.04 1.66 Allowed 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.925 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.473 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -34.64 -39.67 0.09 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' S' ' 100' ' ' LEU . 2.0 mm-40 -42.27 -42.87 3.23 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.048 -1.461 . . . . 0.0 107.135 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' S' ' 99' ' ' TRP . 3.3 mt-10 -82.86 -27.06 31.03 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.894 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . . . . . . . . . 8.0 t -83.4 -39.14 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 C-N-CA 116.66 -2.016 . . . . 0.0 112.962 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.55 -50.17 7.03 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 118.743 -1.183 . . . . 0.0 111.35 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . 0.458 ' H ' HD21 ' S' ' 105' ' ' LEU . 1.0 OUTLIER -87.15 11.74 13.25 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.913 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' S' ' 105' ' ' LEU . 21.2 tttm -32.3 -41.87 0.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.598 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.873 -179.977 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.825 0.345 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 9.75 10.39 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.125 -1.03 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.425 ' C ' ' N ' ' R' ' 19' ' ' TRP . 6.2 tt0 -85.7 -84.36 0.16 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.66 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -30.84 0.99 Allowed 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 122.897 1.332 . . . . 0.0 109.008 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . 0.425 ' N ' ' C ' ' R' ' 17' ' ' GLN . 54.3 t-105 -55.12 -56.75 16.33 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.804 -1.998 . . . . 0.0 109.059 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.3 tp -51.85 -38.16 54.87 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.898 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' R' ' 22' ' ' PHE . 21.9 mtp180 -56.82 -64.34 0.91 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.781 -1.168 . . . . 0.0 111.195 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.474 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -35.82 -48.12 0.54 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 118.813 -1.155 . . . . 0.0 111.435 179.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . 0.471 ' O ' ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -76.61 -68.44 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.975 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 9.0 t70 -39.84 -28.49 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.112 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . 0.471 ' N ' ' O ' ' R' ' 23' ' ' VAL . 10.2 tp -77.73 -56.77 4.24 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.347 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 tt -41.09 -59.43 1.49 Allowed 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . 0.426 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.1 OUTLIER -54.45 -60.9 2.72 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.287 -0.965 . . . . 0.0 111.088 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -43.21 -24.29 0.08 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.401 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -97.9 -31.89 11.96 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.197 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -50.73 -38.08 45.45 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 118.794 -1.163 . . . . 0.0 110.105 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -27.37 69.09 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.082 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . 0.437 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.4 m120 -101.61 -10.15 20.32 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.087 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . 0.437 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.5 m-20 75.71 17.32 2.35 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.413 0.625 . . . . 0.0 110.291 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -85.27 -15.33 43.81 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.621 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 9.5 p-80 -52.24 -13.94 0.39 Allowed 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.797 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 8.2 mt -79.27 -66.01 0.28 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 117.504 -1.679 . . . . 0.0 110.147 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.2 Cg_endo -53.98 -26.97 42.92 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 N-CA-C 109.501 -1.0 . . . . 0.0 109.501 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 1.5 tp -77.48 -35.53 53.6 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.947 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.68 -33.74 64.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -74.64 5.18 5.12 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.256 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mt -113.23 -58.08 2.2 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 119.817 -0.753 . . . . 0.0 112.812 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.91 36.29 0.72 Allowed 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 118.381 -1.328 . . . . 0.0 112.876 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 165.24 140.64 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 114.719 -1.128 . . . . 0.0 108.591 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.565 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -33.35 0.0 OUTLIER Pre-proline 0 N--CA 1.496 1.838 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.565 ' CD ' ' H ' ' R' ' 44' ' ' THR . 34.9 Cg_endo -88.99 -103.16 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.146 0 C-N-CA 121.054 1.169 . . . . 0.0 112.16 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' R' ' 50' ' ' ALA . 0.6 OUTLIER -52.21 -13.56 0.34 Allowed 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.411 -179.883 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . 0.475 ' N ' ' C ' ' R' ' 45' ' ' PRO . 7.1 mm-40 -69.79 -61.67 1.69 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.079 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -21.92 13.14 Favored 'General case' 0 C--N 1.299 -1.604 0 C-N-CA 118.94 -1.104 . . . . 0.0 110.39 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -108.08 -71.68 0.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.595 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' R' ' 46' ' ' ASP . . . -48.86 -36.99 18.25 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . 0.402 ' HG ' ' N ' ' R' ' 52' ' ' GLY . 0.2 OUTLIER -69.57 -38.67 77.48 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.932 -179.892 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . 0.402 ' N ' ' HG ' ' R' ' 51' ' ' LEU . . . -65.99 -28.14 73.42 Favored Glycine 0 N--CA 1.485 1.901 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.552 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -63.61 -79.45 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.54 -0.83 . . . . 0.0 110.594 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . 0.438 ' C ' ' O ' ' R' ' 53' ' ' THR . 1.2 ptp180 -36.02 -50.5 0.69 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 123.796 0.685 . . . . 0.0 111.286 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.69 -36.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 118.04 -1.464 . . . . 0.0 110.314 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' R' ' 53' ' ' THR . 2.8 mtm180 -75.37 -40.44 58.04 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.533 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.559 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -70.34 -38.99 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 116.869 -1.933 . . . . 0.0 109.532 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.559 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 54.3 t -59.82 -59.28 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 117.73 -1.588 . . . . 0.0 109.33 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.59 -24.73 5.78 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.781 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.77 -50.73 16.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.942 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.89 -31.6 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.368 -0.933 . . . . 0.0 112.562 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tp . . . . . 0 N--CA 1.494 1.754 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.327 -179.946 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 87.56 97.34 0.9 Allowed Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.047 -1.549 . . . . 0.0 109.927 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.426 ' C ' ' O ' ' R' ' 78' ' ' GLY . 0.1 OUTLIER -20.71 -44.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.499 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -50.01 -12.83 0.09 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.285 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 81' ' ' THR . . . . . 0.426 ' N ' ' O ' ' R' ' 79' ' ' ILE . 17.0 m -88.95 -51.13 5.78 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -80.5 6.83 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.423 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -105.34 -13.55 15.62 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.649 -1.22 . . . . 0.0 112.737 -179.92 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.73 -33.52 11.68 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.408 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.35 -29.34 2.51 Favored Glycine 0 N--CA 1.484 1.89 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.729 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 86' ' ' SER . . . . . 0.415 ' C ' ' H ' ' R' ' 88' ' ' SER . 0.4 OUTLIER -96.41 -50.69 4.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 118.629 -1.229 . . . . 0.0 112.219 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . 0.539 ' N ' ' OD1' ' R' ' 87' ' ' ASN . 0.7 OUTLIER -68.14 5.83 0.87 Allowed 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.651 -0.82 . . . . 0.0 112.489 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' R' R ' 88' ' ' SER . . . . . 0.415 ' H ' ' C ' ' R' ' 86' ' ' SER . 42.5 m -116.45 -46.9 2.76 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.401 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.2 tt -46.65 -36.4 6.98 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.199 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -66.14 -70.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 122.062 0.935 . . . . 0.0 112.393 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 92' ' ' ALA . . . -58.86 -82.52 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 113.813 -1.54 . . . . 0.0 112.781 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 91' ' ' ALA . . . 58.1 150.27 0.07 OUTLIER Pre-proline 0 N--CA 1.492 1.634 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.037 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -54.3 152.88 23.99 Favored 'Trans proline' 0 C--O 1.214 -0.701 0 C-N-CA 121.079 1.186 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 33.5 t -74.51 -61.49 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 C-N-CA 119.36 -0.936 . . . . 0.0 112.992 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.46 -16.98 41.85 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.466 -0.893 . . . . 0.0 112.997 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -79.6 -35.72 39.15 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 118.775 -1.17 . . . . 0.0 111.308 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.85 -24.97 55.8 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 118.892 -1.123 . . . . 0.0 109.918 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -65.69 -19.3 65.85 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.053 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 21.0 t90 -97.16 -55.02 2.98 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.99 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.443 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.0 mm? -39.59 -28.84 0.05 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.02 -1.072 . . . . 0.0 113.542 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' R' ' 100' ' ' LEU . 10.2 mm-40 -47.1 -39.02 12.41 Favored 'General case' 0 C--N 1.292 -1.93 0 C-N-CA 117.717 -1.593 . . . . 0.0 107.519 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -89.47 -28.55 19.61 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 113.936 -1.483 . . . . 0.0 112.415 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 10.4 t -78.82 -34.0 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.16 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.0 -48.86 16.78 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.315 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . 0.472 ' C ' ' CD1' ' R' ' 105' ' ' LEU . 2.4 tm? -58.05 -44.04 87.22 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.837 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt . . . . . 0 N--CA 1.488 1.434 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.3 -179.979 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 121.602 0.715 . . . . 0.0 110.684 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -117.46 12.6 14.23 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.447 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.478 ' C ' ' N ' ' S' ' 19' ' ' TRP . 1.2 mt-30 -89.62 -81.41 0.28 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.115 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.539 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 3.1 mp0 -42.12 -30.61 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 122.942 1.353 . . . . 0.0 108.158 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . 0.478 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.26 72.2 t-105 -56.44 -56.09 25.5 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.269 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' S' ' 17' ' ' GLN . 5.9 tp -58.87 -27.34 65.08 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.845 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.457 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.9 mtt85 -66.49 -74.42 0.11 Allowed 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.48 -1.288 . . . . 0.0 109.65 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.457 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -36.34 -42.45 0.32 Allowed 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.172 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . 0.416 ' O ' ' C ' ' S' ' 24' ' ' ASP . 3.0 t -69.79 -56.03 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.7 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' S' ' 23' ' ' VAL . 22.6 t0 -35.94 -73.31 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.725 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . 0.402 ' CD2' ' N ' ' S' ' 25' ' ' LEU . 0.1 OUTLIER -49.97 -46.16 52.15 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.584 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 tp -45.18 -30.5 1.19 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.057 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.25 -71.77 0.34 Allowed 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.464 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -50.62 -27.04 6.11 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.59 -50.1 12.1 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.94 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . 0.443 ' CD1' ' C ' ' S' ' 30' ' ' TYR . 11.2 t80 -44.55 -38.24 4.07 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.247 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -46.38 -37.23 7.29 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.711 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.65 -79.34 0.54 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.788 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 172.73 35.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.953 0.882 . . . . 0.0 109.322 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -100.95 -19.37 15.9 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.767 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -57.08 -17.98 12.58 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.544 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.2 mt -76.84 -63.33 0.54 Allowed Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 118.263 -1.375 . . . . 0.0 110.304 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 5.4 Cg_exo -50.98 -32.0 36.66 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 N-CA-C 109.863 -0.861 . . . . 0.0 109.863 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 mt -67.85 -43.54 79.25 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . 0.458 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.3 OUTLIER -54.78 -34.06 62.17 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.101 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -83.89 10.69 9.1 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.81 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.38 -63.58 1.39 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.929 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mtt -91.39 33.58 0.99 Allowed 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.709 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . 0.458 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.6 OUTLIER 164.91 142.23 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 O-C-N 123.439 0.462 . . . . 0.0 110.021 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.503 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.25 -42.41 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.313 0 C-N-CA 117.196 -1.802 . . . . 0.0 115.238 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.503 ' HD2' ' H ' ' S' ' 44' ' ' THR . 16.0 Cg_endo -76.64 -110.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 121.12 1.213 . . . . 0.0 113.403 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . 0.428 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 1.0 OUTLIER -51.28 -16.95 0.6 Allowed 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.49 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . 0.401 ' N ' ' C ' ' S' ' 45' ' ' PRO . 5.9 mm-40 -65.76 -66.99 0.48 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.016 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -51.82 -42.2 62.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.113 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.08 -68.9 0.31 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.051 -1.06 . . . . 0.0 112.208 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.44 -22.57 21.01 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.191 -1.004 . . . . 0.0 111.257 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 5.7 tt -67.68 -53.27 29.08 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.87 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.69 -52.1 52.67 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.684 -1.766 . . . . 0.0 108.684 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.551 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.1 OUTLIER -39.83 -74.46 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.982 0.896 . . . . 0.0 111.071 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . 0.536 ' HE ' ' CG2' ' S' ' 55' ' ' VAL . 0.0 OUTLIER -41.76 -39.03 1.61 Allowed 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 113.868 -1.514 . . . . 0.0 112.638 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . 0.536 ' CG2' ' HE ' ' S' ' 54' ' ' ARG . 13.4 t -73.6 -27.68 23.63 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 C-N-CA 117.874 -1.53 . . . . 0.0 108.209 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.1 OUTLIER -80.97 -35.28 32.33 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.91 -1.041 . . . . 0.0 112.306 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . 0.524 ' CD1' ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -73.08 -35.98 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 116.662 -2.015 . . . . 0.0 106.997 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . 0.524 ' N ' ' CD1' ' S' ' 57' ' ' ILE . 9.9 t -62.25 -63.32 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 C-N-CA 118.68 -1.208 . . . . 0.0 109.536 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -50.57 -32.01 17.41 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.926 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -73.76 -54.17 8.65 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.859 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 15.6 mt -46.68 -26.5 0.93 Allowed 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.934 -1.106 . . . . 0.0 109.903 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.16 -35.62 64.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.841 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 . . . . . 0 N--CA 1.491 1.584 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.167 179.921 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 tttm . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 121.044 0.449 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . 0.533 ' O ' ' N ' ' S' ' 75' ' ' LEU . 1.0 OUTLIER -110.16 21.73 16.4 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.885 0.85 . . . . 0.0 110.088 -179.947 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 58.69 -66.64 0.03 OUTLIER 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 112.901 -1.954 . . . . 0.0 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' S' ' 73' ' ' ASN . 4.0 mt -75.1 -15.5 60.6 Favored 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.957 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -74.46 -28.54 63.42 Favored Glycine 0 N--CA 1.491 2.317 0 C-N-CA 119.635 -1.269 . . . . 0.0 110.868 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -159.85 -77.65 0.06 Allowed 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.727 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' S' ' 81' ' ' THR . . . 140.85 109.76 0.8 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.618 -1.793 . . . . 0.0 108.618 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.498 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -29.46 -45.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -179.777 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.54 -46.84 87.7 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.982 -1.087 . . . . 0.0 111.077 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 81' ' ' THR . . . . . 0.471 ' N ' ' O ' ' S' ' 78' ' ' GLY . 61.0 m -53.57 -45.01 69.78 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 pt -84.74 10.15 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 118.71 -1.196 . . . . 0.0 113.986 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.522 ' C ' ' H ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -108.06 -52.71 2.73 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.324 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -63.17 0.38 0.63 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.466 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . 0.522 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -70.86 -9.82 66.74 Favored Glycine 0 N--CA 1.487 2.038 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.212 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 86' ' ' SER . . . . . 0.493 ' C ' ' H ' ' S' ' 88' ' ' SER . 9.4 p -126.72 -42.92 1.74 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.028 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . 0.436 ' N ' ' OG ' ' S' ' 86' ' ' SER . 0.9 OUTLIER -57.95 -7.19 0.7 Allowed 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.026 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.493 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -66.29 -31.16 71.8 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.946 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 4.5 mt -45.68 -28.27 0.97 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.018 -1.073 . . . . 0.0 109.758 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' S' ' 92' ' ' ALA . 60.6 mttt -92.25 -75.73 0.48 Allowed 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.122 0.963 . . . . 0.0 110.385 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -40.21 -27.08 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.921 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . 0.444 ' N ' ' O ' ' S' ' 90' ' ' LYS . . . -91.1 149.71 40.41 Favored Pre-proline 0 N--CA 1.489 1.488 0 C-N-CA 118.972 -1.091 . . . . 0.0 111.707 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -54.8 160.68 7.18 Favored 'Trans proline' 0 C--O 1.215 -0.673 0 C-N-CA 121.403 1.402 . . . . 0.0 111.699 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' S' ' 96' ' ' LEU . 83.6 t -88.42 -26.57 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 118.774 -1.171 . . . . 0.0 109.63 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -58.87 -8.82 1.5 Allowed 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.732 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' S' ' 94' ' ' VAL . 2.5 mt -66.1 -51.66 55.95 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.817 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.21 -50.38 3.59 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.041 -0.663 . . . . 0.0 111.911 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -55.98 -30.12 61.31 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.837 -0.745 . . . . 0.0 112.791 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . 0.427 ' O ' ' N ' ' S' ' 102' ' ' GLU . 7.8 t90 -86.07 -54.13 4.66 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.808 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.451 ' O ' ' C ' ' S' ' 101' ' ' GLU . 2.1 mm? -40.14 -41.49 1.28 Allowed 'General case' 0 C--N 1.293 -1.871 0 C-N-CA 118.802 -1.159 . . . . 0.0 113.663 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' S' ' 100' ' ' LEU . 4.5 mt-10 -46.11 -30.33 1.86 Allowed 'General case' 0 C--N 1.289 -2.064 0 C-N-CA 118.26 -1.376 . . . . 0.0 108.229 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.427 ' N ' ' O ' ' S' ' 99' ' ' TRP . 3.9 mm-40 -87.79 -39.25 15.05 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.319 -1.31 . . . . 0.0 114.026 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -82.77 -18.8 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 C-N-CA 114.826 -2.749 . . . . 0.0 111.192 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -87.28 -50.92 6.26 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.732 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.77 -53.26 58.81 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.46 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -56.31 -59.94 4.23 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.976 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 116.431 -1.747 . . . . 0.0 110.344 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.667 0.27 . . . . 0.0 110.479 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -158.87 27.11 0.22 Allowed 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.604 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -110.44 -79.15 0.58 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -61.41 -30.69 70.72 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 9.6 t-105 -62.02 -55.0 33.73 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.146 -1.843 . . . . 0.0 107.417 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . 0.472 ' C ' ' CD1' ' R' ' 20' ' ' LEU . 1.9 tm? -56.05 -39.67 72.38 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 112.681 -2.054 . . . . 0.0 109.544 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.479 ' O ' ' C ' ' R' ' 22' ' ' PHE . 4.6 mtt-85 -50.47 -69.68 0.11 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 117.858 -1.537 . . . . 0.0 109.044 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.546 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -32.77 -47.05 0.16 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 119.811 -0.755 . . . . 0.0 111.009 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 77.2 t -66.84 -59.23 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.378 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -37.66 -63.47 0.46 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . 0.529 ' CD2' ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -65.14 -41.94 94.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.253 -1.379 . . . . 0.0 112.205 -179.838 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . 0.449 ' CD1' ' C ' ' R' ' 26' ' ' LEU . 2.8 tm? -47.41 -54.65 10.75 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.145 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . 0.504 ' O ' ' NZ ' ' S' ' 27' ' ' LYS . 0.0 OUTLIER -78.66 -24.35 45.23 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.046 -1.062 . . . . 0.0 112.203 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.71 -14.09 59.0 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.891 -1.124 . . . . 0.0 110.891 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.49 -45.85 5.97 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.462 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -42.69 -27.4 0.17 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.467 -0.893 . . . . 0.0 110.855 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -56.4 -43.58 79.44 Favored 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.037 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -96.4 -79.66 0.44 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.62 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 172.56 27.74 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.693 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . 0.564 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 0.8 OUTLIER -95.03 -14.27 24.46 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.816 -179.889 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 16.7 p-80 -52.14 -24.84 7.63 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.12 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.438 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -74.33 -62.75 0.95 Allowed Pre-proline 0 C--N 1.301 -1.517 0 C-N-CA 117.965 -1.494 . . . . 0.0 110.538 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.0 Cg_endo -54.31 -22.12 25.42 Favored 'Trans proline' 0 C--N 1.32 -0.949 0 C-N-CA 120.544 0.829 . . . . 0.0 110.469 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.41 -30.13 23.83 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.889 -0.724 . . . . 0.0 110.257 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . 0.487 ' O ' ' CD1' ' R' ' 43' ' ' LEU . 0.1 OUTLIER -64.41 -29.36 70.42 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.166 -1.013 . . . . 0.0 108.393 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . 0.438 ' O ' ' OD1' ' R' ' 40' ' ' ASN . 0.0 OUTLIER -82.23 6.49 16.54 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.495 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 mt -106.91 -55.48 2.32 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 119.975 -0.69 . . . . 0.0 112.509 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -96.65 34.2 1.71 Allowed 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.074 -1.051 . . . . 0.0 112.762 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . 0.487 ' CD1' ' O ' ' R' ' 39' ' ' LEU . 0.7 OUTLIER 169.21 150.41 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 179.893 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.12 -40.94 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 116.152 -2.219 . . . . 0.0 115.898 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -105.99 -98.96 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.121 1.214 . . . . 0.0 113.954 -179.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -50.18 -24.35 2.76 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.08 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.33 -48.71 80.1 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 118.78 -1.168 . . . . 0.0 110.087 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ttp180 -66.11 -38.0 87.14 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.977 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -62.59 -70.73 0.19 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.906 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.27 -31.73 1.67 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.223 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.72 -69.68 0.18 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.565 -0.854 . . . . 0.0 110.591 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.34 -52.59 6.08 Favored Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.697 -1.239 . . . . 0.0 110.104 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.487 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -43.29 -76.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.022 0.915 . . . . 0.0 111.521 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . 0.457 ' C ' ' CD ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -37.72 -49.0 1.12 Allowed 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.518 -1.674 . . . . 0.0 114.176 -179.878 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . 0.456 ' N ' ' HG3' ' R' ' 54' ' ' ARG . 64.0 t -66.28 -23.12 31.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 C-N-CA 117.561 -1.655 . . . . 0.0 109.489 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' R' ' 53' ' ' THR . 3.0 ptt180 -81.64 -39.57 24.21 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.602 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.467 ' C ' ' CD1' ' R' ' 57' ' ' ILE . 0.4 OUTLIER -71.46 -37.75 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 117.545 -1.662 . . . . 0.0 107.185 179.784 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . . . . . . . . . 25.6 t -63.15 -69.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 119.111 -1.035 . . . . 0.0 109.905 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -48.43 -21.25 0.51 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.389 -0.924 . . . . 0.0 111.363 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -76.29 -53.47 8.17 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.186 -1.006 . . . . 0.0 112.814 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pp -62.43 -24.69 67.56 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 118.228 -1.389 . . . . 0.0 111.204 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mt . . . . . 0 C--N 1.305 -1.351 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.763 179.888 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.006 0.432 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 146.44 9.03 Favored Glycine 0 N--CA 1.488 2.156 0 C-N-CA 119.525 -1.322 . . . . 0.0 110.751 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.488 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -39.84 -36.64 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.642 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.531 ' O ' ' NE ' ' R' ' 84' ' ' ARG . . . -52.75 -37.11 58.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.672 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 81' ' ' THR . . . . . 0.541 ' CG2' ' N ' ' R' ' 82' ' ' ILE . 3.9 t -68.81 -50.9 46.31 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.388 -0.925 . . . . 0.0 113.129 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . 0.541 ' N ' ' CG2' ' R' ' 81' ' ' THR . 12.2 pt -73.09 10.69 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.334 -1.346 . . . . 0.0 112.447 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -93.52 -68.25 0.81 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.801 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . 0.692 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.51 -23.57 10.78 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.63 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.72 -50.17 55.02 Favored Glycine 0 N--CA 1.49 2.283 0 C-N-CA 119.422 -1.37 . . . . 0.0 110.331 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 56.1 m -93.65 -26.27 17.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -86.07 3.66 41.48 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.435 -0.906 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -26.04 59.73 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.703 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.77 -30.34 61.11 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.146 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.24 -51.69 3.07 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.306 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.18 0.11 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.537 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -96.74 163.99 19.06 Favored Pre-proline 0 N--CA 1.489 1.518 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.583 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -49.37 152.55 5.66 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 C-N-CA 121.438 1.425 . . . . 0.0 111.507 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.54 10.52 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 119.933 -0.707 . . . . 0.0 111.409 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.62 -11.69 58.74 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.188 -1.005 . . . . 0.0 111.619 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 pp -97.37 -32.9 11.63 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.359 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.39 -29.17 3.74 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.212 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -82.77 -42.03 18.45 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.788 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -62.23 -60.01 4.2 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.602 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.28 -26.5 0.06 Allowed 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.127 -1.029 . . . . 0.0 113.244 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.452 ' C ' ' O ' ' R' ' 100' ' ' LEU . 2.1 mm-40 -48.62 -38.9 22.19 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 117.412 -1.715 . . . . 0.0 106.563 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -88.65 -28.78 20.4 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 113.26 -1.791 . . . . 0.0 112.276 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 t -91.22 -3.45 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 117.489 -1.684 . . . . 0.0 110.813 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' R' ' 100' ' ' LEU . 29.3 tp -101.33 -51.79 3.4 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.692 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . 0.489 ' C ' ' CD1' ' R' ' 105' ' ' LEU . 0.5 OUTLIER -66.17 -26.57 67.48 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 118.905 -1.118 . . . . 0.0 110.525 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 8.6 tttp . . . . . 0 N--CA 1.487 1.389 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.553 -179.983 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 9.7 mtt180 . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.966 0.412 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -133.68 -4.28 2.9 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' S' ' 18' ' ' GLU . 5.6 mt-30 -87.78 -84.19 0.2 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.977 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.403 ' C ' ' O ' ' S' ' 17' ' ' GLN . 3.1 mp0 -45.54 -35.26 3.78 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -44.44 -53.93 6.43 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.564 -1.653 . . . . 0.0 108.685 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . 0.415 ' O ' ' C ' ' S' ' 21' ' ' ARG . 7.5 tp -59.78 -46.32 89.54 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 113.758 -1.565 . . . . 0.0 111.758 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.473 ' N ' ' CD ' ' S' ' 21' ' ' ARG . 3.4 mpt_? -44.48 -66.17 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.578 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.471 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -35.59 -51.03 0.63 Allowed 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.862 179.527 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' S' ' 26' ' ' LEU . 30.7 t -67.76 -68.51 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.815 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' S' ' 23' ' ' VAL . 13.2 t0 -20.86 -54.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 124.248 0.968 . . . . 0.0 113.107 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . 0.453 ' C ' ' N ' ' S' ' 27' ' ' LYS . 1.7 mt -74.26 -47.58 34.2 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.778 -1.169 . . . . 0.0 109.695 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' S' ' 23' ' ' VAL . 0.2 OUTLIER -47.42 -16.73 0.06 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.409 -0.916 . . . . 0.0 110.974 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . 0.529 ' O ' ' N ' ' S' ' 29' ' ' ALA . 5.7 tptm -93.95 -73.53 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.591 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -46.33 -9.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.607 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . 0.529 ' N ' ' O ' ' S' ' 27' ' ' LYS . . . -91.72 -42.22 10.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.722 -1.191 . . . . 0.0 112.331 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . 0.449 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 28.1 t80 -43.78 -29.82 0.58 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 118.916 -1.114 . . . . 0.0 110.802 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -36.09 66.13 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.196 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 29.9 m120 -92.78 -7.17 47.27 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.656 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.418 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.7 OUTLIER 76.43 29.58 0.7 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.388 0.613 . . . . 0.0 110.249 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -95.71 -14.25 23.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.999 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -45.56 -33.72 2.93 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 113.813 -1.54 . . . . 0.0 113.334 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.46 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.9 mt -68.24 -64.58 1.77 Allowed Pre-proline 0 C--N 1.304 -1.378 0 C-N-CA 117.442 -1.703 . . . . 0.0 110.12 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.46 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.6 Cg_exo -47.42 -26.83 6.43 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 C-N-CA 120.524 0.816 . . . . 0.0 110.184 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.93 -37.65 34.12 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.429 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . 0.482 ' O ' ' CD1' ' S' ' 43' ' ' LEU . 0.4 OUTLIER -57.38 -27.29 62.18 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.695 179.865 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.4 5.91 39.92 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.45 -63.05 1.46 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 42' ' ' MET . . . . . 0.592 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -89.04 34.13 0.79 Allowed 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 118.578 -1.249 . . . . 0.0 112.397 -179.713 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . 0.482 ' CD1' ' O ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER 170.26 141.54 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.776 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.711 ' HG1' HH21 ' S' ' 48' ' ' ARG . 0.3 OUTLIER -176.22 -32.19 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 115.972 1.842 . . . . 0.0 115.972 -179.699 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' S' ' 44' ' ' THR . 24.6 Cg_endo -87.64 -102.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 121.609 1.539 . . . . 0.0 112.529 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' S' ' 50' ' ' ALA . 8.7 m-20 -49.74 -34.93 20.46 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 118.556 -1.258 . . . . 0.0 108.047 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -49.61 -61.63 2.0 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.507 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . 0.711 HH21 ' HG1' ' S' ' 44' ' ' THR . 0.0 OUTLIER -45.63 -47.46 14.79 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.891 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -83.79 -65.83 0.96 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.478 -1.289 . . . . 0.0 113.009 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . 0.47 ' N ' ' O ' ' S' ' 46' ' ' ASP . . . -44.57 -46.5 9.98 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.417 -0.913 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 44.3 mt -45.98 -58.04 3.9 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 118.844 -1.142 . . . . 0.0 110.832 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.63 -54.15 18.28 Favored Glycine 0 N--CA 1.483 1.806 0 C-N-CA 118.84 -1.648 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.45 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.1 OUTLIER -43.14 -83.32 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -179.84 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . 0.433 ' CD ' ' O ' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -43.76 -63.7 0.8 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 58.8 t -45.13 -29.42 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.968 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.525 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -92.2 -36.9 13.01 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 118.18 -1.408 . . . . 0.0 112.21 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . 0.465 ' CD1' ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -62.99 -31.35 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 C-N-CA 115.419 -2.513 . . . . 0.0 105.064 179.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . 0.465 ' N ' ' CD1' ' S' ' 57' ' ' ILE . 31.3 t -62.0 -64.84 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 CA-C-N 114.879 -1.055 . . . . 0.0 108.19 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.8 -33.1 15.58 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.746 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -70.43 -54.11 13.7 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.559 -0.857 . . . . 0.0 111.719 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 31.5 mt -53.13 -24.18 9.87 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.681 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 tp -57.47 -38.89 75.25 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.045 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 . . . . . 0 N--CA 1.491 1.58 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.972 179.786 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 5.2 tttm . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 110.673 -0.121 . . . . 0.0 110.673 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . 0.408 ' O ' ' CB ' ' S' ' 74' ' ' GLU . 0.2 OUTLIER -113.99 -31.38 6.4 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.541 0.686 . . . . 0.0 109.638 179.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' S' ' 73' ' ' ASN . 2.9 pt-20 153.76 -58.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.042 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . 0.406 ' H ' ' CG ' ' S' ' 74' ' ' GLU . 0.3 OUTLIER -108.93 21.48 17.17 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 119.837 -0.745 . . . . 0.0 109.237 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -97.6 -49.19 1.85 Allowed Glycine 0 N--CA 1.492 2.396 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.436 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . 175.94 97.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.517 0.675 . . . . 0.0 110.352 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.71 159.97 8.59 Favored Glycine 0 N--CA 1.482 1.713 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.809 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.503 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.6 OUTLIER -49.33 -38.0 11.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 CA-C-N 114.399 -0.901 . . . . 0.0 110.266 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.414 ' C ' ' O ' ' S' ' 79' ' ' ILE . . . -38.44 -44.31 0.92 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.226 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 24.4 m -71.81 -43.75 65.09 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 122.082 0.944 . . . . 0.0 112.211 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -81.33 12.31 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.26 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 -179.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.503 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -126.25 -18.91 4.83 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 118.934 -1.106 . . . . 0.0 113.508 179.729 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . 0.516 ' C ' ' CD ' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -87.06 -19.99 27.79 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 118.254 -1.378 . . . . 0.0 109.05 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.0 -18.75 49.58 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.274 -1.441 . . . . 0.0 110.102 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t -84.35 -60.34 2.11 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.913 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.49 2.92 20.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.625 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.457 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.2 OUTLIER -55.79 -48.9 74.55 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.768 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 pp -46.88 -14.48 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.386 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . 0.457 ' N ' ' O ' ' S' ' 88' ' ' SER . 17.7 tptt -49.09 -52.89 23.09 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.64 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.49 -38.25 13.5 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.258 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 54.6 60.32 10.44 Favored Pre-proline 0 C--N 1.303 -1.424 0 C-N-CA 119.833 -0.747 . . . . 0.0 111.842 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -63.07 97.49 0.19 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 121.239 1.292 . . . . 0.0 110.667 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -56.75 -10.42 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.905 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -83.48 -24.09 31.92 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.548 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . 0.421 ' O ' ' N ' ' S' ' 99' ' ' TRP . 3.7 mp -84.29 -51.31 7.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.211 -0.996 . . . . 0.0 111.181 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.52 -32.82 3.6 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.95 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -82.13 -24.26 35.19 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.387 -0.925 . . . . 0.0 110.584 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . 0.421 ' N ' ' O ' ' S' ' 96' ' ' LEU . 4.7 t90 -95.09 -63.54 1.16 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.256 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.511 ' O ' ' C ' ' S' ' 101' ' ' GLU . 2.0 mm? -35.58 -39.57 0.14 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.511 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -40.72 -41.47 1.54 Allowed 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 118.155 -1.418 . . . . 0.0 107.571 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.9 -28.09 23.0 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 113.756 -1.565 . . . . 0.0 112.652 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . 0.405 ' O ' ' OG ' ' S' ' 107' ' ' SER . 3.3 t -84.03 -15.36 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 116.615 -2.034 . . . . 0.0 111.888 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 4.9 mt -99.8 -61.94 1.3 Allowed 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.826 -0.75 . . . . 0.0 111.913 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' S' ' 107' ' ' SER . 4.5 mm? -63.86 -75.21 0.08 Allowed 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.231 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -42.17 -23.44 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.731 -0.787 . . . . 0.0 110.841 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' S' S ' 107' ' ' SER . . . . . 0.477 ' N ' ' O ' ' S' ' 105' ' ' LEU . 19.6 p . . . . . 0 C--N 1.304 -1.371 0 CA-C-O 116.253 -1.832 . . . . 0.0 110.83 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 121.099 0.476 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -80.37 7.56 9.41 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.798 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.421 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.1 mp0 -84.97 -75.6 0.35 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.285 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -46.16 -30.7 2.05 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 122.804 1.288 . . . . 0.0 108.466 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . 0.421 ' N ' ' C ' ' R' ' 17' ' ' GLN . 67.2 t-105 -55.61 -58.51 7.48 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 112.645 -2.07 . . . . 0.0 110.229 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.9 tp -50.06 -23.6 2.18 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.521 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.541 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mmt85 -71.68 -69.7 0.37 Allowed 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.813 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.541 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.41 -37.39 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.19 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t -74.24 -50.48 27.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.413 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' R' ' 21' ' ' ARG . 38.5 t70 -41.17 -72.87 0.05 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.567 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -47.5 -44.85 25.81 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.579 -0.848 . . . . 0.0 111.13 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.88 -56.91 7.4 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.149 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -62.54 -35.9 80.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -81.24 -7.58 59.59 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.886 -1.126 . . . . 0.0 112.537 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' R' ' 31' ' ' GLN . . . -99.94 -57.98 2.02 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.105 -1.038 . . . . 0.0 112.83 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . 0.419 ' C ' ' O ' ' R' ' 29' ' ' ALA . 0.2 OUTLIER -34.53 -27.67 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.859 -179.771 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' R' ' 29' ' ' ALA . 1.2 tt0 -54.84 -44.54 74.03 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.801 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -103.43 -76.48 0.59 Allowed 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.965 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 178.8 27.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.966 -1.094 . . . . 0.0 112.06 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . 0.596 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 1.0 OUTLIER -99.61 -11.59 20.82 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.249 -0.981 . . . . 0.0 110.869 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . 0.424 ' N ' ' HB2' ' R' ' 29' ' ' ALA . 47.0 p-80 -59.25 -24.34 63.13 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.829 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.408 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 8.1 mt -76.13 -59.56 1.09 Allowed Pre-proline 0 C--N 1.303 -1.436 0 C-N-CA 118.018 -1.473 . . . . 0.0 110.81 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.408 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.5 Cg_exo -54.88 -36.29 91.2 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 N-CA-C 109.404 -1.037 . . . . 0.0 109.404 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.77 -43.84 95.21 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.619 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.55 -34.25 49.37 Favored 'General case' 0 C--O 1.203 -1.344 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -74.12 5.75 4.09 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.316 -0.953 . . . . 0.0 111.542 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.01 -56.64 2.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.46 12.33 2.53 Favored 'General case' 0 N--CA 1.501 2.098 0 C-N-CA 117.429 -1.709 . . . . 0.0 112.841 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 pp 179.95 146.58 0.24 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.548 ' N ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -175.44 -38.07 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 116.075 -2.25 . . . . 0.0 116.14 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' R' ' 44' ' ' THR . 41.4 Cg_endo -87.26 -109.43 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 121.444 1.429 . . . . 0.0 113.183 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -54.48 -32.75 58.43 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 119.721 -0.791 . . . . 0.0 110.275 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . 0.431 ' OE1' ' OE1' ' S' ' 47' ' ' GLU . 30.6 mt-10 -54.6 -64.6 0.78 Allowed 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.081 -1.047 . . . . 0.0 110.49 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.19 -38.32 11.75 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.171 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.52 -68.02 0.4 Allowed 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.351 -1.34 . . . . 0.0 111.938 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.499 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -65.84 -52.54 49.61 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.205 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . 0.499 ' C ' ' O ' ' R' ' 50' ' ' ALA . 3.2 tt -33.77 -48.89 0.3 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.526 -0.87 . . . . 0.0 110.357 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -64.85 -69.37 1.35 Allowed Glycine 0 N--CA 1.482 1.753 0 C-N-CA 119.564 -1.303 . . . . 0.0 110.104 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.449 ' C ' ' O ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -34.02 -69.14 0.1 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 122.319 1.057 . . . . 0.0 110.748 179.764 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . 0.471 ' CD ' ' N ' ' R' ' 54' ' ' ARG . 0.1 OUTLIER -35.18 -63.82 0.31 Allowed 'General case' 0 C--N 1.286 -2.156 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.908 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 12.0 p -60.52 -19.24 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 C-N-CA 116.739 -1.984 . . . . 0.0 111.947 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.436 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -83.62 -38.07 22.06 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.38 -0.928 . . . . 0.0 112.422 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.543 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -81.83 -34.58 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.872 -179.639 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.543 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 4.8 p -69.31 -39.92 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 118.045 -1.462 . . . . 0.0 111.37 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . 0.467 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 3.3 pt-20 -72.2 -30.57 65.07 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 118.383 -1.327 . . . . 0.0 110.584 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -74.63 -47.47 31.91 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.609 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.53 -26.71 67.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.015 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.425 0 C-N-CA 118.918 -1.113 . . . . 0.0 109.537 179.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.87 0.366 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 156.29 122.99 0.77 Allowed Glycine 0 N--CA 1.491 2.357 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.647 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.474 ' O ' ' OG1' ' R' ' 83' ' ' THR . 0.1 OUTLIER -37.14 -32.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.622 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.446 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.66 -56.02 14.39 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.962 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 19.7 m -42.89 -50.2 5.79 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 12.1 pt -71.0 -28.72 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 C-N-CA 119.0 -1.08 . . . . 0.0 113.02 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -61.02 -73.15 0.1 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 118.648 -1.221 . . . . 0.0 110.922 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -11.37 1.4 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.102 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -69.73 -28.76 71.7 Favored Glycine 0 N--CA 1.486 1.999 0 C-N-CA 119.775 -1.203 . . . . 0.0 110.99 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 40.2 t -150.32 57.24 0.95 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 118.603 -1.239 . . . . 0.0 112.197 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . 0.464 ' O ' ' CB ' ' R' ' 88' ' ' SER . 32.1 t-20 -94.36 -13.22 26.58 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 88' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER 75.1 -45.36 0.56 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.088 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.73 -25.93 65.89 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.55 -0.86 . . . . 0.0 111.302 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . 0.62 ' C ' ' H ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -48.9 -37.65 20.37 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.526 -1.27 . . . . 0.0 110.797 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' R' ' 92' ' ' ALA . . . -61.03 11.54 0.02 OUTLIER 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.032 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . 0.62 ' H ' ' C ' ' R' ' 90' ' ' LYS . . . -31.34 -59.65 0.32 Allowed Pre-proline 0 N--CA 1.493 1.698 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -51.31 95.28 0.03 OUTLIER 'Trans proline' 0 C--N 1.324 -0.763 0 C-N-CA 120.506 0.804 . . . . 0.0 110.725 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.13 -16.95 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.588 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.82 -28.62 67.73 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.362 -0.935 . . . . 0.0 111.274 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 4.3 mt -61.88 -41.05 97.4 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.481 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -55.86 -37.81 69.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.645 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.55 -29.37 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.6 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 3.0 t90 -99.2 -67.49 0.85 Allowed 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.362 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.578 ' O ' ' N ' ' R' ' 102' ' ' GLU . 1.3 mm? -38.6 -55.46 1.43 Allowed 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.545 ' C ' ' O ' ' R' ' 100' ' ' LEU . 12.7 pt-20 -33.24 -33.11 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.85 -1.14 . . . . 0.0 109.51 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' R' ' 100' ' ' LEU . 1.8 tm-20 -92.54 -32.41 14.85 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.802 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . 0.577 ' N ' ' O ' ' R' ' 100' ' ' LEU . 9.8 t -80.81 -15.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 116.959 -1.896 . . . . 0.0 110.883 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 1.8 tp -102.14 -55.25 2.52 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.937 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.16 -66.65 0.35 Allowed 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.983 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 26.2 tttt . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.503 -179.844 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 121.233 0.54 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -84.92 10.86 10.58 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.588 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . 0.417 ' C ' ' N ' ' S' ' 19' ' ' TRP . 20.8 mt-30 -76.99 -92.11 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.047 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.512 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 0.4 OUTLIER -44.25 -27.45 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 122.164 0.983 . . . . 0.0 109.54 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . 0.417 ' N ' ' C ' ' S' ' 17' ' ' GLN . 32.8 t-105 -53.6 -48.64 69.07 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.627 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' S' ' 17' ' ' GLN . 1.2 tt -59.84 -36.1 76.14 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 113.253 -1.794 . . . . 0.0 111.016 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 1.4 mpt_? -58.17 -73.02 0.08 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.28 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.556 ' C ' ' CD1' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -25.6 -50.67 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.78 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . 0.402 ' N ' ' O ' ' S' ' 21' ' ' ARG . 30.6 t -68.89 -63.05 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.745 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' S' ' 24' ' ' ASP . 21.7 t0 -35.55 -60.65 0.5 Allowed 'General case' 0 N--CA 1.488 1.469 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.838 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . 0.406 ' O ' ' N ' ' S' ' 27' ' ' LYS . 2.7 mt -57.24 -57.09 14.16 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.161 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -42.37 -25.05 0.07 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.243 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' S' ' 25' ' ' LEU . 3.3 mtpm? -82.45 -39.28 22.77 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.716 -1.194 . . . . 0.0 113.005 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -83.23 -20.7 34.08 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.42 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.95 -32.78 26.95 Favored 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.703 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . 0.498 ' O ' ' CD1' ' S' ' 30' ' ' TYR . 0.0 OUTLIER -56.59 -32.53 65.33 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.004 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -47.67 77.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.878 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.57 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 1.8 m120 -84.09 -41.96 16.6 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.781 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 22.1 t70 116.56 49.35 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.713 0 O-C-N 125.059 1.474 . . . . 0.0 109.393 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . 0.44 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 1.4 mm? -112.55 -14.0 13.26 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.996 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -52.22 -13.39 0.33 Allowed 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.528 -1.215 . . . . 0.0 112.89 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.481 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.5 mt -80.87 -66.19 0.25 Allowed Pre-proline 0 N--CA 1.486 1.34 0 C-N-CA 118.217 -1.393 . . . . 0.0 110.093 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.481 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.0 Cg_exo -49.55 -29.04 17.82 Favored 'Trans proline' 0 C--N 1.322 -0.862 0 N-CA-C 109.961 -0.823 . . . . 0.0 109.961 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . 0.558 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.2 mp -71.25 -51.49 24.28 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.469 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.57 -41.6 6.65 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.678 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -18.08 33.44 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.275 -0.97 . . . . 0.0 111.921 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 16.5 mt -94.25 -62.03 1.41 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.527 -0.869 . . . . 0.0 112.918 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 42' ' ' MET . . . . . 0.558 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.2 OUTLIER -81.46 10.55 5.6 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 117.927 -1.509 . . . . 0.0 111.781 -179.881 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.53 126.7 7.8 Favored 'General case' 0 N--CA 1.509 2.505 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.536 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.412 ' N ' ' CD ' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -166.53 -42.53 0.0 OUTLIER Pre-proline 0 N--CA 1.499 2.018 0 C-N-CA 116.456 -2.098 . . . . 0.0 116.506 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.412 ' CD ' ' N ' ' S' ' 44' ' ' THR . 43.7 Cg_endo -89.97 -105.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 120.771 0.98 . . . . 0.0 114.577 -179.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.33 -22.79 44.56 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.94 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . 0.431 ' OE1' ' OE1' ' R' ' 47' ' ' GLU . 5.0 mm-40 -56.97 -61.3 2.54 Favored 'General case' 0 C--N 1.296 -1.741 0 C-N-CA 118.534 -1.266 . . . . 0.0 109.315 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 4.8 mmt85 -55.2 -33.07 62.73 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.936 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -82.67 -66.67 0.86 Allowed 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 118.405 -1.318 . . . . 0.0 114.365 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -50.49 -41.15 52.97 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . 0.457 ' CD1' ' N ' ' S' ' 52' ' ' GLY . 3.7 pp -64.52 -42.25 95.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 117.456 -1.697 . . . . 0.0 111.333 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . 0.457 ' N ' ' CD1' ' S' ' 51' ' ' LEU . . . -55.45 -44.53 85.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 107.632 -2.187 . . . . 0.0 107.632 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.2 OUTLIER -46.71 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.921 -1.139 . . . . 0.0 113.096 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . . . . . . . . . 3.9 ppt_? -48.39 -37.48 17.03 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 119.17 -1.012 . . . . 0.0 113.442 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 35.2 t -57.6 -28.69 32.46 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.864 0 C-N-CA 117.841 -1.544 . . . . 0.0 109.192 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -83.15 -33.23 26.3 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . 0.498 ' CD1' ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -82.57 -29.58 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.105 0 C-N-CA 117.489 -1.684 . . . . 0.0 108.041 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . 0.498 ' N ' ' CD1' ' S' ' 57' ' ' ILE . 10.2 t -63.28 -48.99 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.81 -43.04 98.72 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.91 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.35 -45.76 92.32 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.021 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 97.7 mt -74.72 -31.83 61.96 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.15 -1.02 . . . . 0.0 113.131 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 12.8 tp -77.05 -43.08 35.84 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 118.419 -1.313 . . . . 0.0 112.272 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.297 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . 0.553 ' H ' ' CD ' ' S' ' 72' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . 0.661 ' O ' ' N ' ' S' ' 75' ' ' LEU . 0.7 OUTLIER -90.5 26.2 2.05 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 122.097 0.951 . . . . 0.0 108.671 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' S' ' 76' ' ' GLY . 1.0 OUTLIER 39.6 -71.22 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 112.586 -2.097 . . . . 0.0 112.722 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . 0.661 ' N ' ' O ' ' S' ' 73' ' ' ASN . 0.8 OUTLIER -40.78 -21.3 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.789 -179.981 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' S' ' 74' ' ' GLU . . . -84.01 -65.44 1.54 Allowed Glycine 0 N--CA 1.487 2.081 0 C-N-CA 119.678 -1.249 . . . . 0.0 110.348 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.03 -103.11 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.897 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . 0.405 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . -164.49 146.49 11.43 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.501 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -37.43 -39.09 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.886 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.9 -84.33 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -45.11 -19.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -179.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 4.1 pt -102.12 6.34 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 C-N-CA 118.38 -1.328 . . . . 0.0 113.523 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 83' ' ' THR . . . . . 0.496 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -99.68 -13.41 19.35 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.778 -1.169 . . . . 0.0 112.302 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.56 -36.09 8.9 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.704 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.11 71.69 Favored Glycine 0 N--CA 1.49 2.273 0 C-N-CA 119.66 -1.257 . . . . 0.0 110.83 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.1 p -88.79 -50.03 6.47 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.076 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . 0.516 ' C ' ' H ' ' S' ' 89' ' ' LEU . 1.4 p30 -87.63 -80.46 0.26 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.414 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.482 ' H ' ' CG ' ' S' ' 87' ' ' ASN . 0.2 OUTLIER 73.09 -37.65 0.39 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.338 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . 0.516 ' H ' ' C ' ' S' ' 87' ' ' ASN . 4.7 mt -64.32 -10.41 23.97 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.149 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . 0.402 ' O ' ' C ' ' S' ' 91' ' ' ALA . 16.3 mmtm -75.0 -58.64 3.16 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.241 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' S' ' 92' ' ' ALA . . . -36.14 -78.42 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.181 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.762 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . 0.602 ' N ' ' CD ' ' S' ' 93' ' ' PRO . . . 161.15 -33.68 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.71 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . 0.602 ' CD ' ' N ' ' S' ' 92' ' ' ALA . 6.2 Cg_exo -58.89 95.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.325 -0.695 0 C-N-CA 120.524 0.816 . . . . 0.0 112.607 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 58.4 t -95.13 -18.24 6.79 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.423 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.15 -2.99 6.43 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 3.6 tp -82.53 -36.54 26.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.435 -0.906 . . . . 0.0 111.62 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -1.39 7.34 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.93 -0.708 . . . . 0.0 112.771 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -106.06 -0.41 24.85 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . 0.572 ' O ' ' N ' ' S' ' 103' ' ' VAL . 5.7 t90 -112.53 -64.28 1.32 Allowed 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 114.17 -1.377 . . . . 0.0 113.467 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.865 ' CD2' ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -20.75 -82.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 119.058 2.984 . . . . 0.0 119.058 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.865 ' H ' ' CD2' ' S' ' 100' ' ' LEU . 0.0 OUTLIER -58.58 -43.66 89.53 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 119.15 -1.02 . . . . 0.0 109.071 -179.425 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.427 ' H ' ' HG3' ' S' ' 101' ' ' GLU . 1.6 tm-20 -63.15 -18.39 63.41 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . 0.572 ' N ' ' O ' ' S' ' 99' ' ' TRP . 0.5 OUTLIER -91.22 -54.13 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 C-N-CA 117.154 -1.819 . . . . 0.0 111.036 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . 0.464 ' N ' ' CG1' ' S' ' 103' ' ' VAL . 17.5 mt -51.98 -69.01 0.12 Allowed 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.442 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 8.1 mt -45.84 -74.46 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.888 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -43.49 -57.82 2.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.725 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 116.257 -1.83 . . . . 0.0 111.252 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 121.016 0.436 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -150.37 -3.26 0.36 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.421 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 17' ' ' GLN . . . . . 0.44 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.4 mt-30 -92.42 -79.52 0.39 Allowed 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.855 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 18' ' ' GLU . . . . . 0.596 ' H ' ' CD ' ' R' ' 18' ' ' GLU . 0.0 OUTLIER -48.57 -27.71 2.95 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.888 1.327 . . . . 0.0 107.779 179.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 19' ' ' TRP . . . . . 0.44 ' N ' ' C ' ' R' ' 17' ' ' GLN . 71.8 t-105 -51.62 -60.42 3.18 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 112.912 -1.949 . . . . 0.0 109.127 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -49.5 -31.61 10.47 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.404 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 21' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.3 mmt180 -61.91 -75.68 0.07 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 118.387 -1.325 . . . . 0.0 109.865 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 22' ' ' PHE . . . . . 0.465 ' C ' ' O ' ' R' ' 21' ' ' ARG . 8.7 t80 -36.32 -39.91 0.21 Allowed 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.404 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 23' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' R' ' 25' ' ' LEU . 46.6 t -73.05 -74.39 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.598 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 24' ' ' ASP . . . . . 0.437 ' C ' ' O ' ' R' ' 23' ' ' VAL . 29.8 t70 -37.85 -29.67 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.757 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 25' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' R' ' 23' ' ' VAL . 13.5 tp -70.54 -66.26 0.63 Allowed 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.142 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 tp -48.11 -56.25 8.27 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.372 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 27' ' ' LYS . . . . . 0.623 ' NZ ' ' CE1' ' S' ' 30' ' ' TYR . 0.1 OUTLIER -41.37 -57.13 2.26 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.256 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -78.35 -5.55 52.52 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.554 -0.858 . . . . 0.0 112.353 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 29' ' ' ALA . . . . . 0.425 ' O ' ' N ' ' R' ' 32' ' ' ASN . . . -83.24 -51.26 7.61 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.829 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 30' ' ' TYR . . . . . 0.418 ' O ' ' N ' ' R' ' 33' ' ' ASP . 24.0 t80 -41.23 -67.3 0.26 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.155 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -45.95 -25.82 0.61 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.653 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 32' ' ' ASN . . . . . 0.518 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 0.3 OUTLIER -93.19 -23.48 18.55 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.296 -179.909 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 33' ' ' ASP . . . . . 0.518 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 3.3 t0 85.69 23.09 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 123.695 0.622 . . . . 0.0 111.346 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 34' ' ' LEU . . . . . 0.484 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 0.6 OUTLIER -104.27 -13.37 16.18 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.679 0.752 . . . . 0.0 109.003 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 27.1 p-80 -49.38 -24.88 2.13 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 114.301 -1.318 . . . . 0.0 113.007 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.2 mt -77.83 -64.33 0.42 Allowed Pre-proline 0 N--CA 1.484 1.235 0 C-N-CA 118.081 -1.447 . . . . 0.0 110.893 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 37' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.2 Cg_endo -53.83 -23.9 28.95 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 N-CA-C 109.978 -0.816 . . . . 0.0 109.978 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 78.0 mt -83.9 -33.09 24.84 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.155 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 39' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 43' ' ' LEU . 1.0 OUTLIER -56.43 -32.53 64.97 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.814 179.752 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.77 3.52 25.49 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.792 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 4.9 mp -105.6 -65.17 1.08 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.255 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 42' ' ' MET . . . . . 0.512 ' N ' ' SD ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -94.65 37.59 1.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.23 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 43' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 39' ' ' LEU . 1.1 tp 179.31 127.06 0.07 Allowed 'General case' 0 N--CA 1.505 2.294 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 44' ' ' THR . . . . . 0.561 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.93 -39.22 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.669 0 C-N-CA 117.639 -1.624 . . . . 0.0 115.251 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 45' ' ' PRO . . . . . 0.561 ' HD2' ' H ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -76.14 -95.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.288 0 C-N-CA 120.814 1.009 . . . . 0.0 112.165 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 46' ' ' ASP . . . . . 0.417 ' O ' ' CB ' ' R' ' 50' ' ' ALA . 0.8 OUTLIER -55.86 -6.89 0.25 Allowed 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 118.804 -1.158 . . . . 0.0 109.454 -179.857 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 47' ' ' GLU . . . . . 0.605 ' OE2' ' CH2' ' S' ' 19' ' ' TRP . 25.2 tt0 -72.11 -79.92 0.07 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.044 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 48' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' R' ' 47' ' ' GLU . 9.7 mmm-85 -43.04 -24.59 0.07 Allowed 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.104 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 49' ' ' GLU . . . . . 0.486 ' N ' ' O ' ' R' ' 47' ' ' GLU . 5.4 mt-10 -88.57 -68.23 0.78 Allowed 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.648 -1.221 . . . . 0.0 111.822 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 50' ' ' ALA . . . . . 0.517 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -57.98 -60.55 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 51' ' ' LEU . . . . . 0.475 ' C ' ' O ' ' R' ' 50' ' ' ALA . 2.4 mp -33.48 -62.9 0.27 Allowed 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.439 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.36 -47.38 35.3 Favored Glycine 0 N--CA 1.485 1.929 0 C-N-CA 118.74 -1.695 . . . . 0.0 109.416 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 53' ' ' THR . . . . . 0.525 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -58.99 -81.22 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -34.04 -60.53 0.39 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.578 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.04 -31.08 35.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 C-N-CA 118.136 -1.426 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 56' ' ' ARG . . . . . 0.525 ' N ' ' O ' ' R' ' 53' ' ' THR . 22.2 mtp85 -80.73 -37.25 30.89 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.655 -1.218 . . . . 0.0 112.396 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 57' ' ' ILE . . . . . 0.446 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.45 -31.9 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 C-N-CA 116.801 -1.96 . . . . 0.0 108.297 -179.862 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 58' ' ' VAL . . . . . 0.446 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 2.7 t -61.96 -60.17 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 118.679 -1.208 . . . . 0.0 109.176 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -52.96 -34.88 57.8 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.808 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.73 -45.89 64.04 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.845 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 65.5 mt -84.82 0.24 51.54 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.563 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.699 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.878 0.37 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.76 145.23 7.27 Favored Glycine 0 N--CA 1.489 2.222 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.476 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 79' ' ' ILE . . . . . 0.495 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -44.75 -36.38 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.855 179.995 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 80' ' ' ALA . . . . . 0.539 ' O ' ' NH1' ' R' ' 84' ' ' ARG . . . -62.26 -31.44 72.01 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.511 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 81' ' ' THR . . . . . 0.514 ' C ' ' H ' ' R' ' 83' ' ' THR . 0.9 OUTLIER -86.6 -50.94 6.46 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.113 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -63.51 7.53 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.899 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 83' ' ' THR . . . . . 0.514 ' H ' ' C ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -91.54 -79.31 0.38 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.077 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 84' ' ' ARG . . . . . 0.733 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.58 -26.8 23.13 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.348 179.86 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.85 -44.69 81.53 Favored Glycine 0 N--CA 1.488 2.143 0 C-N-CA 119.343 -1.408 . . . . 0.0 109.924 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 86' ' ' SER . . . . . 0.423 ' C ' ' H ' ' R' ' 88' ' ' SER . 0.3 OUTLIER -94.23 -49.29 5.8 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.527 179.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 87' ' ' ASN . . . . . 0.552 ' ND2' ' N ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER -75.81 10.6 1.73 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.655 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 88' ' ' SER . . . . . 0.423 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.5 OUTLIER -41.51 -27.29 0.09 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.423 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 89' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' R' ' 87' ' ' ASN . 5.6 mt -61.02 -68.6 0.29 Allowed 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.722 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 90' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' R' ' 91' ' ' ALA . 9.4 mmtp -69.5 -75.37 0.11 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.665 0.745 . . . . 0.0 112.622 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 91' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -30.69 -64.83 0.13 Allowed 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.664 -1.607 . . . . 0.0 112.89 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.23 163.08 55.34 Favored Pre-proline 0 N--CA 1.49 1.527 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.774 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -59.23 131.58 41.91 Favored 'Trans proline' 0 C--N 1.32 -0.936 0 C-N-CA 121.656 1.571 . . . . 0.0 111.868 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 94' ' ' VAL . . . . . 0.472 ' C ' ' H ' ' R' ' 96' ' ' LEU . 96.7 t -78.78 -18.74 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.379 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.73 6.36 1.18 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.504 -0.878 . . . . 0.0 110.484 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 96' ' ' LEU . . . . . 0.472 ' H ' ' C ' ' R' ' 94' ' ' VAL . 2.2 tp -80.12 -33.55 38.57 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.717 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -63.63 -25.56 68.28 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.97 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.17 -26.42 68.32 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.863 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -110.48 -62.36 1.53 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.372 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 100' ' ' LEU . . . . . 0.49 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -40.96 -33.03 0.27 Allowed 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 118.999 -1.08 . . . . 0.0 113.334 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 101' ' ' GLU . . . . . 0.49 ' C ' ' O ' ' R' ' 100' ' ' LEU . 6.7 mm-40 -43.76 -37.92 2.95 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 117.668 -1.613 . . . . 0.0 107.366 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 102' ' ' GLU . . . . . 0.405 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.2 mt-10 -90.81 -27.28 18.97 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.567 -1.651 . . . . 0.0 112.05 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.1 t -93.52 -1.25 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 117.651 -1.62 . . . . 0.0 110.79 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' R' R ' 104' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' R' ' 100' ' ' LEU . 20.1 tp -108.22 -51.47 2.89 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.629 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' R' R ' 105' ' ' LEU . . . . . 0.472 ' C ' ' CD1' ' R' ' 105' ' ' LEU . 0.4 OUTLIER -78.19 -28.52 48.16 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 118.845 -1.142 . . . . 0.0 111.73 -179.894 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttm . . . . . 0 N--CA 1.489 1.522 0 C-N-CA 118.937 -1.105 . . . . 0.0 110.583 -179.99 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 121.075 0.465 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -161.78 -12.54 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.606 -0.837 . . . . 0.0 110.637 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 17' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -86.26 -85.69 0.15 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.499 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 18' ' ' GLU . . . . . 0.503 ' N ' ' CD ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -47.28 -33.6 5.77 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.901 -1.12 . . . . 0.0 108.116 179.791 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 19' ' ' TRP . . . . . 0.605 ' CH2' ' OE2' ' R' ' 47' ' ' GLU . 27.7 t-105 -51.34 -61.52 2.19 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.437 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 20' ' ' LEU . . . . . 0.439 ' O ' ' N ' ' S' ' 24' ' ' ASP . 1.3 mt -56.34 -41.72 76.55 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.511 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 21' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' S' ' 22' ' ' PHE . 20.4 mmt180 -44.15 -64.3 0.7 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.523 -1.271 . . . . 0.0 109.64 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 22' ' ' PHE . . . . . 0.442 ' C ' ' O ' ' S' ' 21' ' ' ARG . 4.3 t80 -40.27 -40.39 1.13 Allowed 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 119.062 -1.055 . . . . 0.0 109.765 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 23' ' ' VAL . . . . . 0.462 ' O ' ' N ' ' S' ' 26' ' ' LEU . 45.1 t -80.56 -74.09 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 119.953 -0.699 . . . . 0.0 111.065 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 24' ' ' ASP . . . . . 0.511 ' O ' ' ND2' ' S' ' 28' ' ' ASN . 0.7 OUTLIER -36.63 -32.17 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.097 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 25' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' S' ' 23' ' ' VAL . 63.0 tp -73.54 -49.78 24.72 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.676 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 26' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.4 mp -49.75 -59.78 3.5 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.931 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 27' ' ' LYS . . . . . 0.408 ' O ' ' NE2' ' S' ' 31' ' ' GLN . 0.4 OUTLIER -54.74 -21.39 10.8 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.603 -0.839 . . . . 0.0 113.244 -179.711 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 28' ' ' ASN . . . . . 0.511 ' ND2' ' O ' ' S' ' 24' ' ' ASP . 74.6 m-20 -89.89 -21.15 22.65 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 118.754 -1.179 . . . . 0.0 111.421 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 29' ' ' ALA . . . . . 0.43 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -95.42 -29.8 14.23 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.256 -0.978 . . . . 0.0 111.842 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 30' ' ' TYR . . . . . 0.623 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 6.9 t80 -46.83 -58.26 4.09 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 118.906 -1.118 . . . . 0.0 110.887 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 31' ' ' GLN . . . . . 0.536 ' CD ' ' H ' ' S' ' 31' ' ' GLN . 0.0 OUTLIER -56.6 -18.26 11.36 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.211 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 32' ' ' ASN . . . . . 0.442 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -98.69 -17.38 18.59 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.926 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 33' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.8 OUTLIER 78.73 27.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.608 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -103.9 -13.76 16.25 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.017 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -51.53 -24.63 5.46 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.387 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 36' ' ' LEU . . . . . 0.485 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.0 mt -70.64 -63.92 1.47 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 117.94 -1.504 . . . . 0.0 110.359 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 37' ' ' PRO . . . . . 0.485 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.6 Cg_endo -52.43 -33.67 57.93 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 120.719 0.946 . . . . 0.0 110.8 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.31 -41.28 63.73 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.02 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 39' ' ' LEU . . . . . 0.516 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.3 OUTLIER -51.55 -44.62 62.75 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.443 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.86 10.92 0.6 Allowed 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.608 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 41' ' ' LEU . . . . . 0.516 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.2 tp -106.87 -61.68 1.5 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.983 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 42' ' ' MET . . . . . 0.453 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 0.1 OUTLIER -100.16 39.34 1.35 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.196 -179.792 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 43' ' ' LEU . . . . . 0.479 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.3 OUTLIER 163.08 129.88 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 44' ' ' THR . . . . . 0.572 ' N ' ' CD ' ' S' ' 45' ' ' PRO . 0.3 OUTLIER 178.7 -35.72 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.665 0 C-N-CA 117.469 -1.693 . . . . 0.0 115.298 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 45' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' S' ' 44' ' ' THR . 18.8 Cg_endo -78.89 -109.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 120.81 1.006 . . . . 0.0 112.793 -179.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.57 -15.97 43.7 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.016 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 47' ' ' GLU . . . . . 0.408 ' O ' ' CB ' ' S' ' 51' ' ' LEU . 45.5 mt-10 -70.48 -57.4 4.82 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 119.334 -0.947 . . . . 0.0 110.298 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -55.09 -40.38 70.36 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.724 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.23 -66.14 0.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.147 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 50' ' ' ALA . . . . . 0.591 ' O ' HG21 ' S' ' 53' ' ' THR . . . -63.13 -33.13 74.81 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.778 -1.169 . . . . 0.0 111.044 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 51' ' ' LEU . . . . . 0.408 ' CB ' ' O ' ' S' ' 47' ' ' GLU . 1.7 tt -50.42 -28.71 8.69 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 52' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' S' ' 50' ' ' ALA . . . -83.05 -39.14 10.35 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 112.695 -2.048 . . . . 0.0 114.002 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 53' ' ' THR . . . . . 0.591 HG21 ' O ' ' S' ' 50' ' ' ALA . 0.5 OUTLIER -55.04 -60.46 3.34 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 116.039 -2.264 . . . . 0.0 108.309 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 54' ' ' ARG . . . . . 0.416 ' O ' ' CG2' ' S' ' 58' ' ' VAL . 3.0 ptp180 -48.56 -45.12 37.25 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.416 -1.314 . . . . 0.0 109.665 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 97.7 t -67.71 -21.91 27.8 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 C-N-CA 116.949 -1.9 . . . . 0.0 109.125 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 56' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' S' ' 53' ' ' THR . 2.4 ptt180 -83.29 -42.64 16.92 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 118.672 -1.211 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 57' ' ' ILE . . . . . 0.45 ' CD1' ' C ' ' S' ' 57' ' ' ILE . 0.0 OUTLIER -70.81 -31.93 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 115.99 -2.284 . . . . 0.0 105.745 -179.803 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 58' ' ' VAL . . . . . 0.42 ' N ' ' CD1' ' S' ' 57' ' ' ILE . 24.4 t -57.64 -63.83 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 118.541 -1.263 . . . . 0.0 108.307 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -43.79 -26.86 0.28 Allowed 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.205 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 60' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' S' ' 60' ' ' GLU . 0.0 OUTLIER -88.36 -32.92 18.14 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.585 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 61' ' ' LEU . . . . . 0.611 ' C ' ' H ' ' S' ' 63' ' ' ARG . 0.5 OUTLIER -55.09 -20.79 10.66 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 117.254 -1.779 . . . . 0.0 106.623 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 62' ' ' LEU . . . . . 0.476 ' N ' ' C ' ' S' ' 60' ' ' GLU . 0.6 OUTLIER -78.28 30.14 0.18 Allowed 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.874 -1.512 . . . . 0.0 107.736 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 63' ' ' ARG . . . . . 0.611 ' H ' ' C ' ' S' ' 61' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -125.92 -92.13 0.51 Allowed 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.22 -1.355 . . . . 0.0 109.318 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 74' ' ' GLU . . . . . 0.46 ' HG3' ' H ' ' S' ' 75' ' ' LEU . 0.0 OUTLIER -171.75 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.301 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.87 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 75' ' ' LEU . . . . . 0.46 ' H ' ' HG3' ' S' ' 74' ' ' GLU . 1.7 tm? -112.99 -15.98 12.75 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -46.8 -59.86 5.24 Favored Glycine 0 N--CA 1.479 1.526 0 C-N-CA 119.307 -1.425 . . . . 0.0 109.834 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.0 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 117.443 -1.703 . . . . 0.0 114.714 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.62 134.74 6.75 Favored Glycine 0 N--CA 1.501 2.968 0 N-CA-C 106.717 -2.553 . . . . 0.0 106.717 -179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 79' ' ' ILE . . . . . 0.564 ' O ' ' N ' ' S' ' 81' ' ' THR . 0.0 OUTLIER -56.97 -34.96 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 C-N-CA 118.397 -1.321 . . . . 0.0 112.95 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 80' ' ' ALA . . . . . 0.495 ' C ' ' O ' ' S' ' 79' ' ' ILE . . . -35.3 -31.08 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.366 -0.934 . . . . 0.0 109.378 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 81' ' ' THR . . . . . 0.564 ' N ' ' O ' ' S' ' 79' ' ' ILE . 0.2 OUTLIER -78.16 -60.39 2.39 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 114.299 -1.318 . . . . 0.0 111.344 179.683 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 pt -63.62 -10.91 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.66 -51.02 15.52 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.2 -1.8 . . . . 0.0 109.549 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 84' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 85' ' ' GLY . 1.8 mpt_? -48.93 -70.88 0.08 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.027 0.918 . . . . 0.0 110.669 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 85' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' S' ' 84' ' ' ARG . . . -20.11 -55.84 0.01 OUTLIER Glycine 0 N--CA 1.487 2.073 0 CA-C-N 113.017 -1.901 . . . . 0.0 114.346 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 86' ' ' SER . . . . . 0.569 ' C ' ' H ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -86.39 -61.83 1.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 118.215 -1.394 . . . . 0.0 112.905 -179.776 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -56.73 5.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.235 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 88' ' ' SER . . . . . 0.569 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -52.61 -36.33 56.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.849 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 89' ' ' LEU . . . . . 0.594 ' H ' ' CD1' ' S' ' 89' ' ' LEU . 2.4 mp -75.46 -54.21 7.41 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.957 -1.097 . . . . 0.0 110.872 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 90' ' ' LYS . . . . . 0.464 ' O ' ' C ' ' S' ' 91' ' ' ALA . 23.8 mttt -45.28 -64.05 0.8 Allowed 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.67 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 91' ' ' ALA . . . . . 0.464 ' C ' ' O ' ' S' ' 90' ' ' LYS . . . -23.76 -66.76 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 113.676 -1.602 . . . . 0.0 112.914 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 92' ' ' ALA . . . . . 0.402 ' N ' ' HD2' ' S' ' 93' ' ' PRO . . . 178.39 -51.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.52 0 C-N-CA 118.792 -1.163 . . . . 0.0 113.181 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 93' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' S' ' 92' ' ' ALA . 5.6 Cg_exo -58.36 97.51 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.829 0 C-N-CA 120.66 0.906 . . . . 0.0 111.807 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 94' ' ' VAL . . . . . 0.405 ' O ' ' CG1' ' S' ' 94' ' ' VAL . 28.8 t -110.86 -12.4 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -78.14 -28.81 48.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.209 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 71.3 mt -46.55 -33.3 4.0 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.719 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.76 -36.95 85.57 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.771 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -65.31 -31.34 72.42 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.659 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 99' ' ' TRP . . . . . 0.423 ' O ' ' C ' ' S' ' 100' ' ' LEU . 14.2 t90 -86.8 -58.73 2.49 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.988 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 100' ' ' LEU . . . . . 0.519 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -36.72 -38.29 0.17 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.352 -0.939 . . . . 0.0 112.929 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 101' ' ' GLU . . . . . 0.519 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.8 mt-10 -41.43 -44.82 2.97 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 102' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' S' ' 99' ' ' TRP . 1.8 tt0 -75.8 -33.77 60.15 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.493 -1.685 . . . . 0.0 111.49 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 103' ' ' VAL . . . . . 0.432 ' N ' ' O ' ' S' ' 100' ' ' LEU . 3.6 t -85.16 -52.63 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 116.881 -1.928 . . . . 0.0 111.707 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' S' S ' 104' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' S' ' 100' ' ' LEU . 0.9 OUTLIER -56.54 -57.3 12.94 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.935 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 95.1 mt -51.13 -68.11 0.2 Allowed 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.445 -1.302 . . . . 0.0 110.473 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mttp -44.85 -56.86 4.16 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.651 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 116.399 -1.762 . . . . 0.0 110.848 179.99 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 4.4 m -147.43 71.47 11.81 Favored Pre-proline 0 N--CA 1.489 1.48 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.338 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -67.4 133.45 30.28 Favored 'Trans proline' 0 C--N 1.314 -1.289 0 C-N-CA 121.68 1.586 . . . . 0.0 111.977 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -89.6 89.64 7.91 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.103 -1.039 . . . . 0.0 110.754 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 7.8 t 54.87 52.64 11.64 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.526 -0.87 . . . . 0.0 110.55 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . 51.73 -144.41 0.59 Allowed 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.477 -0.889 . . . . 0.0 110.325 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -144.82 169.5 17.92 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.757 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 11.7 mtm -85.91 90.24 8.01 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.135 -1.026 . . . . 0.0 110.437 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.95 150.96 22.99 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.89 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -80.43 -49.7 11.09 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.47 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -72.49 179.42 3.5 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.366 -0.934 . . . . 0.0 111.454 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 -82.96 104.53 13.24 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 119.342 -0.943 . . . . 0.0 111.306 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -144.21 -11.08 0.64 Allowed 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.18 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -90.09 -72.38 0.57 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -49.26 -35.28 17.24 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -51.05 -62.52 1.56 Allowed 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 113.628 -1.624 . . . . 0.0 107.2 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tp -45.79 -38.09 6.76 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 112.938 -1.937 . . . . 0.0 110.316 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' R' ' 22' ' ' PHE . 26.5 mmt180 -55.93 -66.42 0.43 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 117.17 -1.812 . . . . 0.0 107.69 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.454 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -39.35 -43.24 1.15 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.068 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . 0.463 ' O ' ' N ' ' R' ' 26' ' ' LEU . 40.4 t -68.11 -70.67 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 119.384 -0.927 . . . . 0.0 111.108 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' R' ' 23' ' ' VAL . 4.7 t0 -25.98 -48.83 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.19 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . 0.474 ' CD2' ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -77.3 -45.71 25.34 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 117.017 -1.873 . . . . 0.0 109.322 -179.923 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . 0.463 ' N ' ' O ' ' R' ' 23' ' ' VAL . 0.2 OUTLIER -47.12 -52.74 14.57 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.101 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' R' ' 29' ' ' ALA . 18.4 tptm -66.95 -68.46 0.37 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.103 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -41.86 -20.51 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.241 -0.984 . . . . 0.0 112.071 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . 0.487 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -83.59 -54.22 5.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -43.79 -25.97 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.939 -1.104 . . . . 0.0 110.346 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . 0.413 ' N ' ' C ' ' R' ' 29' ' ' ALA . 2.6 tt0 -50.8 -41.92 57.63 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.548 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -106.1 -72.17 0.72 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.813 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . 0.401 ' H ' HD23 ' R' ' 34' ' ' LEU . 0.7 OUTLIER 170.7 17.43 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.049 -1.06 . . . . 0.0 112.881 -179.746 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . 0.621 ' H ' ' CD2' ' R' ' 34' ' ' LEU . 0.0 OUTLIER -92.69 -10.53 36.86 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.251 -1.379 . . . . 0.0 110.614 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 11.0 p-80 -44.47 -30.88 0.94 Allowed 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.446 -0.901 . . . . 0.0 112.929 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.68 -58.11 5.96 Favored Pre-proline 0 N--CA 1.487 1.409 0 C-N-CA 117.884 -1.526 . . . . 0.0 109.906 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.18 -29.98 89.15 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 C-N-CA 119.923 0.415 . . . . 0.0 111.618 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.53 -45.97 34.91 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.694 -0.803 . . . . 0.0 109.283 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 43' ' ' LEU . 0.2 OUTLIER -45.87 -44.15 14.2 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.777 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . 0.529 ' O ' ' N ' ' R' ' 109' ' ' TRP . 1.2 m120 -70.21 -16.48 63.07 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.16 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tp -78.62 -48.61 14.76 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.738 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.13 47.39 2.42 Favored 'General case' 0 N--CA 1.511 2.593 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.512 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER 173.26 117.47 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.387 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.544 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -35.86 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.513 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.544 ' CD ' ' H ' ' R' ' 44' ' ' THR . 32.9 Cg_endo -80.91 -101.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.363 0 C-N-CA 121.154 1.236 . . . . 0.0 114.197 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -53.44 -18.92 3.02 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . 0.516 ' OE2' ' NH1' ' S' ' 54' ' ' ARG . 0.4 OUTLIER -63.76 -65.74 0.64 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.395 -1.73 . . . . 0.0 109.832 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . 0.461 ' NH2' ' O ' ' S' ' 15' ' ' ARG . 2.7 mmm180 -51.62 -30.56 21.88 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 118.773 -1.171 . . . . 0.0 110.912 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . 0.435 ' O ' ' OG1' ' R' ' 53' ' ' THR . 4.6 mt-10 -82.89 -72.81 0.43 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -62.19 -43.03 99.74 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . 0.438 ' CD1' ' C ' ' R' ' 51' ' ' LEU . 0.2 OUTLIER -58.51 -46.84 85.92 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 117.986 -1.486 . . . . 0.0 111.248 -179.802 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . 0.4 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -53.95 -59.26 10.14 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 107.496 -2.241 . . . . 0.0 107.496 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.464 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -34.3 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.183 -1.008 . . . . 0.0 112.239 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.77 -56.42 2.68 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 14.9 p -67.01 -18.86 24.87 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 114.956 -2.698 . . . . 0.0 110.548 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' R' ' 60' ' ' GLU . 0.0 OUTLIER -93.02 -29.38 15.85 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 118.016 -1.474 . . . . 0.0 112.418 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.462 ' C ' ' CD1' ' R' ' 57' ' ' ILE . 0.2 OUTLIER -76.31 -41.43 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 115.663 -2.415 . . . . 0.0 106.872 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.493 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 7.3 p -66.33 -52.94 41.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 117.391 -1.724 . . . . 0.0 110.822 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . 0.493 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 5.7 tt0 -64.03 -12.99 43.57 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.33 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' R' ' 56' ' ' ARG . 3.4 mm-40 -78.97 -52.3 8.44 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.739 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . 0.498 ' C ' ' H ' ' R' ' 63' ' ' ARG . 2.1 pp -89.4 -25.85 21.33 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.067 -1.453 . . . . 0.0 111.554 -179.753 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp -77.8 22.92 0.26 Allowed 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 118.321 -1.351 . . . . 0.0 110.696 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . 0.498 ' H ' ' C ' ' R' ' 61' ' ' LEU . 20.1 ttt180 -114.58 -47.02 2.92 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.846 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.71 -88.56 1.83 Allowed Glycine 0 N--CA 1.494 2.555 0 C-N-CA 119.451 -1.357 . . . . 0.0 109.715 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -143.62 -54.55 0.37 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.565 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 66' ' ' MET . . . . . 0.446 ' O ' ' CB ' ' R' ' 67' ' ' SER . 5.5 ttm -159.97 178.97 9.18 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.422 -0.911 . . . . 0.0 111.053 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 67' ' ' SER . . . . . 0.446 ' CB ' ' O ' ' R' ' 66' ' ' MET . 1.3 t 163.62 86.67 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.834 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.535 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.4 OUTLIER -124.89 -24.65 4.04 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.941 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -72.36 28.98 0.05 Allowed 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.733 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.535 ' H ' ' C ' ' R' ' 68' ' ' GLN . 26.0 mt-10 -85.56 1.33 49.48 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.183 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 tp 61.39 147.39 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.142 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -42.62 128.27 4.0 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.119 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . 0.61 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.5 OUTLIER -96.73 10.56 38.38 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.81 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . 0.444 ' O ' ' N ' ' R' ' 76' ' ' GLY . 23.5 mm-40 40.55 -75.02 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 110.926 -2.852 . . . . 0.0 112.231 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . 0.61 ' N ' ' O ' ' R' ' 73' ' ' ASN . 6.3 mt -42.67 -22.75 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 113.384 -1.735 . . . . 0.0 110.845 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' R' ' 74' ' ' GLU . . . -102.54 -61.17 0.73 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.96 -94.56 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.54 1.01 46.76 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.867 -1.159 . . . . 0.0 113.958 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.56 ' H ' ' CD1' ' R' ' 79' ' ' ILE . 0.1 OUTLIER -122.11 -72.98 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.824 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.534 ' O ' ' N ' ' R' ' 82' ' ' ILE . . . -102.34 -71.28 0.72 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 81' ' ' THR . . . . . 0.569 ' OG1' ' NE1' ' R' ' 1' ' ' TRP . 0.6 OUTLIER -37.09 -21.13 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -79.75 -31.26 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 118.118 -1.433 . . . . 0.0 112.389 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.35 19.71 16.14 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . 0.671 ' NE ' ' CE2' ' R' ' 1' ' ' TRP . 0.1 OUTLIER -93.46 -39.74 10.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 117.575 -1.65 . . . . 0.0 107.804 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . 0.418 ' N ' ' CD ' ' R' ' 84' ' ' ARG . . . -40.57 -24.72 0.08 OUTLIER Glycine 0 N--CA 1.481 1.699 0 CA-C-N 113.48 -1.691 . . . . 0.0 110.561 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 86' ' ' SER . . . . . 0.478 ' N ' ' O ' ' R' ' 84' ' ' ARG . 1.8 t -81.48 -70.3 0.55 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.281 -0.968 . . . . 0.0 110.312 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -60.26 -3.59 0.65 Allowed 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.97 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 88' ' ' SER . . . . . 0.469 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.6 OUTLIER -48.48 -26.73 2.29 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.98 -1.088 . . . . 0.0 110.698 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -41.18 -42.12 1.98 Allowed 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.957 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.97 -50.26 3.03 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.799 0.809 . . . . 0.0 110.399 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.26 -55.34 1.71 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.351 -179.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.45 162.77 23.44 Favored Pre-proline 0 N--CA 1.489 1.503 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.814 179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -56.82 170.04 1.58 Allowed 'Trans proline' 0 C--N 1.316 -1.143 0 C-N-CA 121.02 1.146 . . . . 0.0 111.593 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . 0.467 ' C ' ' H ' ' R' ' 96' ' ' LEU . 79.5 t -93.98 -31.08 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.797 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.47 3.6 0.93 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.894 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . 0.467 ' H ' ' C ' ' R' ' 94' ' ' VAL . 1.3 tp -84.69 -44.93 12.95 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.593 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -59.07 -24.32 62.8 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.764 -0.775 . . . . 0.0 109.543 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -63.25 -40.08 96.41 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.435 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 7.3 t90 -101.2 -60.04 1.59 Allowed 'General case' 0 N--CA 1.512 2.672 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.327 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -43.67 -19.74 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 118.386 -1.325 . . . . 0.0 113.57 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.455 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.2 mm-40 -53.23 -37.13 61.79 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.418 ' N ' ' C ' ' R' ' 100' ' ' LEU . 3.7 mt-10 -86.81 -37.66 17.57 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 111.622 -2.535 . . . . 0.0 114.556 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.0 t -82.62 -9.53 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 116.08 -2.248 . . . . 0.0 111.69 -179.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 tp -94.37 -56.2 2.9 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.12 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . 0.445 ' C ' ' CD1' ' R' ' 105' ' ' LEU . 0.4 OUTLIER -68.3 -27.17 66.06 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.847 -1.141 . . . . 0.0 111.548 -179.643 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -60.38 -40.12 89.73 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 119.111 -1.036 . . . . 0.0 110.438 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 116.326 -1.797 . . . . 0.0 110.415 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' S' S ' 5' ' ' SER . . . . . 0.537 ' N ' ' CD ' ' S' ' 6' ' ' PRO . 0.2 OUTLIER -81.98 -41.82 1.01 Allowed Pre-proline 0 N--CA 1.485 1.306 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.764 179.914 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . 0.537 ' CD ' ' N ' ' S' ' 5' ' ' SER . 2.0 Cg_endo -74.74 148.64 36.84 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 120.471 0.781 . . . . 0.0 111.86 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 43.1 t80 54.06 80.14 0.12 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.975 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -153.73 -57.19 0.12 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.696 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -147.16 -2.1 0.62 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.87 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -84.88 65.82 9.37 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.28 -0.968 . . . . 0.0 110.54 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 36.7 mtt -92.25 115.13 27.81 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.423 -0.911 . . . . 0.0 110.688 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -171.28 103.08 0.21 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.554 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' S' ' 15' ' ' ARG . 0.4 OUTLIER -155.32 71.51 0.78 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 118.981 -1.088 . . . . 0.0 111.368 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -61.86 80.63 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.009 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' S' ' 13' ' ' GLU . 4.1 mtt180 -88.34 142.02 28.08 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.185 -1.006 . . . . 0.0 110.656 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -157.32 -0.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.223 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.444 ' C ' ' N ' ' S' ' 19' ' ' TRP . 6.1 mt-30 -95.4 -83.33 0.36 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.833 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' S' ' 17' ' ' GLN . 9.2 pt-20 -45.22 -30.52 1.23 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . 0.444 ' N ' ' C ' ' S' ' 17' ' ' GLN . 62.4 t-105 -55.89 -64.01 0.99 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.146 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' S' ' 24' ' ' ASP . 6.5 tp -48.14 -36.71 13.92 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.92 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' S' ' 22' ' ' PHE . 17.6 mmt180 -56.53 -67.39 0.31 Allowed 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 117.383 -1.727 . . . . 0.0 106.361 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.459 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -37.55 -47.29 0.91 Allowed 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.58 178.924 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 48.6 t -74.27 -74.7 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.594 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' S' ' 20' ' ' LEU . 14.3 t0 -37.1 -41.73 0.38 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.596 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 58.6 tp -60.62 -53.11 61.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.07 -61.51 2.34 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.361 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 21.8 tptp -39.67 -53.97 2.1 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.047 -0.661 . . . . 0.0 112.572 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -65.97 -25.28 67.03 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.473 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . 0.495 ' O ' ' N ' ' S' ' 31' ' ' GLN . . . -82.99 -48.95 10.08 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.875 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . 0.485 ' CE2' ' NE2' ' S' ' 35' ' ' HIS . 9.4 t80 -42.09 -21.7 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.916 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' S' ' 29' ' ' ALA . 0.9 OUTLIER -69.63 -47.18 64.29 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.926 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.8 OUTLIER -74.72 -27.74 60.5 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.504 -0.879 . . . . 0.0 109.293 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.5 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 1.3 t70 86.49 50.72 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.479 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . 0.58 ' N ' ' CD1' ' S' ' 34' ' ' LEU . 0.0 OUTLIER -136.08 14.62 3.3 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.708 1.242 . . . . 0.0 109.223 179.672 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . 0.485 ' NE2' ' CE2' ' S' ' 30' ' ' TYR . 31.1 p-80 -61.73 -19.15 62.11 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 112.904 -1.953 . . . . 0.0 111.526 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.427 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.8 mt -69.61 -59.01 5.09 Favored Pre-proline 0 N--CA 1.483 1.184 0 C-N-CA 118.894 -1.122 . . . . 0.0 109.213 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -54.31 -34.83 81.77 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 N-CA-C 110.115 -0.763 . . . . 0.0 110.115 179.109 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 19.5 mt -72.13 -40.45 68.07 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 118.991 -1.084 . . . . 0.0 110.523 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . 0.517 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.4 OUTLIER -50.61 -50.8 53.15 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-O 121.523 0.678 . . . . 0.0 109.315 179.644 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . 0.601 ' ND2' HH12 ' S' ' 48' ' ' ARG . 0.7 OUTLIER -56.49 -6.06 0.26 Allowed 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.349 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . 0.517 ' H ' ' C ' ' S' ' 39' ' ' LEU . 1.8 tp -100.43 -67.87 0.84 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.901 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.6 -3.88 20.43 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.658 -1.217 . . . . 0.0 111.172 -179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . 0.448 ' O ' ' O ' ' S' ' 39' ' ' LEU . 1.5 mp -157.0 132.91 9.52 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.177 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.54 ' H ' ' CD ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -170.42 -30.45 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 115.916 -2.314 . . . . 0.0 116.407 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.54 ' CD ' ' H ' ' S' ' 44' ' ' THR . 34.1 Cg_endo -99.03 -102.97 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.398 0 CA-C-N 119.277 0.777 . . . . 0.0 113.701 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.44 -16.75 2.48 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 118.142 -1.423 . . . . 0.0 107.831 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . 0.457 ' N ' ' C ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -68.27 -67.48 0.46 Allowed 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.554 -1.203 . . . . 0.0 107.804 179.498 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . 0.601 HH12 ' ND2' ' S' ' 40' ' ' ASN . 0.0 OUTLIER -41.56 -33.81 0.5 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.927 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . 0.441 ' O ' ' OG1' ' S' ' 53' ' ' THR . 4.2 mt-10 -84.79 -67.83 0.77 Allowed 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 119.536 -0.866 . . . . 0.0 113.041 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . 0.412 ' C ' ' OG1' ' S' ' 53' ' ' THR . . . -45.88 -23.67 0.31 Allowed 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.195 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . 0.411 ' C ' ' N ' ' S' ' 53' ' ' THR . 4.2 mp -77.46 -56.74 4.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.086 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -21.63 4.07 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 118.635 -1.745 . . . . 0.0 109.434 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.441 ' OG1' ' O ' ' S' ' 49' ' ' GLU . 0.1 OUTLIER -73.64 -78.67 0.09 Allowed 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 114.173 -1.013 . . . . 0.0 111.007 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.516 ' NH1' ' OE2' ' R' ' 47' ' ' GLU . 23.3 mtt85 -41.58 -26.99 0.08 Allowed 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.742 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 98.7 t -80.0 -41.5 21.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 C-N-CA 119.022 -1.071 . . . . 0.0 108.845 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' S' ' 53' ' ' THR . 19.7 mtt180 -58.33 -50.61 73.01 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 116.993 -1.883 . . . . 0.0 107.34 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -66.57 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 C-N-CA 117.035 -1.866 . . . . 0.0 111.293 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 52.0 t -42.93 -64.45 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 C-N-CA 118.424 -1.31 . . . . 0.0 113.318 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -48.55 -46.7 39.23 Favored 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.985 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.74 -30.63 70.16 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 119.297 -0.961 . . . . 0.0 112.227 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.15 -27.46 69.39 Favored 'General case' 0 C--N 1.284 -2.252 0 C-N-CA 118.467 -1.293 . . . . 0.0 110.757 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 4.9 mt -81.87 -62.91 1.5 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 116.479 2.029 . . . . 0.0 116.479 -179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -109.04 1.36 20.47 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.638 ' O ' ' N ' ' S' ' 66' ' ' MET . . . -110.35 21.23 24.51 Favored Glycine 0 C--N 1.295 -1.72 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . 0.55 ' C ' ' O ' ' S' ' 64' ' ' GLY . 75.3 mt-10 -20.3 -44.32 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 O-C-N 125.267 1.216 . . . . 0.0 110.014 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 66' ' ' MET . . . . . 0.638 ' N ' ' O ' ' S' ' 64' ' ' GLY . 4.3 mmt -55.63 108.26 0.42 Allowed 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 106.064 -1.828 . . . . 0.0 106.064 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 37.2 t -147.6 76.16 1.39 Allowed 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.451 ' C ' ' H ' ' S' ' 70' ' ' GLU . 18.8 pt20 -122.67 -37.95 2.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 109.498 -3.501 . . . . 0.0 111.287 179.447 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.02 30.6 1.06 Allowed 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 123.03 1.395 . . . . 0.0 107.873 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.473 ' O ' ' C ' ' S' ' 71' ' ' LEU . 5.5 mm-40 -137.06 -31.5 0.83 Allowed 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 112.818 -1.992 . . . . 0.0 113.782 -179.446 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . 0.473 ' C ' ' O ' ' S' ' 70' ' ' GLU . 10.4 mt -39.75 106.52 0.06 Allowed 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 113.772 -1.558 . . . . 0.0 110.465 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . 0.773 ' C ' ' H ' ' S' ' 74' ' ' GLU . 14.8 tttt 48.83 57.18 6.67 Favored 'General case' 0 N--CA 1.525 3.282 1 N-CA-C 122.063 4.097 . . . . 0.0 122.063 178.699 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . 0.26 0.2 OUTLIER -74.1 18.18 0.15 Allowed 'General case' 0 N--CA 1.519 2.989 0 O-C-N 118.418 -2.677 . . . . 0.0 108.844 179.455 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . 0.773 ' H ' ' C ' ' S' ' 72' ' ' LYS 0.363 0.0 OUTLIER 40.81 -51.1 0.0 OUTLIER 'General case' 1 N--CA 1.58 6.033 1 N-CA-C 126.846 5.869 . . . . 0.0 126.846 -171.986 . . . . . . . . 6 4 . 1 . 001 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . 0.458 ' H ' ' HG ' ' S' ' 75' ' ' LEU . 3.4 pp -91.29 -20.36 21.97 Favored 'General case' 0 C--N 1.267 -2.982 0 CA-C-N 118.796 0.725 . . . . 0.0 112.039 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -82.18 -16.38 72.03 Favored Glycine 1 N--CA 1.548 6.125 0 CA-C-N 112.728 -2.033 . . . . 0.0 115.106 178.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -136.72 -69.18 0.47 Allowed 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 115.923 -2.311 . . . . 0.0 113.344 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . 0.439 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 149.12 127.72 1.61 Allowed Glycine 0 CA--C 1.456 -3.644 1 N-CA-C 98.104 -5.999 . . . . 0.0 98.104 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.21 -22.61 27.71 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.211 1 C-N-CA 111.581 -4.047 . . . . 0.0 106.397 -178.572 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.478 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -63.66 -37.32 86.88 Favored 'General case' 0 N--CA 1.511 2.619 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 81' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' S' ' 78' ' ' GLY . 9.1 p -53.67 -55.94 21.62 Favored 'General case' 0 C--N 1.297 -1.683 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.296 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . 0.37 0.3 OUTLIER -63.28 11.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 117.812 2.523 . . . . 0.0 117.812 -178.761 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -96.55 -62.28 1.29 Allowed 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 118.402 -1.319 . . . . 0.0 108.063 178.686 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -52.34 -23.7 6.34 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 118.357 -1.337 . . . . 0.0 109.006 179.241 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.63 -11.1 59.45 Favored Glycine 0 N--CA 1.498 2.825 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.386 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -100.49 -23.16 14.78 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . 0.514 ' N ' ' ND2' ' S' ' 87' ' ' ASN . 0.6 OUTLIER -105.49 -3.8 22.05 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.573 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.51 ' N ' ' O ' ' S' ' 84' ' ' ARG . 0.2 OUTLIER -62.01 -15.6 45.36 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . 0.462 ' N ' ' C ' ' S' ' 87' ' ' ASN . 3.4 mt -71.72 -78.9 0.08 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.221 -1.809 . . . . 0.0 111.366 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -53.96 -66.61 0.36 Allowed 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.54 0.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 160.04 76.9 Favored Pre-proline 0 N--CA 1.501 2.085 0 C-N-CA 118.482 -1.287 . . . . 0.0 110.359 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -68.27 158.22 58.46 Favored 'Trans proline' 0 C--N 1.324 -0.723 0 N-CA-C 108.29 -1.465 . . . . 0.0 108.29 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' S' ' 96' ' ' LEU . 36.4 t -88.04 -65.12 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.353 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -45.37 -12.39 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 C-N-CA 119.065 -1.054 . . . . 0.0 112.783 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' S' ' 94' ' ' VAL . 0.9 OUTLIER -65.59 -34.95 79.42 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.04 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -54.08 -24.18 16.51 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.559 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -82.81 -28.92 29.9 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 118.516 -1.274 . . . . 0.0 110.814 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . 0.403 ' O ' ' N ' ' S' ' 102' ' ' GLU . 6.2 t90 -90.34 -56.25 3.28 Favored 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.518 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.484 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.6 mm? -40.18 -31.58 0.14 Allowed 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 118.954 -1.098 . . . . 0.0 113.829 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.484 ' C ' ' O ' ' S' ' 100' ' ' LEU . 42.5 mt-10 -46.72 -39.7 12.05 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 105.02 -2.215 . . . . 0.0 105.02 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.403 ' N ' ' O ' ' S' ' 99' ' ' TRP . 3.2 mt-10 -86.01 -32.76 21.31 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 112.79 -2.004 . . . . 0.0 114.333 -179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . . . . . . . . . 2.8 t -90.64 -2.43 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 116.64 -2.024 . . . . 0.0 113.125 -179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -109.06 -49.36 3.14 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.92 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . 0.433 ' N ' ' CD2' ' S' ' 105' ' ' LEU . 3.9 mm? -69.04 -64.2 0.91 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 118.832 -1.147 . . . . 0.0 109.602 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -57.83 10.49 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.646 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 116.371 -1.776 . . . . 0.0 109.858 -179.996 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.671 ' CE2' ' NE ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 116.429 -1.748 . . . . 0.0 109.664 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.529 ' N ' ' O ' ' R' ' 40' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 117.141 -1.409 . . . . 0.0 107.71 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.817 0.341 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' R' R ' 5' ' ' SER . . . . . 0.462 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.3 OUTLIER -60.57 -49.84 88.15 Favored Pre-proline 0 N--CA 1.486 1.33 0 C-N-CA 118.902 -1.119 . . . . 0.0 111.963 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' R' ' 5' ' ' SER . 6.1 Cg_endo -70.22 139.66 39.16 Favored 'Trans proline' 0 C--N 1.325 -0.696 0 C-N-CA 120.842 1.028 . . . . 0.0 111.164 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -87.24 117.3 25.9 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.906 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.11 146.24 41.56 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.351 -0.94 . . . . 0.0 111.042 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -172.34 95.31 0.14 Allowed 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.579 -0.848 . . . . 0.0 110.532 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.68 -176.53 1.05 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.078 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 11' ' ' MET . . . . . 0.46 ' N ' ' SD ' ' R' ' 11' ' ' MET . 0.8 OUTLIER -83.24 178.91 7.87 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.551 -0.86 . . . . 0.0 111.22 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.44 122.61 29.22 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.579 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -66.48 -37.1 84.37 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.133 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 51.85 83.71 0.05 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.587 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmm-85 -87.62 117.46 26.45 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.22 -0.992 . . . . 0.0 110.299 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -147.94 -2.2 0.55 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.934 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.416 ' C ' ' N ' ' R' ' 19' ' ' TRP . 2.7 mt-30 -83.88 -80.24 0.19 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.022 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' R' ' 17' ' ' GLN . 5.3 mt-10 -44.2 -31.5 1.0 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 122.708 1.242 . . . . 0.0 108.666 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . 0.416 ' N ' ' C ' ' R' ' 17' ' ' GLN . 74.7 t-105 -56.82 -61.5 2.39 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.78 -2.009 . . . . 0.0 110.823 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 tt -48.11 -24.89 1.24 Allowed 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.533 ' O ' ' N ' ' R' ' 23' ' ' VAL . 10.1 mmt180 -69.78 -70.61 0.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.017 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.472 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.35 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.318 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . 0.533 ' N ' ' O ' ' R' ' 21' ' ' ARG . 48.9 t -75.22 -55.88 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.323 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -38.64 -52.84 1.65 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.459 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -64.38 -55.85 18.33 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.698 -1.201 . . . . 0.0 110.432 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -63.54 -7.05 6.04 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.149 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -83.66 -36.15 24.01 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 118.882 -1.127 . . . . 0.0 112.821 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -113.08 -0.14 14.8 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 119.69 -0.804 . . . . 0.0 113.098 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 30' ' ' TYR . . . -80.2 -53.17 6.92 Favored 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 118.884 -1.127 . . . . 0.0 112.647 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . 0.502 ' CZ ' ' NZ ' ' S' ' 27' ' ' LYS . 14.8 t80 -30.75 -46.63 0.08 Allowed 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . 0.462 HE21 ' CA ' ' R' ' 31' ' ' GLN . 0.0 OUTLIER -58.7 -52.43 65.71 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.346 -0.942 . . . . 0.0 111.191 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . 0.507 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 15.9 m120 -78.03 -12.14 59.96 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.245 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.9 t70 78.91 36.24 0.18 Allowed 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.233 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -99.48 -15.04 18.83 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.022 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . 0.415 ' N ' ' HB2' ' R' ' 29' ' ' ALA . 29.4 p-80 -52.42 -31.67 35.4 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.358 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.425 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.8 mt -69.95 -61.52 2.88 Favored Pre-proline 0 C--N 1.303 -1.431 0 C-N-CA 117.849 -1.541 . . . . 0.0 111.768 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 1.5 Cg_endo -54.3 -25.44 38.88 Favored 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 120.493 0.795 . . . . 0.0 111.208 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 46.5 mt -85.26 -35.81 21.3 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.123 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.91 -36.15 62.42 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.514 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . 0.591 ' N ' HD21 ' R' ' 40' ' ' ASN . 1.7 m120 -73.31 4.57 4.46 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.012 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 50.3 mt -110.68 -67.32 1.0 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.857 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.0 OUTLIER -83.8 40.29 0.73 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.778 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -154.92 165.84 35.43 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.626 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.533 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.293 0.2 OUTLIER -121.76 -151.69 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.353 -179.785 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 9.8 Cg_endo -101.09 -37.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.33 -0.444 0 N-CA-C 109.953 -0.826 . . . . 0.0 109.953 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -26.2 63.8 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.709 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . 0.422 ' O ' ' CB ' ' R' ' 51' ' ' LEU . 4.7 mm-40 -64.46 -51.0 65.27 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -51.73 -38.76 56.65 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 119.141 -1.023 . . . . 0.0 110.327 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . 0.447 ' O ' ' OG1' ' R' ' 53' ' ' THR . 1.2 tt0 -74.66 -67.84 0.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.164 -1.015 . . . . 0.0 112.101 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.454 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -56.36 -41.35 76.02 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.042 -0.663 . . . . 0.0 112.718 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . 0.422 ' CB ' ' O ' ' R' ' 47' ' ' GLU . 0.9 OUTLIER -53.5 -66.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.67 -44.62 6.89 Favored Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.295 -1.431 . . . . 0.0 109.941 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.546 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -49.02 -80.45 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.964 179.893 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 38.1 mtt-85 -37.53 -34.36 0.09 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.849 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -77.56 -32.62 18.51 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 118.197 -1.401 . . . . 0.0 110.446 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -79.8 -35.47 38.42 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.258 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.453 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.84 -36.37 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 117.641 -1.624 . . . . 0.0 108.941 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.453 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 2.3 t -61.76 -61.44 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 118.295 -1.362 . . . . 0.0 109.141 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -45.9 -44.42 14.57 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.813 179.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -52.93 -52.26 58.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.106 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 65.8 mt -76.4 -1.66 28.06 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.619 -0.832 . . . . 0.0 111.53 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp -112.06 22.37 14.89 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 119.701 -0.799 . . . . 0.0 112.138 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 -77.23 -78.79 0.12 Allowed 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 118.672 -1.211 . . . . 0.0 110.163 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -119.45 -72.36 0.37 Allowed Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.404 ' O ' ' C ' ' R' ' 66' ' ' MET . 70.9 mt-10 -154.43 -55.51 0.1 Allowed 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.207 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 66' ' ' MET . . . . . 0.404 ' C ' ' O ' ' R' ' 65' ' ' GLU . 8.4 tpp -35.1 141.84 0.06 Allowed 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.425 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 19.5 p -167.2 71.21 0.11 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.713 -0.795 . . . . 0.0 110.932 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.533 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.2 OUTLIER -128.35 -25.35 2.96 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 119.879 -0.729 . . . . 0.0 110.656 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -71.65 32.51 0.05 Allowed 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.815 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.533 ' H ' ' C ' ' R' ' 68' ' ' GLN . 3.3 pt-20 -100.77 24.13 9.58 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.989 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.12 131.15 45.78 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.994 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . 0.469 ' CB ' ' NZ ' ' R' ' 72' ' ' LYS . 1.7 ttmp? -69.41 126.73 30.65 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 119.568 -0.853 . . . . 0.0 111.117 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -101.07 -105.96 0.24 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 121.775 0.798 . . . . 0.0 110.474 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . 0.462 ' CG ' ' N ' ' R' ' 75' ' ' LEU . 8.3 pt-20 -144.41 -35.77 0.34 Allowed 'General case' 0 C--N 1.279 -2.459 0 CA-C-N 114.365 -1.289 . . . . 0.0 109.769 179.786 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . 0.462 ' N ' ' CG ' ' R' ' 74' ' ' GLU . 0.9 OUTLIER -116.22 -0.7 12.57 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.397 179.853 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -55.59 -73.77 0.39 Allowed Glycine 0 N--CA 1.491 2.333 0 C-N-CA 119.647 -1.263 . . . . 0.0 110.529 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -164.98 -98.4 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.991 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.99 143.09 7.64 Favored Glycine 0 N--CA 1.493 2.464 0 C-N-CA 119.364 -1.398 . . . . 0.0 111.159 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.465 ' CD1' ' C ' ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.47 -42.23 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.226 -179.914 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.471 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.33 -65.98 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.594 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 50.3 m -36.15 -45.82 0.47 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 22.6 pt -72.87 -36.68 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 118.962 -1.095 . . . . 0.0 112.612 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.471 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -52.51 -72.31 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.814 -1.154 . . . . 0.0 111.145 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . 0.451 ' O ' ' OG ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -54.89 -14.9 1.62 Allowed 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.486 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.18 -59.48 7.86 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.342 -1.408 . . . . 0.0 110.229 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 86' ' ' SER . . . . . 0.51 ' C ' ' H ' ' R' ' 88' ' ' SER . 100.0 p -88.0 -43.88 11.41 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.781 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.64 8.65 0.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.49 -0.884 . . . . 0.0 110.847 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 88' ' ' SER . . . . . 0.526 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.4 OUTLIER -68.92 -23.59 64.19 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.622 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . 0.465 ' C ' ' O ' ' R' ' 88' ' ' SER . 10.2 mt -30.87 -34.9 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.69 0.619 . . . . 0.0 112.022 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . 0.526 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -110.14 -64.82 1.22 Allowed 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.63 0.728 . . . . 0.0 111.413 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.23 -37.86 0.06 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.025 -1.443 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -56.58 159.21 7.04 Favored Pre-proline 0 N--CA 1.49 1.561 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.859 -179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -59.62 169.55 4.19 Favored 'Trans proline' 0 C--N 1.325 -0.672 0 C-N-CA 121.257 1.304 . . . . 0.0 111.333 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 63.9 t -108.98 -21.43 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.182 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -94.11 -1.15 54.74 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 119.363 -0.935 . . . . 0.0 111.12 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.55 -31.03 12.53 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.879 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -37.65 71.29 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.442 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -66.38 -10.32 42.21 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.311 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -97.87 -62.24 1.27 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.553 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.516 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -39.43 -38.09 0.53 Allowed 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.516 ' C ' ' O ' ' R' ' 100' ' ' LEU . 1.1 mm-40 -41.57 -38.61 1.38 Allowed 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 117.928 -1.509 . . . . 0.0 107.806 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -90.6 -27.2 19.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.484 -1.689 . . . . 0.0 112.868 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 t -87.97 -9.19 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 117.26 -1.776 . . . . 0.0 111.023 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -98.61 -52.97 3.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.018 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . 0.438 ' CD2' ' N ' ' R' ' 105' ' ' LEU . 4.5 mm? -70.29 -68.51 0.42 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.74 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -48.77 -17.97 0.23 Allowed 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.875 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 116.339 -1.791 . . . . 0.0 110.81 -179.918 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.858 0.361 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' S' S ' 5' ' ' SER . . . . . 0.498 ' C ' ' H ' ' S' ' 7' ' ' TYR . 2.4 m -66.09 154.55 89.56 Favored Pre-proline 0 N--CA 1.487 1.411 0 C-N-CA 119.324 -0.95 . . . . 0.0 110.148 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -56.22 -4.49 0.74 Allowed 'Trans proline' 0 C--N 1.322 -0.855 0 C-N-CA 120.923 1.082 . . . . 0.0 111.534 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . 0.498 ' H ' ' C ' ' S' ' 5' ' ' SER . 4.6 m-85 -74.28 -60.96 2.03 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.297 -0.961 . . . . 0.0 110.956 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.62 21.33 0.66 Allowed 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.892 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.85 -71.59 0.16 Allowed 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.876 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.49 153.25 16.34 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.765 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 38.8 mtp -128.41 69.97 1.37 Allowed 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.947 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.29 156.33 19.25 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.763 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -164.94 155.1 13.7 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.894 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.15 171.59 0.53 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.036 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . 0.483 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER -89.53 -11.8 41.78 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.157 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -7.33 0.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.384 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.483 ' H ' ' C ' ' S' ' 15' ' ' ARG . 0.0 OUTLIER -76.89 -86.24 0.05 Allowed 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.775 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -43.24 -34.77 1.24 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.279 1.038 . . . . 0.0 109.176 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -51.97 -57.55 9.13 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 113.815 -1.538 . . . . 0.0 109.075 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mt -59.37 -30.71 68.61 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.105 -1.407 . . . . 0.0 111.493 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.557 ' O ' ' N ' ' S' ' 24' ' ' ASP . 9.0 mmt85 -56.24 -65.23 0.64 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 117.902 -1.519 . . . . 0.0 109.519 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.482 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -36.62 -39.49 0.21 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.076 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 23.0 t -74.2 -36.69 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.136 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.557 ' N ' ' O ' ' S' ' 21' ' ' ARG . 54.7 t0 -58.83 -64.01 1.09 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.577 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.66 -56.03 8.13 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 118.956 -1.098 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . 0.46 ' C ' ' CD1' ' S' ' 26' ' ' LEU . 2.3 tm? -38.68 -46.4 1.22 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.244 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . 0.502 ' NZ ' ' CZ ' ' R' ' 30' ' ' TYR . 26.0 mtmm -66.16 -77.37 0.07 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.523 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -39.13 -47.76 1.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.91 -27.37 64.73 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.641 -0.824 . . . . 0.0 113.132 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -41.31 98.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 118.582 -1.247 . . . . 0.0 111.089 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -50.13 -30.97 12.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.791 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.448 ' O ' ' OD1' ' S' ' 33' ' ' ASP . 87.7 m-20 -101.77 -83.5 0.46 Allowed 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.482 -0.887 . . . . 0.0 111.402 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' S' ' 32' ' ' ASN . 0.3 OUTLIER 172.74 24.47 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.787 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . 0.59 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 2.1 mm? -98.07 -13.34 21.07 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -51.15 -18.0 0.78 Allowed 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 119.249 -0.98 . . . . 0.0 111.055 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.476 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.1 mt -78.51 -65.86 0.31 Allowed Pre-proline 0 N--CA 1.482 1.14 0 C-N-CA 118.592 -1.243 . . . . 0.0 110.278 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.476 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 6.1 Cg_exo -49.22 -33.44 28.02 Favored 'Trans proline' 0 C--N 1.318 -1.079 0 N-CA-C 110.161 -0.746 . . . . 0.0 110.161 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.21 -38.59 75.3 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 119.48 -0.888 . . . . 0.0 110.05 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.65 -22.55 46.36 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.079 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.58 15.69 19.2 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.696 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -115.52 -63.85 1.4 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.24 -21.82 61.33 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.704 -1.198 . . . . 0.0 112.532 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -152.84 160.2 43.07 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.854 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.532 ' N ' ' CD ' ' S' ' 45' ' ' PRO . 0.6 OUTLIER 178.93 -41.65 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 118.306 -1.357 . . . . 0.0 114.32 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.532 ' CD ' ' N ' ' S' ' 44' ' ' THR . 10.6 Cg_endo -75.88 -98.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.255 1.303 . . . . 0.0 113.064 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.59 -24.88 1.48 Allowed 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.875 -1.13 . . . . 0.0 110.351 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -59.31 -69.17 0.21 Allowed 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.778 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -29.45 4.48 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.7 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -82.56 -67.88 0.75 Allowed 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 118.759 -1.176 . . . . 0.0 112.203 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.11 -51.09 71.1 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 3.9 tp -39.47 -58.32 1.28 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.214 -179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . 0.4 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -53.98 -44.0 72.2 Favored Glycine 0 N--CA 1.492 2.383 0 C-N-CA 119.28 -1.438 . . . . 0.0 109.912 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -47.6 -75.87 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.64 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.626 ' HE ' ' CA ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -48.74 -24.87 1.55 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.437 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -79.06 -27.61 13.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.342 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -81.79 -37.91 26.41 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.307 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . 0.452 ' CD1' ' C ' ' S' ' 57' ' ' ILE . 0.0 OUTLIER -73.61 -35.07 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 117.326 -1.75 . . . . 0.0 107.931 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 11.8 t -60.56 -56.02 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 117.925 -1.51 . . . . 0.0 109.292 179.471 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.83 -27.06 49.54 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.462 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -71.79 -52.19 18.81 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.017 -1.073 . . . . 0.0 112.821 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . 0.445 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -60.74 -24.69 65.91 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 117.738 -1.585 . . . . 0.0 110.269 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . 0.663 ' O ' ' N ' ' S' ' 64' ' ' GLY . 5.3 tp -85.38 25.48 1.02 Allowed 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.539 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . 0.445 ' H ' ' C ' ' S' ' 61' ' ' LEU . 6.6 mtp-105 14.7 40.72 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.1 0 O-C-N 124.696 1.248 . . . . 0.0 114.315 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.663 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -90.22 -14.23 59.19 Favored Glycine 0 N--CA 1.489 2.224 0 C-N-CA 119.494 -1.336 . . . . 0.0 109.84 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -135.4 -66.76 0.56 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.016 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.94 -175.09 2.61 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.64 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 67' ' ' SER . . . . . 0.521 ' O ' ' N ' ' S' ' 69' ' ' ARG . 3.1 p -163.05 -78.67 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.468 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.554 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.9 OUTLIER -30.26 -36.23 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.784 179.681 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . 0.649 HH21 HD21 ' S' ' 73' ' ' ASN . 7.9 tpt180 -73.05 31.4 0.07 Allowed 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.291 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.554 ' H ' ' C ' ' S' ' 68' ' ' GLN . 3.0 mt-10 -91.7 -51.3 5.31 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.611 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 11.8 mt -47.39 145.06 2.61 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.146 -1.022 . . . . 0.0 110.26 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 29.1 tttm -60.85 124.56 20.82 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.863 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . 0.649 HD21 HH21 ' S' ' 69' ' ' ARG . 17.5 m-20 -104.19 -103.06 0.31 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.539 0.685 . . . . 0.0 110.696 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -147.85 -40.67 0.17 Allowed 'General case' 0 C--N 1.28 -2.434 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.816 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.2 tp -130.17 18.97 5.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.484 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -73.58 -57.89 4.8 Favored Glycine 0 N--CA 1.491 2.353 0 C-N-CA 119.577 -1.297 . . . . 0.0 110.89 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.44 -67.31 0.16 Allowed 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.199 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . 0.469 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 152.74 161.64 10.41 Favored Glycine 0 N--CA 1.491 2.333 0 C-N-CA 119.193 -1.48 . . . . 0.0 110.945 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.445 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -65.57 -40.68 88.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 C-N-CA 120.024 -0.671 . . . . 0.0 111.055 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.439 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -67.29 -37.11 82.87 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.274 -0.971 . . . . 0.0 111.617 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 81' ' ' THR . . . . . 0.642 ' HG1' ' N ' ' S' ' 82' ' ' ILE . 77.7 p -60.2 -56.42 21.84 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.337 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . 0.642 ' N ' ' HG1' ' S' ' 81' ' ' THR . 18.5 pt -57.25 -0.63 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.515 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.51 ' H ' ' C ' ' S' ' 81' ' ' THR . 0.0 OUTLIER -98.49 -69.98 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.257 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . 0.65 ' NH2' ' H ' ' R' ' 109' ' ' TRP . 0.1 OUTLIER -58.68 -3.84 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 118.859 -1.136 . . . . 0.0 110.922 -179.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . 0.507 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -95.69 -22.59 20.74 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.341 -1.409 . . . . 0.0 110.292 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 65.2 p -87.32 -12.83 45.3 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.279 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' S' ' 89' ' ' LEU . 9.2 m120 -102.87 3.72 36.9 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -40.32 -24.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.852 -0.739 . . . . 0.0 111.22 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' S' ' 87' ' ' ASN . 7.3 mt -55.84 -49.58 72.93 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.922 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -103.92 -34.96 8.31 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.092 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.0 -71.42 0.07 Allowed 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.2 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.7 159.22 85.9 Favored Pre-proline 0 N--CA 1.488 1.436 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.351 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -57.12 176.79 0.22 Allowed 'Trans proline' 0 C--N 1.323 -0.791 0 C-N-CA 121.668 1.579 . . . . 0.0 112.038 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 65.7 t -96.08 -9.64 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.628 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -77.12 -22.29 52.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.584 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -37.9 79.45 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.847 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 -47.9 82.3 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.747 -0.781 . . . . 0.0 111.439 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -80.2 -8.15 59.3 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.908 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 6.2 t90 -101.37 -65.63 0.96 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 118.925 -1.11 . . . . 0.0 112.398 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.554 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -59.15 -39.9 83.87 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -179.67 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.554 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.0 OUTLIER -40.98 -29.91 0.12 Allowed 'General case' 0 C--N 1.296 -1.748 0 C-N-CA 117.563 -1.655 . . . . 0.0 106.95 179.738 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.545 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 mt-10 -91.88 -24.6 19.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 112.9 -1.955 . . . . 0.0 112.348 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . 0.527 ' N ' ' O ' ' S' ' 100' ' ' LEU . 18.9 t -87.96 -21.19 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 116.536 -2.066 . . . . 0.0 109.833 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tp -86.94 -57.78 2.84 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.949 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.35 -75.09 0.2 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 118.728 -1.189 . . . . 0.0 110.343 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -76.63 47.39 0.49 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.381 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.305 -1.352 0 CA-C-O 116.324 -1.798 . . . . 0.0 110.921 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.418 ' CD1' ' NE ' ' R' ' 84' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.281 0 CA-C-O 116.36 -1.781 . . . . 0.0 110.413 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.65 ' H ' ' NH2' ' S' ' 84' ' ' ARG . 21.6 p-90 . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 116.411 -1.757 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . 0.527 ' H2 ' ' CD ' ' R' ' 4' ' ' GLN . 2.6 mp0 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.896 0.379 . . . . 0.0 110.119 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 51.5 m 45.41 67.83 3.87 Favored Pre-proline 0 C--N 1.304 -1.407 0 C-N-CA 119.493 -0.883 . . . . 0.0 111.657 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -63.82 109.89 1.18 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 121.606 1.537 . . . . 0.0 111.092 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -145.39 7.36 1.14 Allowed 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.237 -0.985 . . . . 0.0 111.208 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 3.2 m -80.16 79.46 6.71 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.912 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -96.72 -112.13 0.14 Allowed 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 119.556 -0.858 . . . . 0.0 110.676 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . 45.61 -164.0 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.32 -0.952 . . . . 0.0 110.839 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 11' ' ' MET . . . . . 0.526 ' N ' ' SD ' ' R' ' 11' ' ' MET . 0.0 OUTLIER -69.4 145.36 52.92 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.684 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -140.69 -137.58 0.12 Allowed 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.637 -0.825 . . . . 0.0 111.044 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -97.94 56.16 1.22 Allowed 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.644 -0.822 . . . . 0.0 111.121 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -115.58 -140.75 0.37 Allowed 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.579 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' R' ' 17' ' ' GLN . 23.5 ttt180 -160.55 -93.66 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 118.945 -1.102 . . . . 0.0 111.145 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -38.74 83.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' R' ' 15' ' ' ARG . 1.5 mt-30 -123.15 -91.42 0.55 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.301 -0.56 . . . . 0.0 109.795 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -57.24 -24.1 52.47 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . 0.4 ' N ' ' C ' ' R' ' 17' ' ' GLN . 9.4 t-105 -59.17 -46.99 86.95 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 112.559 -2.11 . . . . 0.0 106.214 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.0 tp -56.34 -47.22 79.25 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.562 -2.108 . . . . 0.0 110.411 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.0 OUTLIER -47.99 -70.0 0.11 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 119.05 -1.06 . . . . 0.0 110.416 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.5 OUTLIER -27.38 -51.14 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.329 179.675 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . 0.423 ' O ' ' N ' ' R' ' 26' ' ' LEU . 1.2 t -68.73 -46.29 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.326 -0.949 . . . . 0.0 110.991 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . 0.504 ' N ' ' O ' ' R' ' 21' ' ' ARG . 64.0 t0 -39.03 -45.37 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.709 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 mt -75.88 -34.91 60.0 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.06 -1.056 . . . . 0.0 109.986 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . 0.423 ' N ' ' O ' ' R' ' 23' ' ' VAL . 1.0 OUTLIER -55.57 -31.81 62.49 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.048 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -79.93 -39.53 30.1 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 118.931 -1.108 . . . . 0.0 112.244 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -85.86 -18.18 33.53 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.898 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.36 -58.84 2.76 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 118.968 -1.093 . . . . 0.0 111.766 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -45.47 -32.15 2.06 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.596 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' R' ' 31' ' ' GLN . 0.3 OUTLIER -46.79 -40.75 14.22 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.099 -1.04 . . . . 0.0 109.667 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . 0.4 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 63.6 t30 -106.51 -73.53 0.68 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.561 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . 0.4 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.5 OUTLIER 170.6 18.17 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 119.134 -1.026 . . . . 0.0 112.63 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . 0.458 ' H ' HD21 ' R' ' 34' ' ' LEU . 0.9 OUTLIER -88.8 -13.44 39.41 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.05 -1.06 . . . . 0.0 109.19 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 46.5 p-80 -51.55 -27.52 11.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.385 -1.279 . . . . 0.0 113.024 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.456 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.9 mt -70.17 -62.52 2.21 Favored Pre-proline 0 N--CA 1.486 1.365 0 C-N-CA 117.872 -1.531 . . . . 0.0 110.815 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.1 Cg_exo -51.63 -25.21 19.34 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 C-N-CA 120.743 0.962 . . . . 0.0 110.667 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 24.5 mt -81.08 -38.83 26.68 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.096 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.94 -21.09 60.7 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.163 179.87 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . 0.546 ' O ' ' ND2' ' R' ' 40' ' ' ASN . 0.1 OUTLIER -103.69 11.68 35.68 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.374 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 39.4 tp -107.0 -69.81 0.82 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.635 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 1.1 mtt -77.36 7.74 4.97 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 118.121 -1.432 . . . . 0.0 112.81 -179.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 9.0 mp -116.5 -176.2 2.91 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.63 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.443 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.275 0.0 OUTLIER -126.2 -153.33 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 118.543 -1.263 . . . . 0.0 109.62 179.996 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.443 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -97.99 -38.27 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.612 0 CA-C-N 119.95 1.018 . . . . 0.0 111.351 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . 0.439 ' OD1' ' OE1' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -56.42 -18.96 12.84 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.092 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . 0.439 ' OE1' ' OD1' ' R' ' 46' ' ' ASP . 3.6 mp0 -60.67 -71.33 0.14 Allowed 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.327 -0.949 . . . . 0.0 109.727 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -43.67 -44.45 6.44 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.674 -0.81 . . . . 0.0 109.867 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . 0.466 ' O ' ' OG1' ' R' ' 53' ' ' THR . 8.0 mm-40 -56.47 -77.32 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.06 -1.056 . . . . 0.0 111.58 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -66.73 -60.07 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.286 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . 0.452 ' C ' ' O ' ' R' ' 50' ' ' ALA . 4.5 tt -34.02 -58.53 0.45 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.122 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.2 -48.09 59.87 Favored Glycine 0 N--CA 1.488 2.11 0 C-N-CA 119.042 -1.551 . . . . 0.0 109.44 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.506 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.3 OUTLIER -48.46 -79.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.895 -0.722 . . . . 0.0 112.453 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . 0.53 ' H ' ' CD ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -39.88 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.826 -179.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' R' ' 53' ' ' THR . 1.5 t -88.43 -30.18 5.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 C-N-CA 118.488 -1.285 . . . . 0.0 111.236 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -76.58 -37.41 56.56 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.146 -1.022 . . . . 0.0 110.163 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -76.79 -52.42 17.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 C-N-CA 118.834 -1.147 . . . . 0.0 109.651 -179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.5 p -51.99 -44.42 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 117.692 -1.603 . . . . 0.0 110.742 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . 0.503 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 1.5 tm-20 -66.73 -29.56 69.57 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.625 -0.83 . . . . 0.0 111.251 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -48.81 20.88 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.985 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 97.8 mt -70.69 -22.69 62.44 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.681 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . 0.461 ' C ' ' H ' ' R' ' 64' ' ' GLY . 6.5 tp -61.58 -36.84 81.8 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.297 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . 0.651 ' O ' ' N ' ' R' ' 65' ' ' GLU . 17.1 ttm180 -80.19 16.13 1.35 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.311 -0.956 . . . . 0.0 109.999 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . 0.461 ' H ' ' C ' ' R' ' 62' ' ' LEU . . . 17.58 37.18 0.01 OUTLIER Glycine 0 N--CA 1.504 3.215 0 O-C-N 124.697 1.248 . . . . 0.0 114.37 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.651 ' N ' ' O ' ' R' ' 63' ' ' ARG . 0.3 OUTLIER -54.52 -29.77 51.59 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 118.793 -1.163 . . . . 0.0 109.767 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -151.77 157.78 42.45 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.251 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 6.2 t -169.29 70.67 0.07 Allowed 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.987 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -131.13 -97.44 0.33 Allowed 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.922 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.13 30.16 3.22 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 120.194 -0.602 . . . . 0.0 111.042 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.444 ' O ' ' OE1' ' R' ' 74' ' ' GLU . 43.7 mt-10 -130.09 33.29 4.39 Favored 'General case' 0 C--N 1.295 -1.768 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.794 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 23.1 mt -103.66 19.48 19.77 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 119.448 -0.901 . . . . 0.0 112.276 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 4.6 mttt -157.33 -68.5 0.1 Allowed 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 117.948 -1.501 . . . . 0.0 113.048 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -77.38 0.02 23.98 Favored 'General case' 0 C--N 1.308 -1.197 0 C-N-CA 118.661 -1.215 . . . . 0.0 112.298 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . 0.444 ' OE1' ' O ' ' R' ' 70' ' ' GLU . 1.2 pt-20 -60.19 -28.68 68.16 Favored 'General case' 0 C--N 1.278 -2.511 0 C-N-CA 118.201 -1.4 . . . . 0.0 107.471 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . 0.623 ' O ' ' N ' ' R' ' 77' ' ' ALA . 0.8 OUTLIER -136.04 15.08 3.3 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 114.002 -1.454 . . . . 0.0 109.593 179.766 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . 0.482 ' C ' ' O ' ' R' ' 75' ' ' LEU . . . 21.34 38.95 0.01 OUTLIER Glycine 0 N--CA 1.505 3.298 0 O-C-N 124.266 0.979 . . . . 0.0 112.25 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . 0.623 ' N ' ' O ' ' R' ' 75' ' ' LEU . . . -75.39 -78.86 0.1 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.384 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . 0.517 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 171.19 157.8 13.86 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.771 -1.332 . . . . 0.0 109.771 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.569 ' N ' ' CD1' ' R' ' 79' ' ' ILE . 0.7 OUTLIER -73.56 28.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 C-N-CA 119.754 -0.778 . . . . 0.0 112.51 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.517 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.99 -37.4 5.61 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 81' ' ' THR . . . . . 0.487 ' HA ' ' HE1' ' R' ' 1' ' ' TRP . 17.4 p -95.87 -56.44 2.66 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.182 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 pp -47.43 -13.99 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.393 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.487 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -66.25 -80.43 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.642 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . 0.723 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -54.18 -20.5 6.92 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.808 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.99 -46.7 91.05 Favored Glycine 0 N--CA 1.489 2.194 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.101 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -27.95 7.55 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.187 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . 0.644 ' C ' ' H ' ' R' ' 89' ' ' LEU . 1.9 t-20 -88.3 -56.27 3.39 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.793 -1.163 . . . . 0.0 111.446 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 88' ' ' SER . . . . . 0.597 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.8 -2.91 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.605 -1.238 . . . . 0.0 110.459 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . 0.749 ' O ' ' N ' ' R' ' 91' ' ' ALA . 1.2 mm? 28.79 32.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.805 1.316 . . . . 0.0 110.929 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' R' ' 88' ' ' SER . 6.9 tptt 20.19 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 114.163 -1.381 . . . . 0.0 113.927 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . 0.749 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -88.13 -3.09 58.93 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.749 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.89 171.13 8.99 Favored Pre-proline 0 N--CA 1.487 1.416 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.83 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 6.1 Cg_exo -59.33 120.35 8.15 Favored 'Trans proline' 0 C--N 1.324 -0.758 0 C-N-CA 121.112 1.208 . . . . 0.0 111.618 179.925 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 43.1 t -60.99 -37.61 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 118.966 -1.094 . . . . 0.0 109.979 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -60.4 -10.05 4.36 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.709 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 3.2 tt -72.3 -55.03 7.82 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.678 -0.809 . . . . 0.0 110.074 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . 0.488 ' O ' ' CG ' ' R' ' 101' ' ' GLU . 0.0 OUTLIER -63.13 -12.06 24.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.088 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -80.96 -34.2 33.32 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.049 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . 0.616 ' HE1' ' ND2' ' S' ' 32' ' ' ASN . 46.2 t90 -80.52 -58.84 2.93 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 121.952 0.882 . . . . 0.0 111.129 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.587 ' C ' ' N ' ' R' ' 102' ' ' GLU . 0.3 OUTLIER -70.43 -15.2 62.8 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 117.416 -1.714 . . . . 0.0 115.26 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' R' ' 97' ' ' ARG . 3.0 mm-40 -57.94 -18.71 25.1 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.587 ' N ' ' C ' ' R' ' 100' ' ' LEU . 5.0 mt-10 -99.13 -35.63 9.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 112.378 -2.192 . . . . 0.0 114.195 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 5.1 t -73.55 -14.18 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 113.958 -3.097 . . . . 0.0 108.761 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 mt -88.65 -58.6 2.49 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.399 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 15.8 mt -62.5 -77.87 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.887 -1.125 . . . . 0.0 110.38 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.8 tptm -43.58 -81.22 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.718 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 CA-C-O 116.27 -1.824 . . . . 0.0 110.67 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.963 0.411 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 70.2 m 45.29 67.61 4.05 Favored Pre-proline 0 N--CA 1.488 1.437 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.431 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -68.7 -52.8 0.39 Allowed 'Trans proline' 0 C--N 1.313 -1.317 0 C-N-CA 121.897 1.732 . . . . 0.0 111.794 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -80.9 52.1 1.67 Allowed 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.302 -0.959 . . . . 0.0 111.596 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 60.3 p -80.88 3.38 22.9 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 119.183 -1.007 . . . . 0.0 111.148 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.13 -44.16 92.02 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.756 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . 50.28 95.78 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.696 -0.802 . . . . 0.0 111.435 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 3.6 mtm -93.72 -57.08 2.67 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.436 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . 0.431 ' O ' ' O ' ' S' ' 13' ' ' GLU . . . -165.94 -33.33 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.601 -0.839 . . . . 0.0 110.727 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . 0.431 ' O ' ' O ' ' S' ' 12' ' ' ALA . 7.1 mt-10 52.09 169.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.946 -0.702 . . . . 0.0 111.523 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -127.57 107.14 9.67 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.291 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -97.76 117.7 32.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.633 -0.827 . . . . 0.0 111.446 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.49 15.72 6.55 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.174 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.473 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.5 mp0 -88.58 -90.07 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.906 -0.717 . . . . 0.0 110.461 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.514 ' N ' ' CD ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -43.45 -26.54 0.21 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.443 1.116 . . . . 0.0 109.198 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . 0.473 ' N ' ' C ' ' S' ' 17' ' ' GLN . 53.9 t-105 -57.11 -60.96 2.82 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 113.114 -1.857 . . . . 0.0 109.724 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 4.9 tp -43.49 -35.35 1.61 Allowed 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.851 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' S' ' 23' ' ' VAL . 29.7 mtt180 -64.01 -71.95 0.16 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.945 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.513 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -25.89 -40.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.461 0.476 . . . . 0.0 111.791 179.604 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . 0.552 ' N ' ' O ' ' S' ' 21' ' ' ARG . 89.4 t -73.65 -71.65 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 C-N-CA 119.959 -0.696 . . . . 0.0 111.718 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.417 ' C ' ' O ' ' S' ' 23' ' ' VAL . 33.1 t70 -28.28 -35.83 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . 0.52 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.5 mt -87.3 -44.07 11.69 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.015 -1.074 . . . . 0.0 111.069 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -57.15 -63.13 1.32 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.156 -1.017 . . . . 0.0 111.74 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -50.55 -49.17 56.7 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -67.46 -35.61 79.53 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.737 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -27.91 69.46 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 118.896 -1.121 . . . . 0.0 111.771 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -51.19 -53.57 33.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 118.694 -1.202 . . . . 0.0 110.519 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.12 -14.82 4.35 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.404 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.616 ' ND2' ' HE1' ' R' ' 99' ' ' TRP . 0.6 OUTLIER -105.43 -17.16 14.52 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.544 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.485 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.7 t0 75.13 25.35 1.35 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.847 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . 0.427 ' N ' HD21 ' S' ' 34' ' ' LEU . 0.4 OUTLIER -101.5 -13.97 17.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.881 179.97 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 12.2 p-80 -47.11 -19.8 0.14 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.926 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -80.16 -65.71 0.27 Allowed Pre-proline 0 N--CA 1.484 1.254 0 C-N-CA 117.593 -1.643 . . . . 0.0 110.43 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -50.25 -24.52 11.7 Favored 'Trans proline' 0 C--N 1.32 -0.95 0 N-CA-C 110.066 -0.782 . . . . 0.0 110.066 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . 0.51 ' O ' ' SD ' ' S' ' 42' ' ' MET . 73.1 mt -82.5 -39.1 22.91 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.929 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . 0.473 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.2 OUTLIER -52.36 -38.26 58.31 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.898 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . 0.425 ' ND2' HH22 ' S' ' 48' ' ' ARG . 0.3 OUTLIER -76.23 13.13 0.97 Allowed 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 118.748 -1.181 . . . . 0.0 110.16 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . 0.473 ' H ' ' C ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER -116.2 -54.9 2.44 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.568 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 42' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.0 OUTLIER -82.85 -8.02 59.61 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 118.13 -1.428 . . . . 0.0 112.057 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -112.78 173.47 6.36 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.476 ' CB ' ' CD ' ' S' ' 45' ' ' PRO 0.295 0.3 OUTLIER -129.12 -140.63 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.57 0 CA-C-O 117.37 -1.3 . . . . 0.0 109.497 179.941 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.476 ' CD ' ' CB ' ' S' ' 44' ' ' THR . 12.1 Cg_endo -98.95 -44.4 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.501 0 CA-C-N 122.282 1.851 . . . . 0.0 111.102 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -23.03 5.49 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.102 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -68.5 -51.01 47.92 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.022 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . 0.425 HH22 ' ND2' ' S' ' 40' ' ' ASN . 4.8 mpt_? -55.76 -46.96 77.76 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.459 -0.792 . . . . 0.0 112.442 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.49 -66.08 0.6 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . 0.486 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -60.32 -61.59 2.49 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . 0.437 ' C ' ' CD1' ' S' ' 51' ' ' LEU . 0.2 OUTLIER -45.48 -38.11 5.91 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.529 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.22 -40.66 99.33 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 108.279 -1.928 . . . . 0.0 108.279 179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.531 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -54.74 -73.89 0.05 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.291 -0.954 . . . . 0.0 110.921 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.431 ' HB3' ' CZ3' ' R' ' 109' ' ' TRP . 1.3 mmt180 -37.43 -39.15 0.28 Allowed 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.262 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.1 t -64.11 -40.86 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 C-N-CA 117.742 -1.583 . . . . 0.0 109.246 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' S' ' 53' ' ' THR . 30.2 mtt180 -62.27 -51.59 67.11 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.691 -1.203 . . . . 0.0 109.325 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 2.0 mt -54.76 -64.96 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.784 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 86.2 t -43.29 -70.68 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.915 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -52.79 -31.13 36.98 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -34.38 64.25 Favored 'General case' 0 C--N 1.308 -1.225 0 C-N-CA 118.238 -1.385 . . . . 0.0 111.438 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 15.3 mt -75.5 -39.39 58.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.292 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mt -60.04 -31.53 70.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.284 -0.967 . . . . 0.0 110.197 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . 0.66 ' O ' ' N ' ' S' ' 65' ' ' GLU . 0.4 OUTLIER -83.81 5.08 26.37 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.405 -0.918 . . . . 0.0 110.629 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.443 ' C ' ' O ' ' S' ' 63' ' ' ARG . . . 19.88 36.83 0.01 OUTLIER Glycine 0 N--CA 1.506 3.364 0 O-C-N 124.429 1.081 . . . . 0.0 113.122 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . 0.66 ' N ' ' O ' ' S' ' 63' ' ' ARG . 2.4 mm-40 -89.42 -36.12 15.63 Favored 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 119.439 -0.905 . . . . 0.0 110.82 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -168.15 111.54 0.61 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.367 -0.933 . . . . 0.0 111.428 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 90.2 p -159.09 64.6 0.4 Allowed 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.511 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.51 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.4 OUTLIER -133.16 -18.23 2.31 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 119.774 -0.77 . . . . 0.0 112.381 -179.774 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . 0.678 ' O ' ' N ' ' S' ' 71' ' ' LEU . 1.9 tpt180 -68.45 31.31 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.51 ' H ' ' C ' ' S' ' 68' ' ' GLN . 49.3 mt-10 5.91 49.69 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.775 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . 0.678 ' N ' ' O ' ' S' ' 69' ' ' ARG . 0.6 OUTLIER -46.63 -21.0 0.15 Allowed 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 119.641 -0.824 . . . . 0.0 112.357 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt 52.73 -112.28 0.67 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.462 -0.895 . . . . 0.0 111.219 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . 0.497 ' O ' ' C ' ' S' ' 74' ' ' GLU . 52.7 t30 -129.09 6.16 5.39 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.292 -0.963 . . . . 0.0 113.405 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 73' ' ' ASN . 2.5 mm-40 -42.77 -46.85 5.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.094 -1.817 . . . . 0.0 106.094 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.3 tp -143.32 24.58 1.76 Allowed 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 112.919 -1.946 . . . . 0.0 108.514 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -127.42 -99.79 1.06 Allowed Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.896 -1.621 . . . . 0.0 113.023 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . 0.404 ' O ' ' CG ' ' S' ' 73' ' ' ASN . . . -150.59 -67.66 0.19 Allowed 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.062 -1.055 . . . . 0.0 112.765 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.57 160.08 33.11 Favored Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.093 -1.527 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.455 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -61.97 -39.87 85.23 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.273 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.21 -58.48 6.89 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.329 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 81' ' ' THR . . . . . 0.41 ' C ' ' H ' ' S' ' 83' ' ' THR . 73.1 p -42.2 -59.29 1.84 Allowed 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 34.1 pt -60.14 -3.16 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 119.093 -1.043 . . . . 0.0 112.925 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -107.81 -37.77 6.03 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.749 -0.78 . . . . 0.0 111.396 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . 0.456 ' O ' ' OG ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -81.34 19.19 1.0 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.482 -179.965 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.9 -38.88 2.81 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.595 -1.288 . . . . 0.0 110.424 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 86' ' ' SER . . . . . 0.401 ' C ' ' H ' ' S' ' 88' ' ' SER . 0.3 OUTLIER -87.19 -51.55 5.92 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.688 -179.987 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -79.37 11.18 3.1 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.321 -0.951 . . . . 0.0 110.107 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.456 ' OG ' ' O ' ' S' ' 84' ' ' ARG . 0.1 OUTLIER -72.9 -31.5 64.71 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.331 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' S' ' 88' ' ' SER . 7.3 mt -34.95 -50.49 0.48 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.539 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -40.01 -66.72 0.28 Allowed 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.576 0.703 . . . . 0.0 112.358 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.27 -46.47 17.71 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.442 -1.253 . . . . 0.0 112.572 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -42.49 153.69 0.3 Allowed Pre-proline 0 N--CA 1.49 1.571 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.252 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -58.26 141.42 96.74 Favored 'Trans proline' 0 C--O 1.216 -0.6 0 C-N-CA 121.53 1.487 . . . . 0.0 112.139 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . 0.451 ' CG1' ' O ' ' S' ' 94' ' ' VAL . 63.4 t -109.71 11.13 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.087 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -99.21 -0.17 42.02 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.816 -0.753 . . . . 0.0 111.005 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 70.0 mt -101.64 -21.0 14.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.171 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.11 -24.05 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.679 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -101.57 -22.32 14.51 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.88 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . 0.428 ' CZ3' HG22 ' S' ' 103' ' ' VAL . 17.7 t90 -82.13 -60.45 2.22 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.999 -1.081 . . . . 0.0 112.959 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.527 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.4 OUTLIER -50.41 -36.27 32.12 Favored 'General case' 0 C--N 1.286 -2.188 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.998 -179.493 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.4 mt-10 -40.87 -32.14 0.21 Allowed 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.842 -1.543 . . . . 0.0 107.439 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.527 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -88.56 -28.19 20.9 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.042 -1.89 . . . . 0.0 112.381 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . 0.507 ' N ' ' O ' ' S' ' 100' ' ' LEU . 2.1 t -79.9 -35.91 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 115.233 -2.587 . . . . 0.0 108.331 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.5 -52.68 63.49 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.951 -1.1 . . . . 0.0 108.054 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 12.7 tp -56.48 -57.08 13.85 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 119.469 -0.892 . . . . 0.0 109.909 179.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -95.91 80.57 3.34 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.502 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.304 -1.411 0 CA-C-O 116.186 -1.864 . . . . 0.0 111.029 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.487 ' HE1' ' HA ' ' R' ' 81' ' ' THR . 1.0 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 116.409 -1.758 . . . . 0.0 110.474 . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.431 ' CZ3' ' HB3' ' S' ' 54' ' ' ARG . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 116.219 -1.848 . . . . 0.0 109.994 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 121.061 0.458 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 59.2 m 51.08 62.45 11.4 Favored Pre-proline 0 C--N 1.303 -1.418 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.768 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -65.03 156.03 64.96 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 C-N-CA 121.483 1.456 . . . . 0.0 111.139 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -109.52 -0.47 18.8 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.755 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m 59.2 28.43 17.73 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.981 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.74 117.69 17.76 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.599 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.54 -173.86 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.48 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -106.16 133.22 51.21 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.698 -0.801 . . . . 0.0 110.72 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -90.11 40.31 1.0 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.367 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -90.1 121.51 32.23 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.146 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -67.67 124.85 24.42 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.662 -0.815 . . . . 0.0 110.952 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.58 23.79 14.01 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.83 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -103.83 55.91 0.73 Allowed 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.556 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.6 tt0 -113.09 -82.27 0.59 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.272 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.1 OUTLIER -49.52 -21.66 1.02 Allowed 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 123.445 1.593 . . . . 0.0 106.937 179.571 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . 0.556 ' N ' ' C ' ' R' ' 17' ' ' GLN 0.257 43.2 t-105 -55.49 -51.66 66.25 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.607 -2.542 . . . . 0.0 109.042 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.07 -21.95 48.17 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.24 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.475 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.0 mmt85 -71.28 -72.07 0.23 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.354 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.475 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -35.5 -32.66 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.193 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . 0.473 ' N ' ' O ' ' R' ' 21' ' ' ARG . 89.0 t -81.95 -58.16 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.805 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . 0.439 ' HA ' ' HZ1' ' R' ' 27' ' ' LYS . 23.5 t0 -34.94 -45.2 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.385 -179.87 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . 0.404 ' O ' ' C ' ' R' ' 26' ' ' LEU . 0.7 OUTLIER -82.83 -40.2 20.67 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.726 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . 0.404 ' C ' ' O ' ' R' ' 25' ' ' LEU . 4.8 tp -37.75 -52.63 1.28 Allowed 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.789 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . 0.439 ' HZ1' ' HA ' ' R' ' 24' ' ' ASP . 0.1 OUTLIER -70.12 -51.85 28.3 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.615 -1.234 . . . . 0.0 112.501 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -51.02 -31.4 18.13 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.855 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.39 -53.45 5.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.0 -1.08 . . . . 0.0 112.692 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . 0.411 ' O ' ' C ' ' R' ' 31' ' ' GLN . 61.5 t80 -36.51 -51.19 0.82 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' R' ' 30' ' ' TYR . 1.9 tt0 -38.45 -35.69 0.19 Allowed 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.576 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -101.77 -80.82 0.5 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.796 -0.762 . . . . 0.0 110.638 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 168.35 35.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.689 0.757 . . . . 0.0 109.106 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . 0.413 ' N ' ' CD2' ' R' ' 34' ' ' LEU . 2.1 mm? -100.86 -19.3 16.0 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.434 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . 0.406 ' CG ' ' N ' ' R' ' 36' ' ' LEU . 6.3 p-80 -48.09 -41.2 25.61 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 114.842 -1.072 . . . . 0.0 112.754 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.1 mt -58.06 -64.07 3.18 Favored Pre-proline 0 C--N 1.302 -1.494 0 C-N-CA 117.988 -1.485 . . . . 0.0 111.146 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.9 Cg_endo -56.35 -17.26 20.46 Favored 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.955 1.103 . . . . 0.0 111.27 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.82 -56.46 3.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.099 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . 0.476 ' C ' ' H ' ' R' ' 41' ' ' LEU . 2.6 mm? -51.71 -33.78 35.93 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 117.988 -1.485 . . . . 0.0 108.049 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -12.94 0.07 Allowed 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.058 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . 0.476 ' H ' ' C ' ' R' ' 39' ' ' LEU . 11.6 mt -112.0 -58.01 2.19 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 120.0 -0.68 . . . . 0.0 111.349 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 42' ' ' MET . . . . . 0.498 ' N ' ' SD ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -87.03 39.11 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 118.235 -1.386 . . . . 0.0 110.279 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -160.48 170.62 20.58 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.275 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.461 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.314 0.1 OUTLIER -132.86 -153.68 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.619 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.817 -179.955 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.461 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -95.21 -40.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.217 -0.531 0 N-CA-C 110.01 -0.804 . . . . 0.0 110.01 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -58.93 -34.19 71.45 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.111 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . 0.47 ' N ' ' OE1' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -63.23 -48.06 79.86 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.945 179.908 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -37.94 28.94 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.016 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -77.64 -73.27 0.31 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.972 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.42 -48.03 37.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.906 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -61.69 1.59 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.176 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.57 -44.95 68.26 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 119.69 -1.243 . . . . 0.0 111.451 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.482 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.1 OUTLIER -52.57 -83.42 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.61 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 10.1 mtt85 -42.33 -21.77 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.798 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . 0.482 ' N ' ' O ' ' R' ' 53' ' ' THR . 2.3 t -82.04 -40.61 17.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.027 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.4 -30.93 33.45 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 118.594 -1.242 . . . . 0.0 112.825 -179.599 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -78.66 -42.51 25.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 C-N-CA 118.007 -1.477 . . . . 0.0 109.228 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.535 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.9 p -62.1 -49.42 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.68 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . 0.535 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 3.9 pt-20 -66.91 -28.15 68.07 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 117.93 -1.508 . . . . 0.0 111.351 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -72.18 -44.9 62.32 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 119.067 -1.053 . . . . 0.0 112.253 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 40.0 mt -82.61 -7.15 59.66 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.497 -1.281 . . . . 0.0 111.983 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp -66.37 -0.83 2.89 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 118.708 -1.197 . . . . 0.0 110.871 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . 0.655 ' O ' ' N ' ' R' ' 65' ' ' GLU . 2.3 mtp180 -95.27 7.86 44.86 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 119.389 -0.924 . . . . 0.0 111.299 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . 0.443 ' C ' ' O ' ' R' ' 63' ' ' ARG . . . 19.05 37.15 0.01 OUTLIER Glycine 0 N--CA 1.503 3.162 0 O-C-N 124.422 1.076 . . . . 0.0 113.491 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.655 ' N ' ' O ' ' R' ' 63' ' ' ARG . 2.5 mm-40 -63.86 -35.86 82.01 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.943 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mtm -140.23 166.22 25.28 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.489 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 9.6 t -171.98 70.9 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.231 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -130.79 -100.36 0.31 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.54 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.08 26.11 2.25 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.806 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -129.32 26.26 5.42 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.073 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mt -92.11 -19.62 22.11 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.422 -179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . 0.405 ' C ' ' H ' ' R' ' 74' ' ' GLU . 27.6 mttt -134.41 -55.61 0.85 Allowed 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 119.285 -0.966 . . . . 0.0 112.405 -179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -72.93 2.27 7.19 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 118.512 -1.275 . . . . 0.0 111.719 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . 0.405 ' H ' ' C ' ' R' ' 72' ' ' LYS . 0.4 OUTLIER -50.77 -43.79 58.53 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 179.82 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' R' ' 77' ' ' ALA . 5.4 tp -136.84 28.76 2.9 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.052 -1.431 . . . . 0.0 108.862 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . 0.462 ' C ' ' O ' ' R' ' 75' ' ' LEU . . . 23.16 37.49 0.01 OUTLIER Glycine 0 N--CA 1.504 3.198 0 O-C-N 124.347 1.03 . . . . 0.0 112.499 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . 0.598 ' N ' ' O ' ' R' ' 75' ' ' LEU . . . -76.6 -83.46 0.07 Allowed 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 119.709 -0.797 . . . . 0.0 110.985 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . 0.551 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 178.09 155.82 15.14 Favored Glycine 0 N--CA 1.488 2.165 0 C-N-CA 119.527 -1.32 . . . . 0.0 110.557 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.54 ' N ' ' CD1' ' R' ' 79' ' ' ILE . 0.8 OUTLIER -71.48 25.63 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 C-N-CA 119.887 -0.725 . . . . 0.0 112.168 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.551 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.2 -39.69 5.17 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 81' ' ' THR . . . . . 0.529 ' H ' ' HG1' ' R' ' 81' ' ' THR . 18.2 p -94.91 -61.16 1.54 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.857 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 1.8 pp -43.43 -22.29 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 119.319 -0.953 . . . . 0.0 110.998 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.465 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -60.24 -81.98 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.036 -179.922 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . 0.761 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -50.12 -26.01 4.06 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 118.738 -1.185 . . . . 0.0 110.015 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.95 -47.37 19.65 Favored Glycine 0 N--CA 1.486 1.981 0 C-N-CA 119.493 -1.337 . . . . 0.0 110.307 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.51 -56.18 2.43 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.103 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . 0.654 ' C ' ' H ' ' R' ' 89' ' ' LEU . 2.5 m-80 -43.41 -49.82 7.01 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.656 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 88' ' ' SER . . . . . 0.61 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.78 -1.05 0.5 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.377 -1.329 . . . . 0.0 109.954 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . 0.744 ' O ' ' N ' ' R' ' 91' ' ' ALA . 0.3 OUTLIER 27.59 33.37 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.172 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' R' ' 88' ' ' SER . 5.1 tptp 21.52 25.85 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 CA-C-N 114.249 -1.341 . . . . 0.0 113.404 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . 0.744 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -79.9 -20.65 45.33 Favored 'General case' 0 C--N 1.286 -2.171 0 C-N-CA 117.133 -1.827 . . . . 0.0 111.03 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -61.12 161.02 18.21 Favored Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.93 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -58.31 168.48 3.76 Favored 'Trans proline' 0 C--N 1.323 -0.8 0 C-N-CA 121.543 1.495 . . . . 0.0 111.525 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 12.5 t -91.46 -24.03 5.66 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.532 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.26 -9.23 38.56 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.515 -0.874 . . . . 0.0 110.996 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -66.33 -47.65 72.83 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.806 -0.758 . . . . 0.0 111.463 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -31.55 68.48 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.229 -0.989 . . . . 0.0 111.157 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -73.99 -19.69 60.57 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.206 -0.998 . . . . 0.0 111.298 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . 0.401 ' O ' ' C ' ' R' ' 100' ' ' LEU . 1.8 t90 -96.14 -70.22 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.311 -0.955 . . . . 0.0 112.629 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.586 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.1 mm? -36.6 -52.35 0.87 Allowed 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.586 ' C ' ' O ' ' R' ' 100' ' ' LEU . 47.9 mt-10 -33.85 -42.06 0.11 Allowed 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.087 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' R' ' 100' ' ' LEU . 0.4 OUTLIER -85.17 -29.74 24.51 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 113.455 -1.702 . . . . 0.0 112.874 -179.949 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . 0.53 ' N ' ' O ' ' R' ' 100' ' ' LEU . 4.7 t -80.79 -35.97 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 116.603 -2.039 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.37 -58.38 3.8 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 4.7 mt -47.51 -70.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 118.642 -1.223 . . . . 0.0 111.533 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -52.71 -60.94 2.64 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.993 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 107' ' ' SER . . . . . 0.407 ' C ' ' O ' ' R' ' 103' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 116.385 -1.769 . . . . 0.0 111.172 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . 0.5 HE21 ' C ' ' S' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 121.029 0.442 . . . . 0.0 110.223 . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 5' ' ' SER . . . . . 0.408 ' N ' ' HD3' ' S' ' 6' ' ' PRO . 17.5 m 52.07 58.74 15.33 Favored Pre-proline 0 C--N 1.302 -1.479 0 C-N-CA 119.862 -0.735 . . . . 0.0 111.801 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . 0.408 ' HD3' ' N ' ' S' ' 5' ' ' SER . 1.0 OUTLIER -63.84 -44.7 12.51 Favored 'Trans proline' 0 C--N 1.314 -1.25 0 C-N-CA 121.246 1.297 . . . . 0.0 110.54 179.898 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -61.29 137.8 58.24 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.753 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.33 -25.63 33.73 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.28 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . 0.431 ' O ' ' O ' ' S' ' 10' ' ' ALA . . . -163.45 -4.15 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.162 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . 0.431 ' O ' ' O ' ' S' ' 9' ' ' ALA . . . 52.67 168.01 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.519 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 13.7 mtm -145.16 143.41 30.32 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.7 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . 0.444 ' O ' ' N ' ' S' ' 14' ' ' GLN . . . -58.12 -94.85 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.24 -0.984 . . . . 0.0 110.648 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 64.49 -73.25 0.06 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.877 -0.729 . . . . 0.0 111.162 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . 0.444 ' N ' ' O ' ' S' ' 12' ' ' ALA . 24.1 mt-30 -122.34 98.74 6.07 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.828 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 -88.21 157.4 18.81 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.241 -0.984 . . . . 0.0 110.944 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . 0.451 ' O ' ' CG ' ' S' ' 16' ' ' HIS . 58.1 t-80 -142.68 12.69 1.9 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.926 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.449 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.3 mt-30 -88.94 -83.92 0.22 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.928 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' S' ' 17' ' ' GLN . 24.5 mt-10 -43.58 -32.74 1.0 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . 0.449 ' N ' ' C ' ' S' ' 17' ' ' GLN . 65.2 t-105 -48.5 -56.33 8.59 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 112.881 -1.963 . . . . 0.0 109.65 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.48 -35.9 42.05 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 113.693 -1.594 . . . . 0.0 111.679 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.559 ' O ' ' C ' ' S' ' 22' ' ' PHE . 50.4 mtt-85 -63.35 -73.24 0.12 Allowed 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.566 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.559 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.5 t80 -24.92 -50.68 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.643 0.735 . . . . 0.0 111.34 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . 0.414 ' O ' ' C ' ' S' ' 24' ' ' ASP . 24.8 t -70.56 -46.78 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.787 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' S' ' 21' ' ' ARG . 16.8 t0 -36.64 -62.95 0.44 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.919 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -64.0 -49.88 70.7 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 118.658 -1.217 . . . . 0.0 110.391 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -40.1 -63.27 0.63 Allowed 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.879 -179.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -57.04 6.39 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.404 -0.918 . . . . 0.0 112.606 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -64.36 -16.84 63.02 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.099 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' S' ' 31' ' ' GLN . . . -90.36 -47.9 7.46 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 118.933 -1.107 . . . . 0.0 112.491 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . 0.413 ' C ' ' O ' ' S' ' 29' ' ' ALA . 0.4 OUTLIER -40.19 -26.8 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.376 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.3 tt0 -75.71 -37.93 59.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.384 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 18.1 t-20 -95.1 -8.33 36.85 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.6 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.5 t0 84.71 23.05 0.1 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 123.626 0.579 . . . . 0.0 110.794 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.88 -16.46 31.88 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.025 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . 0.414 ' N ' ' HB2' ' S' ' 29' ' ' ALA . 26.4 p-80 -54.95 -25.3 28.6 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 113.97 -1.468 . . . . 0.0 113.018 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 5.6 mt -70.75 -63.34 1.63 Allowed Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.417 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.7 Cg_endo -54.61 -36.54 89.6 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 C-N-CA 120.636 0.89 . . . . 0.0 111.57 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . 0.511 ' O ' ' SD ' ' S' ' 42' ' ' MET . 19.7 mt -74.8 -37.52 62.33 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.656 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -53.07 -38.31 62.4 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.384 179.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -76.27 7.62 4.12 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.95 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.57 -55.62 2.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.724 -0.79 . . . . 0.0 112.457 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 42' ' ' MET . . . . . 0.561 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -78.67 6.38 8.96 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 118.496 -1.282 . . . . 0.0 111.474 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 68.6 mt -127.38 -175.62 3.5 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.519 ' CB ' ' CD ' ' S' ' 45' ' ' PRO 0.299 0.3 OUTLIER -129.23 -147.34 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.364 0 C-N-CA 118.681 -1.207 . . . . 0.0 109.51 -179.91 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.519 ' CD ' ' CB ' ' S' ' 44' ' ' THR . 8.0 Cg_endo -96.55 -42.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.218 -0.492 0 CA-C-N 120.147 1.088 . . . . 0.0 110.566 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -52.27 -29.94 25.48 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.891 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -59.92 -54.21 48.8 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.645 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.1 -39.82 60.37 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.471 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . 0.431 ' O ' ' OG1' ' S' ' 53' ' ' THR . 85.6 mt-10 -82.34 -68.65 0.68 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.831 -1.148 . . . . 0.0 112.49 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -49.68 -50.01 45.25 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . 0.449 ' C ' ' CD1' ' S' ' 51' ' ' LEU . 0.4 OUTLIER -60.08 -40.97 91.43 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 118.155 -1.418 . . . . 0.0 110.7 -179.947 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . 0.463 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -61.4 -30.96 75.65 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.518 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -65.16 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 114.748 -0.726 . . . . 0.0 110.733 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -41.35 -24.11 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . 0.485 ' N ' ' O ' ' S' ' 53' ' ' THR . 12.9 t -71.42 -44.28 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 117.957 -1.497 . . . . 0.0 107.627 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.3 OUTLIER -59.55 -48.65 80.81 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.997 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 mt -57.44 -63.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.968 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 79.5 t -46.5 -59.92 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 C-N-CA 118.243 -1.383 . . . . 0.0 111.467 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -61.02 -18.8 59.75 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.502 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -79.95 -39.38 30.32 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.657 -1.217 . . . . 0.0 111.002 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.15 -29.7 64.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.95 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.97 -66.59 0.36 Allowed 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 118.981 -1.088 . . . . 0.0 109.719 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . 0.678 ' O ' ' N ' ' S' ' 65' ' ' GLU . 0.0 OUTLIER -78.61 -44.0 25.01 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 179.773 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.431 ' C ' ' N ' ' S' ' 66' ' ' MET . . . 13.75 38.65 0.0 OUTLIER Glycine 0 N--CA 1.503 3.101 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.469 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . 0.678 ' N ' ' O ' ' S' ' 63' ' ' ARG . 0.0 OUTLIER -47.05 -25.41 0.82 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 118.542 -1.263 . . . . 0.0 109.177 179.726 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 66' ' ' MET . . . . . 0.431 ' N ' ' C ' ' S' ' 64' ' ' GLY . 0.5 OUTLIER -139.5 109.46 6.38 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.144 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 11.5 p -168.75 82.68 0.15 Allowed 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.297 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.584 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.0 OUTLIER -125.26 -17.16 5.74 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.521 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . 0.685 ' O ' ' N ' ' S' ' 71' ' ' LEU . 1.4 tpt180 -68.41 27.45 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.609 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.584 ' H ' ' C ' ' S' ' 68' ' ' GLN . 6.6 mt-10 13.11 40.09 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . 0.685 ' N ' ' O ' ' S' ' 69' ' ' ARG . 5.7 mp 11.13 -73.67 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' S' ' 70' ' ' GLU . 1.1 tptm 84.31 -156.66 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 O-C-N 123.791 0.682 . . . . 0.0 109.992 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' S' ' 77' ' ' ALA . 14.4 t-20 -107.74 6.51 27.69 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.319 -0.952 . . . . 0.0 112.281 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . 0.482 ' C ' ' O ' ' S' ' 73' ' ' ASN . 1.4 mt-10 -44.99 -44.67 10.09 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 tp -145.0 21.4 1.59 Allowed 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.929 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -129.94 -100.02 0.9 Allowed Glycine 0 N--CA 1.499 2.841 0 C-N-CA 118.829 -1.653 . . . . 0.0 112.96 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . 0.52 ' O ' ' ND2' ' S' ' 73' ' ' ASN . . . -147.29 -59.34 0.27 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.202 -0.999 . . . . 0.0 112.688 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 179.24 161.06 26.09 Favored Glycine 0 N--CA 1.491 2.331 0 C-N-CA 118.666 -1.731 . . . . 0.0 111.593 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.491 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.1 OUTLIER -59.73 -28.69 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 115.093 -0.554 . . . . 0.0 111.249 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.448 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.38 -55.29 16.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.508 -0.877 . . . . 0.0 113.248 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 80.9 p -46.52 -51.61 15.03 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 7.3 pt -70.81 11.47 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 C-N-CA 119.165 -1.014 . . . . 0.0 113.304 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -120.9 -46.48 2.34 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.062 179.89 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . 0.501 ' C ' ' H ' ' S' ' 86' ' ' SER . 3.0 ptm180 -63.89 -23.02 67.19 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.974 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.55 -4.9 1.54 Allowed Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.217 -1.468 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 86' ' ' SER . . . . . 0.501 ' H ' ' C ' ' S' ' 84' ' ' ARG . 1.0 OUTLIER -157.24 -12.92 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.542 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -92.91 -22.6 19.14 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.72 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.414 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.4 OUTLIER -75.85 -37.51 58.91 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.58 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' S' ' 88' ' ' SER . 26.4 mt -37.62 -43.7 0.64 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 120.229 -0.589 . . . . 0.0 111.844 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -42.66 -64.3 0.64 Allowed 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.47 15.69 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.825 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -59.28 164.84 4.38 Favored Pre-proline 0 N--CA 1.489 1.492 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.035 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -45.55 133.39 12.99 Favored 'Trans proline' 0 C--N 1.321 -0.913 0 C-N-CA 121.871 1.714 . . . . 0.0 112.49 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 4.1 t -108.92 -5.25 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.251 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.94 -7.16 1.58 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.932 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 2.7 mt -75.8 -32.96 60.1 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.716 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -37.47 72.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.456 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -72.47 -30.47 64.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.051 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 16.7 t90 -88.2 -61.77 1.64 Allowed 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -179.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.526 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.3 OUTLIER -52.36 -32.61 39.23 Favored 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 115.435 1.642 . . . . 0.0 115.435 -179.64 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' S' ' 100' ' ' LEU . 0.4 OUTLIER -43.78 -27.95 0.38 Allowed 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 117.751 -1.58 . . . . 0.0 106.953 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.526 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.8 mt-10 -94.98 -28.24 15.24 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.122 -1.853 . . . . 0.0 112.942 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . . . . . . . . . 2.1 t -77.65 -28.65 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 114.893 -2.723 . . . . 0.0 108.322 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.66 -56.82 4.32 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.458 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 6.5 mt -60.78 -69.42 0.23 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.709 -1.196 . . . . 0.0 110.957 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' S' ' 107' ' ' SER . 1.7 ttmm -96.86 162.38 13.44 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.406 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' S' S ' 107' ' ' SER . . . . . 0.466 ' N ' ' CG ' ' S' ' 106' ' ' LYS . 81.8 p . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 116.243 -1.837 . . . . 0.0 110.844 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . . . . . . . . . 32.0 m-90 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 116.478 -1.725 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . . . . . . . . . 11.5 m-90 . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 116.418 -1.753 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.881 0.372 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' R' R ' 5' ' ' SER . . . . . 0.519 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.2 OUTLIER -87.8 -46.08 0.48 Allowed Pre-proline 0 C--N 1.305 -1.354 0 C-N-CA 118.971 -1.092 . . . . 0.0 112.304 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.7 Cg_endo -68.39 141.68 52.06 Favored 'Trans proline' 0 C--N 1.32 -0.924 0 C-N-CA 120.699 0.933 . . . . 0.0 111.019 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.13 179.47 2.35 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 118.991 -1.084 . . . . 0.0 110.852 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.61 -27.87 1.29 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.647 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -112.97 58.98 0.65 Allowed 'General case' 0 N--CA 1.487 1.378 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.436 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.23 120.86 25.9 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.857 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 21.8 mmt -88.09 123.26 32.59 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.747 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.89 113.92 7.58 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.531 -0.868 . . . . 0.0 111.534 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.78 103.91 0.3 Allowed 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.343 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -43.29 147.46 0.37 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.429 -0.909 . . . . 0.0 111.38 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -97.33 78.61 2.72 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.588 -0.845 . . . . 0.0 111.374 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -157.1 -4.74 0.1 Allowed 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.076 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -91.42 -85.56 0.23 Allowed 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.231 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . 0.436 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.5 OUTLIER -45.52 -33.96 3.02 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 123.106 1.431 . . . . 0.0 107.66 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -52.71 -58.55 6.46 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 112.925 -1.943 . . . . 0.0 108.175 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.68 -28.66 65.96 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.695 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.535 ' O ' ' C ' ' R' ' 22' ' ' PHE . 10.4 mmt-85 -56.3 -68.02 0.25 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 117.885 -1.526 . . . . 0.0 110.144 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.535 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -33.3 -40.09 0.06 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.049 179.613 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . 0.428 ' N ' ' O ' ' R' ' 21' ' ' ARG . 14.9 t -72.05 -47.47 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 C-N-CA 119.469 -0.893 . . . . 0.0 110.44 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' R' ' 21' ' ' ARG . 36.0 t70 -45.5 -21.34 0.09 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.241 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 -43.37 6.36 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.994 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 tt -47.74 -38.0 14.46 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.325 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttp -76.64 -38.55 54.46 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -82.88 -2.2 54.17 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.113 -1.035 . . . . 0.0 113.63 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -115.47 -30.97 6.06 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.144 -1.022 . . . . 0.0 113.426 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -44.01 -38.95 3.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.111 -1.035 . . . . 0.0 112.164 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.76 -29.71 58.9 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.524 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.5 m-20 -87.86 -11.32 48.14 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 118.981 -1.088 . . . . 0.0 111.377 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 2.5 t70 81.19 24.69 0.27 Allowed 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.773 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -95.7 -22.15 17.73 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.821 0.82 . . . . 0.0 109.828 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 37.9 p-80 -52.82 -18.26 1.79 Allowed 'General case' 0 C--N 1.295 -1.804 0 CA-C-N 114.227 -1.352 . . . . 0.0 113.068 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.474 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.5 mt -78.82 -65.69 0.31 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 118.503 -1.279 . . . . 0.0 111.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.474 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.1 Cg_endo -50.93 -28.13 23.0 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 120.541 0.828 . . . . 0.0 110.227 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 7.2 mt -82.54 -34.83 27.72 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 119.354 -0.939 . . . . 0.0 111.482 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.14 -26.36 62.58 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.775 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.87 15.28 8.67 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 118.825 -1.15 . . . . 0.0 109.204 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . 0.494 ' C ' ' H ' ' R' ' 43' ' ' LEU . 1.8 tp -114.2 -63.6 1.43 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.376 -0.829 . . . . 0.0 113.007 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.6 OUTLIER -62.56 7.46 0.07 Allowed 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 117.443 -1.703 . . . . 0.0 112.253 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' R' ' 41' ' ' LEU . 2.3 pp -150.95 -177.25 5.9 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.389 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.533 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.312 0.3 OUTLIER -119.04 -150.82 0.01 OUTLIER Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.327 -179.846 . . . . . . . . 4 4 . 1 . 005 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.533 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 9.6 Cg_endo -93.37 -42.69 0.03 OUTLIER 'Trans proline' 0 C--O 1.213 -0.745 0 CA-C-N 119.228 0.76 . . . . 0.0 110.614 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.35 -21.98 6.64 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.391 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . 0.425 ' HG3' ' H ' ' R' ' 44' ' ' THR . 2.3 mt-10 -76.71 -41.89 43.48 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.018 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -62.63 -30.43 71.35 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.63 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -73.6 -62.97 1.3 Allowed 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.915 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.473 ' C ' HH21 ' R' ' 54' ' ' ARG . . . -52.73 -31.37 37.52 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.574 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.0 mt -56.36 -61.27 2.52 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.97 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.28 -53.37 9.47 Favored Glycine 0 N--CA 1.484 1.843 0 C-N-CA 119.119 -1.515 . . . . 0.0 110.009 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -39.71 -80.1 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.559 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . 0.473 HH21 ' C ' ' R' ' 50' ' ' ALA . 20.7 mtt180 -38.11 -53.74 1.39 Allowed 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.51 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 5.8 t -63.21 -31.18 51.77 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.75 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.95 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -78.67 -33.59 46.94 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.161 -1.416 . . . . 0.0 111.468 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.441 ' CD1' ' C ' ' R' ' 57' ' ' ILE . 0.0 OUTLIER -82.67 -34.99 12.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 117.754 -1.578 . . . . 0.0 108.264 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.414 ' N ' HD11 ' R' ' 57' ' ' ILE . 2.6 t -59.61 -53.49 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.419 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . 0.471 ' O ' ' N ' ' R' ' 63' ' ' ARG . 27.2 mt-10 -58.65 -46.84 86.26 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.012 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -48.36 -31.1 5.65 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.768 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 96.3 mt -96.92 -24.68 15.73 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.189 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp -97.06 -0.51 47.07 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 119.365 -0.934 . . . . 0.0 111.484 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' R' ' 59' ' ' GLU . 14.6 tpp180 -63.83 -71.43 0.17 Allowed 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 118.654 -1.219 . . . . 0.0 109.017 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -127.73 -68.71 0.15 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.268 -1.533 . . . . 0.0 109.268 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.502 ' O ' ' C ' ' R' ' 66' ' ' MET . 31.5 mt-10 -153.39 -48.02 0.09 Allowed 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 120.166 -0.614 . . . . 0.0 109.839 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 66' ' ' MET . . . . . 0.502 ' C ' ' O ' ' R' ' 65' ' ' GLU . 0.0 OUTLIER -8.21 111.23 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.771 1.294 . . . . 0.0 113.514 179.986 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 97.5 p -154.59 60.39 0.68 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.044 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.566 ' C ' ' H ' ' R' ' 70' ' ' GLU . 2.9 mt-30 -130.41 -43.56 1.15 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 120.039 -0.665 . . . . 0.0 110.486 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.15 31.5 0.07 Allowed 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 120.079 -0.649 . . . . 0.0 110.901 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.566 ' H ' ' C ' ' R' ' 68' ' ' GLN . 0.2 OUTLIER -89.03 10.2 22.48 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.893 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mt -51.37 176.87 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.211 -0.996 . . . . 0.0 110.666 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -118.66 118.4 31.54 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.961 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -101.24 -107.07 0.23 Allowed 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.335 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -153.73 -61.57 0.14 Allowed 'General case' 0 C--N 1.28 -2.443 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.881 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . . . . . . . . . 46.5 mt -85.72 -24.27 27.02 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.308 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -47.3 -71.56 0.53 Allowed Glycine 0 N--CA 1.489 2.175 0 C-N-CA 119.637 -1.268 . . . . 0.0 110.642 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -150.53 -101.44 0.07 Allowed 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.169 -1.012 . . . . 0.0 110.794 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -178.66 155.46 16.52 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 119.221 -1.466 . . . . 0.0 110.723 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.49 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.1 OUTLIER -46.74 -47.67 7.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.466 -179.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.423 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -59.83 -62.15 2.09 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 118.768 -1.173 . . . . 0.0 110.637 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 43.9 m -39.23 -47.76 1.7 Allowed 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 pt -77.32 -13.11 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.524 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -87.72 -58.94 2.39 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.607 -1.237 . . . . 0.0 112.099 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . 0.633 ' NE ' ' CD1' ' R' ' 1' ' ' TRP . 0.0 OUTLIER -65.92 6.6 0.35 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.362 -179.887 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . 0.524 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -102.51 -33.82 4.35 Favored Glycine 0 N--CA 1.492 2.378 0 C-N-CA 119.69 -1.243 . . . . 0.0 110.412 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 1.5 t -83.07 -30.59 27.9 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.477 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -93.63 8.42 40.94 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.956 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.41 -27.26 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.29 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 90.2 mt -44.11 -28.09 0.46 Allowed 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.202 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . 0.409 ' O ' ' C ' ' R' ' 91' ' ' ALA . 18.3 mttt -80.9 -71.45 0.47 Allowed 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.309 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -36.72 -63.18 0.43 Allowed 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.163 -1.38 . . . . 0.0 111.959 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -40.72 109.06 0.59 Allowed Pre-proline 0 N--CA 1.488 1.438 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.915 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -55.92 156.41 19.68 Favored 'Trans proline' 0 C--O 1.215 -0.629 0 C-N-CA 120.667 0.911 . . . . 0.0 111.83 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.5 -41.41 90.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.38 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -66.44 -27.93 68.2 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.803 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -39.05 83.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.545 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -27.83 63.39 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.467 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.31 -22.37 57.74 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.104 -1.039 . . . . 0.0 109.96 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 2.9 t90 -95.56 -66.48 0.91 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.909 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.509 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.2 mm? -41.16 -38.01 1.0 Allowed 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.509 ' C ' ' O ' ' R' ' 100' ' ' LEU . 7.3 mt-10 -41.31 -39.16 1.33 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 117.874 -1.53 . . . . 0.0 107.702 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.403 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.1 mt-10 -90.01 -27.63 19.63 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 113.428 -1.715 . . . . 0.0 112.427 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.3 t -89.05 -7.94 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 117.361 -1.736 . . . . 0.0 110.746 -179.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 8.6 tp -97.93 -54.03 3.21 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.507 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -69.28 -68.3 0.41 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 118.76 -1.176 . . . . 0.0 110.765 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -48.68 -23.93 1.2 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.91 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 19.5 t . . . . . 0 C--N 1.306 -1.319 0 CA-C-O 116.357 -1.782 . . . . 0.0 110.785 -179.974 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.44 164.0 0.53 Allowed Pre-proline 0 N--CA 1.487 1.386 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.479 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -60.04 -20.86 62.84 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 C-N-CA 121.129 1.219 . . . . 0.0 110.452 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.62 145.9 55.48 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.16 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 74.4 m -103.62 -107.4 0.27 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.606 179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . 174.49 139.33 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.202 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.57 105.2 2.16 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.543 -0.863 . . . . 0.0 110.68 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 11' ' ' MET . . . . . 0.461 ' CG ' ' O ' ' S' ' 11' ' ' MET . 3.2 ptp -57.12 98.55 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.042 -1.063 . . . . 0.0 110.404 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -143.19 -54.73 0.39 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.717 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -79.29 -10.1 59.74 Favored 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.089 -1.044 . . . . 0.0 110.453 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -85.99 100.16 11.95 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.071 -1.052 . . . . 0.0 109.766 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.97 120.46 5.38 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 118.887 -1.125 . . . . 0.0 110.392 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.23 -25.17 0.06 Allowed 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.326 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.429 ' O ' ' C ' ' S' ' 18' ' ' GLU . 0.3 OUTLIER -85.53 -69.57 0.65 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.693 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.429 ' C ' ' O ' ' S' ' 17' ' ' GLN . 3.3 mp0 -43.55 -41.39 4.47 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 123.133 1.444 . . . . 0.0 107.862 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.265 42.3 t-105 -52.73 -53.72 43.79 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 111.958 -2.383 . . . . 0.0 108.899 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.11 -37.54 72.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 113.8 -1.545 . . . . 0.0 110.759 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.507 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.6 mmt180 -51.0 -70.75 0.08 Allowed 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 118.283 -1.367 . . . . 0.0 109.28 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.507 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.53 -42.93 0.06 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.333 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 3.6 t -81.6 -33.15 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.119 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.498 ' N ' ' O ' ' S' ' 21' ' ' ARG . 55.6 t0 -53.42 -34.64 58.58 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 120.075 -0.65 . . . . 0.0 112.273 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.96 -44.55 7.65 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.664 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -45.01 -49.5 11.27 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.298 -179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.95 -71.18 0.07 Allowed 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.37 -0.932 . . . . 0.0 112.743 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.19 -5.86 1.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.791 -0.764 . . . . 0.0 113.054 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.55 -46.16 7.09 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.712 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -45.71 -52.5 10.84 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.618 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -42.0 -30.72 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.849 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.43 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 56.5 m-20 -99.5 -84.72 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 119.625 -0.83 . . . . 0.0 110.658 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.43 ' OD2' ' O ' ' S' ' 32' ' ' ASN . 0.5 OUTLIER 170.95 23.43 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 119.253 -0.979 . . . . 0.0 112.151 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . 0.583 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 1.3 mm? -94.43 -14.63 25.03 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.0 -1.08 . . . . 0.0 109.856 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 38.4 p-80 -48.76 -28.56 3.72 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.735 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.453 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.8 mt -72.74 -63.33 1.14 Allowed Pre-proline 0 C--N 1.303 -1.439 0 C-N-CA 118.285 -1.366 . . . . 0.0 111.419 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -52.28 -21.62 13.75 Favored 'Trans proline' 0 C--N 1.321 -0.882 0 C-N-CA 121.088 1.192 . . . . 0.0 111.376 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 23.5 mt -86.12 -44.51 12.18 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.9 OUTLIER -49.39 -45.55 46.25 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.12 -1.032 . . . . 0.0 109.858 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . 0.553 ' O ' ' N ' ' R' ' 1' ' ' TRP . 1.0 OUTLIER -60.87 -4.0 0.89 Allowed 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.618 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 mp -103.66 -59.25 1.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.091 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 42' ' ' MET . . . . . 0.48 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -95.64 22.66 6.9 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.586 -179.805 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.1 OUTLIER -169.39 123.85 0.81 Allowed 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.52 ' N ' ' CD ' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.75 -41.54 0.0 OUTLIER Pre-proline 0 N--CA 1.484 1.261 0 C-N-CA 117.084 -1.846 . . . . 0.0 114.855 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.52 ' CD ' ' N ' ' S' ' 44' ' ' THR . 19.1 Cg_endo -79.43 -109.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 121.12 1.213 . . . . 0.0 113.196 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -50.66 -12.8 0.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.488 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . 0.489 ' H ' ' C ' ' S' ' 45' ' ' PRO . 8.9 mm-40 -75.94 -71.82 0.36 Allowed 'General case' 0 C--N 1.297 -1.676 0 C-N-CA 119.544 -0.862 . . . . 0.0 110.582 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -49.55 -15.43 0.16 Allowed 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.894 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' C ' ' S' ' 47' ' ' GLU . 9.8 mm-40 -91.45 -69.11 0.75 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.433 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.04 -27.69 69.28 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.211 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.54 -63.59 1.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.629 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . 0.436 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -45.72 -48.15 13.05 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.013 -1.635 . . . . 0.0 109.013 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.509 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -45.43 -74.54 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.616 0.722 . . . . 0.0 111.86 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.438 HH21 HD21 ' R' ' 41' ' ' LEU . 0.0 OUTLIER -35.24 -58.99 0.54 Allowed 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.71 -1.132 . . . . 0.0 112.873 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 16.1 t -59.62 -25.28 31.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 C-N-CA 117.465 -1.694 . . . . 0.0 110.971 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -79.3 -38.72 34.63 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.296 -1.362 . . . . 0.0 111.443 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . 0.444 ' CD1' ' C ' ' S' ' 57' ' ' ILE . 0.0 OUTLIER -79.08 -34.65 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 117.801 -1.56 . . . . 0.0 108.827 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . 0.401 ' N ' HD11 ' S' ' 57' ' ' ILE . 78.1 t -68.68 -63.11 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.183 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -50.19 -31.14 13.02 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.412 -1.315 . . . . 0.0 110.193 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . 0.415 ' CG ' ' O ' ' S' ' 56' ' ' ARG . 7.7 mm-40 -62.12 -62.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.551 -0.86 . . . . 0.0 112.089 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . 0.53 ' C ' ' H ' ' S' ' 63' ' ' ARG . 4.6 pp -62.45 -8.63 6.46 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 117.738 -1.585 . . . . 0.0 109.716 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' S' ' 64' ' ' GLY . 2.3 tp -79.97 33.02 0.27 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.717 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . 0.53 ' H ' ' C ' ' S' ' 61' ' ' LEU . 19.7 mtm180 22.64 35.87 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.979 0 O-C-N 124.555 1.16 . . . . 0.0 113.736 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.598 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -96.28 -30.06 8.02 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -119.52 -73.23 0.65 Allowed 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.563 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 66' ' ' MET . . . . . 0.449 ' O ' ' CB ' ' S' ' 67' ' ' SER . 1.5 mmt -121.27 -134.55 0.31 Allowed 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.453 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 67' ' ' SER . . . . . 0.546 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.3 OUTLIER 165.08 -64.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 119.941 -0.704 . . . . 0.0 109.671 -179.992 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.54 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.9 OUTLIER -29.61 -33.65 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.74 179.745 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' S' ' 67' ' ' SER . 1.6 tpt180 -70.75 33.14 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 120.212 -0.595 . . . . 0.0 112.025 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.54 ' H ' ' C ' ' S' ' 68' ' ' GLN . 5.0 tt0 -81.24 -21.09 39.72 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.459 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 10.7 mt -83.07 140.82 32.45 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.156 -1.017 . . . . 0.0 111.13 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.58 126.93 27.43 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.249 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -99.2 -103.13 0.22 Allowed 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.83 0.824 . . . . 0.0 110.839 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -140.61 -56.97 0.52 Allowed 'General case' 0 C--N 1.283 -2.3 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.139 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 tp -121.01 13.37 11.32 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.25 -55.83 27.98 Favored Glycine 0 N--CA 1.492 2.416 0 C-N-CA 119.816 -1.183 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -163.71 -68.98 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.984 -1.087 . . . . 0.0 111.225 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . 149.38 131.18 1.93 Allowed Glycine 0 N--CA 1.488 2.134 0 C-N-CA 119.372 -1.394 . . . . 0.0 110.371 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.458 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.78 -36.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.237 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.91 -44.26 73.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.583 -0.847 . . . . 0.0 112.314 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 81' ' ' THR . . . . . 0.479 ' HG1' ' N ' ' S' ' 82' ' ' ILE . 25.3 p -62.54 -40.9 98.29 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . 0.479 ' N ' ' HG1' ' S' ' 81' ' ' THR . 23.0 pt -73.35 -15.07 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 119.344 -0.943 . . . . 0.0 112.758 -179.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.444 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -81.51 -57.21 3.57 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.492 -1.283 . . . . 0.0 111.391 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -68.68 -4.55 16.11 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.008 -1.077 . . . . 0.0 110.747 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.86 -25.55 60.0 Favored Glycine 0 N--CA 1.488 2.104 0 C-N-CA 119.321 -1.418 . . . . 0.0 110.124 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 86' ' ' SER . . . . . 0.424 ' C ' ' H ' ' S' ' 88' ' ' SER . 41.8 p -105.94 -34.91 7.46 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.657 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' S' ' 89' ' ' LEU . 24.3 m120 -77.0 12.99 1.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.909 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.424 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.6 OUTLIER -38.71 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.294 -179.949 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' S' ' 87' ' ' ASN . 1.0 OUTLIER -42.02 -66.37 0.36 Allowed 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.646 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.49 -62.09 1.78 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.687 -1.205 . . . . 0.0 111.669 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.35 -70.85 0.09 Allowed 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.168 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.64 148.54 90.19 Favored Pre-proline 0 N--CA 1.489 1.498 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.908 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -55.0 159.54 9.38 Favored 'Trans proline' 0 C--N 1.325 -0.667 0 C-N-CA 121.066 1.177 . . . . 0.0 110.996 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -83.24 -32.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.917 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -67.46 -20.95 65.55 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.648 -0.821 . . . . 0.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 1.2 tp -62.02 -36.35 81.29 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.576 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -16.29 38.75 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.256 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -101.49 -35.47 9.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.234 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 19.6 t90 -66.6 -62.29 1.53 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.911 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.529 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -57.07 -32.57 66.39 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -179.711 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.529 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.9 mm-40 -42.77 -29.65 0.33 Allowed 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 117.692 -1.603 . . . . 0.0 106.746 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.528 ' N ' ' C ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -94.99 -26.41 16.11 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.987 -1.915 . . . . 0.0 112.157 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . 0.471 ' N ' ' O ' ' S' ' 100' ' ' LEU . 14.0 t -83.28 -14.83 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 C-N-CA 115.964 -2.294 . . . . 0.0 108.102 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 19.9 tp -83.56 -53.48 5.64 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.203 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 86.4 mt -77.8 -80.03 0.11 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' S' ' 102' ' ' GLU . 16.2 mtpt -95.51 -160.05 0.76 Allowed 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.166 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' S' S ' 107' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' S' ' 102' ' ' GLU . 65.5 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 116.445 -1.74 . . . . 0.0 111.533 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.633 ' CD1' ' NE ' ' R' ' 84' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 116.255 -1.831 . . . . 0.0 110.296 . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . . . . . . . . . 1.1 m-90 . . . . . 0 N--CA 1.483 1.223 0 CA-C-O 116.351 -1.785 . . . . 0.0 110.033 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' R' R ' 5' ' ' SER . . . . . 0.568 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.0 OUTLIER -84.96 -43.44 0.68 Allowed Pre-proline 0 C--N 1.306 -1.316 0 C-N-CA 119.293 -0.963 . . . . 0.0 112.41 -179.934 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . 0.568 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.0 OUTLIER -70.26 117.3 5.04 Favored 'Trans proline' 0 C--N 1.32 -0.972 0 C-N-CA 121.027 1.151 . . . . 0.0 111.414 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.61 123.8 36.17 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.755 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 1.1 p -157.4 76.68 0.83 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.586 -0.846 . . . . 0.0 110.728 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.76 -168.97 2.34 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.882 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.94 143.37 32.22 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.988 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -114.18 165.92 12.16 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.423 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.91 139.62 34.54 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.967 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -132.17 13.29 4.68 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 119.964 -0.694 . . . . 0.0 110.405 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 51.84 91.5 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.433 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -84.11 95.0 8.47 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.152 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . 0.464 ' O ' ' CG ' ' R' ' 16' ' ' HIS . 22.1 t-80 -111.62 6.74 20.18 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.6 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' R' ' 18' ' ' GLU . 1.0 OUTLIER -91.05 -80.19 0.35 Allowed 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.358 -0.937 . . . . 0.0 111.36 -179.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.0 OUTLIER -44.33 -35.06 2.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 123.231 1.491 . . . . 0.0 107.824 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -52.69 -61.34 2.35 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 112.33 -2.214 . . . . 0.0 109.16 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -47.11 -44.4 21.37 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.459 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 1.0 OUTLIER -47.77 -73.1 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 118.645 -1.222 . . . . 0.0 109.639 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -25.45 -47.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.156 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . 0.435 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.5 t -71.14 -53.32 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 118.956 -1.097 . . . . 0.0 111.478 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 32.9 t0 -35.68 -65.19 0.26 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.647 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.11 -48.43 70.75 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.13 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.37 -46.44 62.76 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.545 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -61.6 -45.0 95.96 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 -74.73 -36.02 62.66 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -70.25 -29.26 66.02 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.622 -1.231 . . . . 0.0 113.077 -179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . 0.429 ' CD2' ' N ' ' R' ' 31' ' ' GLN . 23.7 t80 -42.01 -60.25 1.48 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.005 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . 0.429 ' N ' ' CD2' ' R' ' 30' ' ' TYR . 1.8 tt0 -60.43 -28.84 68.6 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.084 -1.046 . . . . 0.0 110.703 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . 0.436 ' OD1' ' NE1' ' S' ' 99' ' ' TRP . 0.2 OUTLIER -80.78 -15.86 55.32 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.534 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 74.15 23.98 2.02 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.949 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . 0.413 ' N ' HD21 ' R' ' 34' ' ' LEU . 0.7 OUTLIER -100.82 -10.52 20.65 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 114.724 -1.125 . . . . 0.0 108.712 179.917 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -53.77 -15.57 1.33 Allowed 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.225 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -77.75 -65.4 0.36 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 117.544 -1.663 . . . . 0.0 110.662 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.8 Cg_exo -50.19 -31.76 29.99 Favored 'Trans proline' 0 C--N 1.321 -0.889 0 N-CA-C 109.686 -0.929 . . . . 0.0 109.686 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 5.6 mt -73.39 -40.41 64.35 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.443 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.01 -22.5 62.68 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.205 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -91.53 11.48 23.98 Favored 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.513 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.19 -64.22 1.35 Allowed 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.933 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 42' ' ' MET . . . . . 0.489 ' SD ' ' O ' ' R' ' 22' ' ' PHE . 3.4 ptp -73.71 8.96 1.62 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 117.369 -1.732 . . . . 0.0 112.246 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 65.5 mt -128.77 -174.07 3.15 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.523 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.306 0.3 OUTLIER -134.97 -145.12 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 119.093 -1.043 . . . . 0.0 109.305 179.908 . . . . . . . . 4 4 . 1 . 006 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.523 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 10.2 Cg_endo -98.62 -43.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.554 0 CA-C-N 120.614 1.255 . . . . 0.0 111.16 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.53 -27.45 38.51 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.208 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -61.56 -49.8 75.19 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.983 179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.98 -34.72 66.01 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.927 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -75.56 -71.46 0.37 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.127 -1.029 . . . . 0.0 112.521 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.445 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.88 -46.49 51.7 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.304 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 tt -52.68 -45.09 66.65 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.776 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.74 -42.04 97.79 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 118.91 -1.614 . . . . 0.0 109.302 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.5 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.3 OUTLIER -49.55 -78.91 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.835 -0.682 . . . . 0.0 112.022 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.1 -37.06 0.8 Allowed 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.088 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 33.3 t -72.31 -34.24 48.55 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.593 -1.243 . . . . 0.0 110.227 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.1 OUTLIER -73.42 -38.31 65.6 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.553 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.511 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -77.19 -39.86 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 117.577 -1.649 . . . . 0.0 109.631 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.511 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 4.2 t -63.21 -68.76 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 117.438 -1.705 . . . . 0.0 109.325 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 16.7 tt0 -43.16 -36.27 1.65 Allowed 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.956 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -65.67 -54.32 29.07 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 118.971 -1.091 . . . . 0.0 112.109 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 34.7 mt -78.88 -6.31 55.8 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.439 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 5.1 tp -104.77 5.98 33.69 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 119.621 -0.831 . . . . 0.0 110.981 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -80.84 -72.5 0.42 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.416 -0.914 . . . . 0.0 111.196 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -125.92 -69.16 0.18 Allowed Glycine 0 N--CA 1.494 2.528 0 N-CA-C 110.093 -1.203 . . . . 0.0 110.093 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.525 ' O ' ' C ' ' R' ' 66' ' ' MET . 80.2 mt-10 -151.85 -74.09 0.15 Allowed 'General case' 0 C--N 1.301 -1.504 0 C-N-CA 119.592 -0.843 . . . . 0.0 110.469 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 66' ' ' MET . . . . . 0.525 ' C ' ' O ' ' R' ' 65' ' ' GLU . 20.2 mtp 7.35 97.23 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.142 0 O-C-N 124.732 1.27 . . . . 0.0 113.093 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 4.2 p -143.3 60.37 1.4 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.54 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.3 OUTLIER -126.67 -24.28 3.58 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -75.37 29.09 0.1 Allowed 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 119.974 -0.69 . . . . 0.0 111.147 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.54 ' H ' ' C ' ' R' ' 68' ' ' GLN . 12.6 mt-10 -86.16 19.27 2.73 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.436 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.39 140.64 53.32 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.389 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 3.4 tttm -106.05 88.29 2.77 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.997 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -79.33 -102.25 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.731 0.777 . . . . 0.0 112.121 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -136.6 -65.99 0.54 Allowed 'General case' 0 C--N 1.282 -2.333 0 CA-C-N 114.142 -1.39 . . . . 0.0 110.965 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . . . . . . . . . 2.2 mt -103.51 5.51 36.87 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.825 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -50.97 -51.97 32.62 Favored Glycine 0 N--CA 1.489 2.192 0 C-N-CA 119.556 -1.307 . . . . 0.0 110.408 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -166.94 -95.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.145 -1.022 . . . . 0.0 111.102 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.16 131.99 2.08 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 119.43 -1.367 . . . . 0.0 110.295 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.449 ' O ' ' OG1' ' R' ' 83' ' ' THR . 0.1 OUTLIER -45.34 -44.54 3.62 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.258 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.41 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -64.9 -62.95 1.25 Allowed 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 118.797 -1.161 . . . . 0.0 109.678 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 23.0 m -33.85 -49.23 0.32 Allowed 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.938 -1.028 . . . . 0.0 113.092 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 30.3 pt -73.73 -34.85 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 119.006 -1.078 . . . . 0.0 113.014 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.529 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.1 OUTLIER -55.55 -67.42 0.28 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.715 -1.194 . . . . 0.0 110.83 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -6.62 1.0 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.889 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . 0.443 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -70.5 -48.42 36.7 Favored Glycine 0 N--CA 1.489 2.184 0 C-N-CA 119.414 -1.375 . . . . 0.0 110.3 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.68 -7.53 54.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.718 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.2 OUTLIER -109.89 12.91 23.69 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.99 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -41.36 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.767 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . 0.468 ' N ' ' O ' ' R' ' 87' ' ' ASN . 4.2 mt -50.85 -33.82 25.42 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.737 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.39 -19.26 18.59 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.264 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.46 -62.81 1.42 Allowed 'General case' 0 C--N 1.291 -1.942 0 C-N-CA 118.976 -1.09 . . . . 0.0 112.31 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -99.95 164.98 15.42 Favored Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.305 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -58.83 171.87 1.86 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 C-N-CA 121.465 1.443 . . . . 0.0 111.611 179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 75.3 t -82.11 -8.91 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 119.386 -0.926 . . . . 0.0 110.787 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -65.37 -30.36 71.18 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.598 -0.841 . . . . 0.0 111.049 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.71 -44.09 97.02 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.718 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.53 -44.89 26.16 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.17 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -73.03 -24.22 60.7 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.348 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 3.6 t90 -92.04 -66.19 0.95 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.158 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.456 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.1 mm? -43.17 -28.07 0.27 Allowed 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 118.729 -1.188 . . . . 0.0 112.865 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.456 ' C ' ' O ' ' R' ' 100' ' ' LEU . 3.5 mt-10 -46.98 -38.81 11.31 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 117.491 -1.684 . . . . 0.0 106.823 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.48 ' O ' ' N ' ' R' ' 107' ' ' SER . 3.0 mt-10 -90.67 -30.9 16.85 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.908 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.5 t -85.88 -12.37 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 C-N-CA 117.331 -1.747 . . . . 0.0 111.224 -179.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 18.8 tp -96.98 -55.3 2.91 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.625 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . 0.456 ' CD2' ' N ' ' R' ' 105' ' ' LEU . 4.0 mm? -72.49 -74.55 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.923 -1.111 . . . . 0.0 111.32 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . 0.438 ' O ' ' O ' ' R' ' 107' ' ' SER . 11.0 ttpt -72.22 -77.51 0.1 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 119.513 -0.875 . . . . 0.0 110.955 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' R' R ' 107' ' ' SER . . . . . 0.48 ' N ' ' O ' ' R' ' 102' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 116.521 -1.704 . . . . 0.0 111.013 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.741 0.305 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.24 165.53 49.65 Favored Pre-proline 0 N--CA 1.486 1.358 0 C-N-CA 119.171 -1.011 . . . . 0.0 110.34 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -56.87 -14.49 14.09 Favored 'Trans proline' 0 C--N 1.317 -1.107 0 C-N-CA 121.195 1.263 . . . . 0.0 110.529 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -132.83 -172.14 2.84 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.787 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 8' ' ' SER . . . . . 0.468 ' O ' ' N ' ' S' ' 10' ' ' ALA . 23.3 t -161.17 42.7 0.16 Allowed 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.014 -1.075 . . . . 0.0 110.945 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.2 90.89 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.719 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . 0.468 ' N ' ' O ' ' S' ' 8' ' ' SER . . . -64.25 149.15 48.58 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.243 -0.983 . . . . 0.0 110.965 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 3.8 ptp -104.77 50.39 0.79 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.999 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.12 -37.74 88.43 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.775 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -120.62 158.11 28.08 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.528 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . 0.48 HE21 ' C ' ' S' ' 14' ' ' GLN . 0.0 OUTLIER -164.76 108.06 0.88 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.237 -0.985 . . . . 0.0 110.923 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.35 99.95 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.157 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . 0.412 ' H ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER -171.34 -4.07 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' S' ' 18' ' ' GLU . 8.7 tt0 -82.01 -86.01 0.1 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.051 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' S' ' 17' ' ' GLN . 1.0 OUTLIER -40.43 -34.83 0.37 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 122.648 1.213 . . . . 0.0 109.156 179.789 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -51.26 -60.91 2.61 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.041 -1.891 . . . . 0.0 110.457 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.32 -31.97 35.75 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.645 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.506 ' O ' ' C ' ' S' ' 22' ' ' PHE . 11.7 mmm-85 -59.68 -71.56 0.12 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.506 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.1 t80 -32.74 -50.47 0.26 Allowed 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 119.341 -0.944 . . . . 0.0 111.096 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.31 -44.81 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.427 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.419 ' O ' ' C ' ' S' ' 25' ' ' LEU . 25.7 t0 -48.14 -75.88 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.651 -0.82 . . . . 0.0 111.609 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . 0.419 ' C ' ' O ' ' S' ' 24' ' ' ASP . 1.2 mt -39.91 -44.78 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.756 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.41 -57.39 11.49 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.01 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.75 -49.86 0.8 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -85.59 -32.62 21.99 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 118.922 -1.111 . . . . 0.0 113.355 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -66.75 -39.85 88.08 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.072 -1.051 . . . . 0.0 112.541 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -58.21 -38.32 76.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.93 -1.108 . . . . 0.0 112.028 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.0 -21.79 4.89 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 118.712 -1.195 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.46 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 35.3 m120 -111.57 -76.27 0.6 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.829 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.0 OUTLIER 172.06 1.28 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 118.644 -1.222 . . . . 0.0 113.02 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . 0.64 ' CD2' ' H ' ' S' ' 34' ' ' LEU . 0.9 OUTLIER -75.01 -18.51 60.35 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.609 -0.836 . . . . 0.0 111.558 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -51.12 -22.68 2.63 Favored 'General case' 0 C--N 1.293 -1.866 0 C-N-CA 119.494 -0.882 . . . . 0.0 112.746 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.467 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.4 mt -73.35 -64.03 0.89 Allowed Pre-proline 0 N--CA 1.486 1.338 0 C-N-CA 118.327 -1.349 . . . . 0.0 110.234 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.467 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -53.45 -32.73 64.09 Favored 'Trans proline' 0 C--N 1.322 -0.864 0 C-N-CA 120.769 0.979 . . . . 0.0 110.455 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 21.8 mt -74.12 -39.7 63.17 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.19 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . 0.508 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -52.97 -44.2 66.98 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.332 179.802 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.1 OUTLIER -66.94 -0.92 3.44 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.536 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 tp -105.32 -67.36 0.92 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.623 -0.831 . . . . 0.0 112.964 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 42' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 2.0 mmm -91.04 47.6 1.42 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 118.761 -1.175 . . . . 0.0 111.624 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . 0.508 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.3 OUTLIER 160.72 125.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.532 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -179.33 -41.86 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.376 0 C-N-CA 116.507 -2.077 . . . . 0.0 115.794 -179.694 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.532 ' HD2' ' H ' ' S' ' 44' ' ' THR . 5.5 Cg_endo -65.71 -110.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 120.713 0.942 . . . . 0.0 113.343 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . 0.404 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 0.2 OUTLIER -54.91 -12.14 0.76 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 119.029 -1.068 . . . . 0.0 110.361 -179.735 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . 0.429 ' H ' ' C ' ' S' ' 45' ' ' PRO . 6.4 mm-40 -68.17 -64.39 0.87 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.607 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -57.82 -33.45 68.62 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.255 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -70.41 -63.12 1.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.21 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.09 -37.52 83.01 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.336 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 mt -46.74 -57.57 4.72 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 118.64 -1.224 . . . . 0.0 109.293 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' S' ' 53' ' ' THR . . . -52.2 -64.96 3.57 Favored Glycine 0 N--CA 1.484 1.852 0 N-CA-C 108.486 -1.846 . . . . 0.0 108.486 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.404 ' C ' ' O ' ' S' ' 52' ' ' GLY . 0.2 OUTLIER -34.85 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.641 0.734 . . . . 0.0 112.78 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.486 ' CG ' ' CZ3' ' R' ' 109' ' ' TRP . 8.1 ttp85 -51.57 -46.11 63.31 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.376 -1.284 . . . . 0.0 113.393 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 95.1 t -68.95 -19.08 23.61 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 C-N-CA 117.473 -1.691 . . . . 0.0 109.918 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.411 ' CD ' ' C ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -85.62 -37.06 19.93 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.542 -1.263 . . . . 0.0 110.804 -179.958 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . 0.428 HD11 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -74.54 -38.38 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 117.429 -1.708 . . . . 0.0 107.902 179.942 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . 0.428 ' N ' HD11 ' S' ' 57' ' ' ILE . 0.9 OUTLIER -60.43 -50.95 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 117.156 -1.817 . . . . 0.0 107.399 179.452 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -51.7 -31.88 27.82 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.092 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . 0.428 ' C ' ' H ' ' S' ' 62' ' ' LEU . 24.0 mm-40 -68.99 -57.58 5.28 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 118.98 -1.088 . . . . 0.0 112.178 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . 0.542 ' C ' ' H ' ' S' ' 63' ' ' ARG . 3.6 pp -61.43 -7.47 3.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.912 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . 0.611 ' O ' ' N ' ' S' ' 64' ' ' GLY . 7.0 tp -76.13 28.88 0.12 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 119.494 -0.882 . . . . 0.0 110.586 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . 0.542 ' H ' ' C ' ' S' ' 61' ' ' LEU . 3.9 mtm180 19.37 40.03 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.075 0 O-C-N 124.361 1.038 . . . . 0.0 113.625 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.611 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -108.43 -38.37 1.95 Allowed Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.895 -1.145 . . . . 0.0 110.262 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -112.02 -91.73 0.48 Allowed 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.176 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 5.0 tpp -108.66 -145.99 0.4 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.869 -0.733 . . . . 0.0 111.526 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 67' ' ' SER . . . . . 0.572 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.1 OUTLIER 176.28 -68.08 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.094 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.576 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.0 OUTLIER -24.61 -36.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 124.213 0.945 . . . . 0.0 113.516 179.764 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . 0.572 ' N ' ' O ' ' S' ' 67' ' ' SER . 0.0 OUTLIER -69.32 31.53 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 120.158 -0.617 . . . . 0.0 112.221 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.576 ' H ' ' C ' ' S' ' 68' ' ' GLN . 0.9 OUTLIER -98.65 21.69 10.98 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.937 179.949 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 30.9 mt -87.92 -178.65 6.06 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.684 -0.807 . . . . 0.0 110.949 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.5 tttm -116.83 80.34 1.46 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.869 -0.732 . . . . 0.0 110.913 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -81.2 -102.93 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.76 0.79 . . . . 0.0 110.7 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -141.87 -65.63 0.42 Allowed 'General case' 0 C--N 1.279 -2.482 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.505 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 mp -82.42 5.96 18.76 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.684 -0.807 . . . . 0.0 109.162 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -68.87 -56.13 9.85 Favored Glycine 0 N--CA 1.488 2.106 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.196 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . 175.54 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.004 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 175.79 167.89 35.36 Favored Glycine 0 N--CA 1.493 2.443 0 C-N-CA 119.363 -1.399 . . . . 0.0 110.823 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.425 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.1 OUTLIER -62.77 -43.52 98.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.234 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -58.25 -53.83 53.82 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.234 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -43.14 -60.49 1.64 Allowed 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.786 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 15.8 pt -68.46 10.47 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -179.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -106.7 -45.42 4.22 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.982 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -32.79 62.82 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.785 -1.166 . . . . 0.0 111.489 -179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.27 -45.59 90.41 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 119.242 -1.456 . . . . 0.0 110.23 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.45 -29.48 69.62 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.169 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . 0.523 ' O ' ' N ' ' S' ' 89' ' ' LEU . 1.2 m-20 -100.8 15.91 26.83 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.6 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.406 ' C ' ' O ' ' S' ' 87' ' ' ASN . 0.5 OUTLIER -37.85 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 120.249 -0.581 . . . . 0.0 112.004 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . 0.523 ' N ' ' O ' ' S' ' 87' ' ' ASN . 11.8 mt -57.38 -54.65 44.42 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.392 -0.923 . . . . 0.0 111.298 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -94.83 -35.27 12.14 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.689 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.01 -49.12 72.31 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.602 -1.181 . . . . 0.0 112.498 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -86.53 163.74 40.54 Favored Pre-proline 0 N--CA 1.489 1.516 0 C-N-CA 119.164 -1.014 . . . . 0.0 111.598 -179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -53.67 175.96 0.1 Allowed 'Trans proline' 0 C--N 1.324 -0.732 0 C-N-CA 121.546 1.497 . . . . 0.0 111.429 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -108.55 -33.67 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.291 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.65 3.29 29.5 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.186 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -31.25 24.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.798 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.8 -23.05 67.21 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.014 -1.074 . . . . 0.0 110.259 179.947 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -78.07 -14.34 59.53 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.033 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . 0.436 ' NE1' ' OD1' ' R' ' 32' ' ' ASN . 21.4 t90 -107.36 -59.09 1.87 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.019 0.914 . . . . 0.0 111.513 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.524 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.7 OUTLIER -58.61 -34.04 70.69 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.517 ' C ' ' O ' ' S' ' 100' ' ' LEU . 5.0 mt-10 -43.3 -32.2 0.76 Allowed 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 117.29 -1.764 . . . . 0.0 106.571 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.524 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.7 mt-10 -89.97 -23.78 21.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 112.637 -2.074 . . . . 0.0 112.437 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . 0.503 ' N ' ' O ' ' S' ' 100' ' ' LEU . 21.9 t -88.17 -22.73 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 C-N-CA 116.255 -2.178 . . . . 0.0 109.975 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 21.6 tp -81.29 -55.23 4.86 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.032 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mt -57.87 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 118.325 -1.35 . . . . 0.0 110.274 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' S' ' 102' ' ' GLU . 0.4 OUTLIER -112.07 -177.83 3.27 Favored 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.512 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 116.417 -1.754 . . . . 0.0 110.838 179.955 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.456 ' N ' ' OD1' ' S' ' 40' ' ' ASN . 1.1 t-105 . . . . . 0 N--CA 1.484 1.258 0 CA-C-O 116.352 -1.785 . . . . 0.0 109.96 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.486 ' CZ3' ' CG ' ' S' ' 54' ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 116.37 -1.776 . . . . 0.0 110.012 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 121.001 0.429 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' R' R ' 5' ' ' SER . . . . . 0.534 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.0 OUTLIER -84.73 -45.48 0.69 Allowed Pre-proline 0 C--N 1.305 -1.355 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.83 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.2 Cg_endo -70.18 149.43 64.17 Favored 'Trans proline' 0 C--N 1.321 -0.898 0 C-N-CA 120.969 1.112 . . . . 0.0 110.929 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -89.74 176.76 6.72 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.115 -1.034 . . . . 0.0 110.388 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.1 131.0 20.36 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.48 -0.888 . . . . 0.0 110.597 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.52 165.1 13.19 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.084 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -88.89 117.33 27.81 Favored 'General case' 0 C--N 1.305 -1.335 0 C-N-CA 119.516 -0.874 . . . . 0.0 110.65 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 6.9 mtp -64.79 -160.22 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.161 -1.016 . . . . 0.0 110.175 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.75 -178.83 4.01 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.863 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . 0.429 ' O ' ' O ' ' R' ' 14' ' ' GLN . 3.2 tt0 -167.69 -5.77 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.469 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . 0.429 ' O ' ' O ' ' R' ' 13' ' ' GLU . 31.8 mt-30 45.77 94.86 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.468 -0.893 . . . . 0.0 110.738 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -82.06 157.78 24.0 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.371 -0.932 . . . . 0.0 111.056 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -71.13 63.29 0.33 Allowed 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.057 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.51 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.2 mt-30 -115.12 -76.86 0.57 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -55.4 -17.93 5.88 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 123.55 1.643 . . . . 0.0 106.666 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . 0.51 ' N ' ' C ' ' R' ' 17' ' ' GLN . 63.0 t-105 -57.22 -61.67 2.3 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 111.421 -2.627 . . . . 0.0 109.666 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tp -50.04 -38.4 37.71 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.558 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.553 ' O ' ' N ' ' R' ' 24' ' ' ASP . 11.7 mtt-85 -54.28 -69.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.273 -1.371 . . . . 0.0 110.121 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.489 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.1 OUTLIER -35.39 -43.1 0.23 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 119.046 -1.061 . . . . 0.0 110.705 179.616 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 85.2 t -68.58 -38.44 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.437 -0.905 . . . . 0.0 110.093 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' R' ' 21' ' ' ARG . 27.6 t70 -48.55 -75.57 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.096 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -44.6 -45.21 9.39 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.857 179.877 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.4 tt -42.39 -58.17 2.32 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.472 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . 0.536 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.5 OUTLIER -69.49 -61.66 1.7 Allowed 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.763 -0.775 . . . . 0.0 112.319 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -46.11 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . 0.536 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -114.16 -29.19 7.04 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 119.302 -0.959 . . . . 0.0 113.127 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -48.54 -41.6 30.85 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 118.875 -1.13 . . . . 0.0 111.31 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.29 -22.54 66.3 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.113 -1.035 . . . . 0.0 111.495 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . 0.529 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 22.1 t-20 -102.16 -10.98 19.15 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.83 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . 0.529 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 81.66 13.2 0.63 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 121.643 0.735 . . . . 0.0 110.195 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -86.91 -15.76 37.99 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.267 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . 0.416 ' HD1' ' N ' ' R' ' 35' ' ' HIS . 4.5 p-80 -52.25 -30.45 27.69 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 113.881 -1.508 . . . . 0.0 113.439 179.984 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.465 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 3.3 mt -66.64 -63.46 2.96 Favored Pre-proline 0 C--N 1.304 -1.401 0 C-N-CA 117.92 -1.512 . . . . 0.0 110.557 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.471 ' O ' ' ND2' ' R' ' 40' ' ' ASN . 3.5 Cg_exo -52.75 -27.79 35.44 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 C-N-CA 120.536 0.824 . . . . 0.0 110.556 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . 0.405 ' O ' ' SD ' ' R' ' 42' ' ' MET . 15.1 mt -84.49 -36.43 22.26 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.778 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . 0.481 ' C ' ' H ' ' R' ' 41' ' ' LEU . 0.0 OUTLIER -51.47 -57.45 9.0 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.761 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' R' ' 37' ' ' PRO . 0.1 OUTLIER -64.13 2.51 0.55 Allowed 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.049 -1.06 . . . . 0.0 111.113 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' R' ' 39' ' ' LEU . 3.7 tp -93.32 -64.11 1.13 Allowed 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.509 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 42' ' ' MET . . . . . 0.405 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.0 OUTLIER -79.53 12.57 2.43 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 117.431 -1.708 . . . . 0.0 109.406 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . 0.441 ' H ' ' C ' ' R' ' 41' ' ' LEU . 19.6 mt -132.34 169.96 15.76 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.457 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.29 0.2 OUTLIER -132.24 -135.52 0.0 OUTLIER Pre-proline 0 CA--C 1.57 1.735 0 CA-C-O 116.957 -1.497 . . . . 0.0 109.725 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 18.8 Cg_endo -100.45 -49.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.483 0.874 0 CA-C-N 123.127 2.152 . . . . 0.0 112.051 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.43 -22.05 4.32 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.549 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.31 -52.8 11.19 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.89 -13.14 21.97 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.318 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -88.42 -65.09 1.05 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.144 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.448 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -61.63 -44.18 97.47 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.077 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.45 -60.63 2.39 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.665 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -44.76 42.1 Favored Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.297 -1.43 . . . . 0.0 109.973 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.496 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.2 OUTLIER -48.21 -79.93 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.092 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -39.91 -37.77 0.61 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.199 -179.818 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 93.5 t -72.64 -35.27 50.06 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.726 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.9 OUTLIER -77.21 -39.45 48.64 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.151 -1.02 . . . . 0.0 111.821 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.458 HD11 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -73.38 -36.14 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 117.713 -1.595 . . . . 0.0 108.383 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.458 ' N ' HD11 ' R' ' 57' ' ' ILE . 3.1 t -56.28 -65.24 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 C-N-CA 118.07 -1.452 . . . . 0.0 109.39 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 63.3 mt-10 -47.61 -44.55 26.76 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.88 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -46.15 -44.36 15.78 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.874 -0.731 . . . . 0.0 111.758 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 9.8 mt -99.15 -0.1 42.31 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.291 -0.964 . . . . 0.0 111.668 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.6 tp -96.98 13.13 30.0 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 119.194 -1.002 . . . . 0.0 111.448 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -85.22 -82.22 0.18 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.065 -1.054 . . . . 0.0 110.473 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -126.35 -65.14 0.16 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.023 -1.631 . . . . 0.0 109.023 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.459 ' CG ' ' H ' ' R' ' 66' ' ' MET . 0.3 OUTLIER -142.88 -89.64 0.13 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.245 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 66' ' ' MET . . . . . 0.459 ' H ' ' CG ' ' R' ' 65' ' ' GLU . 0.0 OUTLIER 29.51 94.61 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.354 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 26.8 m -147.85 58.98 1.12 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.219 -0.993 . . . . 0.0 111.07 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.437 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.0 OUTLIER -135.04 -34.29 0.88 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 119.96 -0.696 . . . . 0.0 110.67 -179.96 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.62 33.81 0.21 Allowed 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.657 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.437 ' H ' ' C ' ' R' ' 68' ' ' GLN . 12.9 pt-20 -106.48 26.11 10.3 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.85 -0.74 . . . . 0.0 112.011 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 7.9 mt -74.89 143.74 43.67 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 118.675 -1.21 . . . . 0.0 110.547 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 35.9 tttm -67.28 119.21 11.77 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.734 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -96.49 -102.89 0.17 Allowed 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 121.759 0.79 . . . . 0.0 110.387 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -147.02 -59.32 0.28 Allowed 'General case' 0 C--N 1.278 -2.508 0 CA-C-N 114.214 -1.357 . . . . 0.0 109.405 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -100.81 -8.35 22.74 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.743 179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -43.14 -65.03 1.55 Allowed Glycine 0 N--CA 1.488 2.142 0 C-N-CA 119.705 -1.236 . . . . 0.0 110.836 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -168.1 -96.35 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.118 -1.033 . . . . 0.0 111.248 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -161.73 155.27 26.46 Favored Glycine 0 N--CA 1.493 2.446 0 C-N-CA 119.48 -1.343 . . . . 0.0 110.279 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.447 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.1 OUTLIER -54.77 -49.5 68.36 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.785 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.464 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -61.14 -56.51 20.02 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.036 -1.066 . . . . 0.0 111.217 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 81' ' ' THR . . . . . 0.453 ' H ' ' HG1' ' R' ' 81' ' ' THR . 4.0 m -38.87 -54.42 1.63 Allowed 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 9.4 pt -64.72 -20.65 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.551 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -75.32 -73.28 0.26 Allowed 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 118.389 -1.324 . . . . 0.0 111.677 -179.915 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -6.24 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.545 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . 0.551 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -69.25 -46.03 58.97 Favored Glycine 0 N--CA 1.49 2.287 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.741 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 86' ' ' SER . . . . . 0.527 ' C ' ' H ' ' R' ' 88' ' ' SER . 33.8 t -102.77 -42.14 5.97 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.438 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -67.5 9.42 0.25 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.606 -0.837 . . . . 0.0 111.234 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 88' ' ' SER . . . . . 0.527 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.4 OUTLIER -74.22 -22.91 59.15 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.031 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' R' ' 88' ' ' SER . 3.8 mt -37.29 -25.31 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.996 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . 0.527 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -108.71 -56.66 2.24 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.318 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.84 -6.21 2.57 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.663 -1.153 . . . . 0.0 112.585 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 138.68 97.48 Favored Pre-proline 0 N--CA 1.489 1.505 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.567 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -63.01 128.28 22.56 Favored 'Trans proline' 0 C--O 1.214 -0.705 0 C-N-CA 121.016 1.144 . . . . 0.0 111.582 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . 0.4 ' O ' ' CG1' ' R' ' 94' ' ' VAL . 82.7 t -67.68 -5.5 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.487 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -91.93 7.62 41.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.723 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.1 tp -104.35 -41.93 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.163 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.7 -47.2 67.41 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.286 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -60.04 -17.37 38.57 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.674 -0.81 . . . . 0.0 112.567 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 3.9 t90 -113.66 -65.26 1.2 Allowed 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.489 -179.823 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.494 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.3 mm? -39.89 -38.56 0.7 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.494 ' C ' ' O ' ' R' ' 100' ' ' LEU . 11.2 mt-10 -43.79 -33.94 1.43 Allowed 'General case' 0 C--N 1.291 -1.966 0 C-N-CA 117.738 -1.585 . . . . 0.0 107.825 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.441 ' N ' ' C ' ' R' ' 100' ' ' LEU . 6.4 mt-10 -91.75 -31.85 15.62 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.939 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 3.2 t -82.44 -10.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 117.288 -1.765 . . . . 0.0 110.287 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 34.0 tp -92.95 -50.44 5.55 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.631 179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . 0.502 ' C ' ' H ' ' R' ' 107' ' ' SER . 1.0 OUTLIER -52.5 -66.44 0.38 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 119.16 -1.016 . . . . 0.0 110.252 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -49.41 -11.35 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.681 -0.807 . . . . 0.0 111.179 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 107' ' ' SER . . . . . 0.502 ' H ' ' C ' ' R' ' 105' ' ' LEU . 10.4 m . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 116.324 -1.798 . . . . 0.0 110.788 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.776 0.322 . . . . 0.0 110.294 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.98 160.71 42.56 Favored Pre-proline 0 N--CA 1.487 1.415 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.181 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -55.5 -33.35 85.98 Favored 'Trans proline' 0 C--N 1.318 -1.054 0 C-N-CA 121.311 1.341 . . . . 0.0 111.444 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.44 138.3 57.46 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.17 -1.012 . . . . 0.0 110.537 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 47.3 p -81.28 -179.37 7.33 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.255 -0.978 . . . . 0.0 110.502 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -164.65 -31.53 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.881 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.28 -176.51 3.98 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.812 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -126.19 121.34 32.5 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.614 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.0 40.87 0.97 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.362 -0.935 . . . . 0.0 110.907 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -138.77 131.59 29.31 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.859 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . 0.427 ' N ' ' NE2' ' S' ' 14' ' ' GLN . 2.7 mp0 -85.26 177.79 7.72 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.375 -0.93 . . . . 0.0 111.175 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . 0.515 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.2 OUTLIER -87.25 18.21 3.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.847 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -66.11 7.73 0.27 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.757 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.515 ' H ' ' C ' ' S' ' 15' ' ' ARG . 1.2 mp0 -92.65 -85.51 0.26 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.76 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.6 mt-10 -42.93 -29.93 0.37 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 122.966 1.365 . . . . 0.0 108.276 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . 0.466 ' N ' ' C ' ' S' ' 17' ' ' GLN . 22.8 t-105 -56.45 -54.43 45.73 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 112.729 -2.032 . . . . 0.0 107.927 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . 0.495 ' N ' ' O ' ' S' ' 17' ' ' GLN . 0.5 OUTLIER -57.64 -36.55 72.0 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 113.573 -1.648 . . . . 0.0 111.455 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -54.82 -74.41 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 118.595 -1.242 . . . . 0.0 110.027 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.547 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.7 OUTLIER -27.13 -48.26 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 119.234 -0.986 . . . . 0.0 111.472 179.626 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' S' ' 21' ' ' ARG . 62.2 t -66.82 -49.75 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.439 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' S' ' 21' ' ' ARG . 15.6 t70 -41.07 -56.25 2.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.583 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . 0.405 ' CD2' ' N ' ' S' ' 25' ' ' LEU . 0.2 OUTLIER -60.61 -45.32 94.45 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.272 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -48.31 -43.71 33.27 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.389 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.05 -41.04 33.73 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.84 -9.86 18.67 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 119.305 -0.958 . . . . 0.0 113.329 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -46.69 15.02 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.774 -1.171 . . . . 0.0 112.096 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . 0.408 ' C ' ' N ' ' S' ' 32' ' ' ASN . 17.7 t80 -49.93 -46.34 51.98 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.687 -0.805 . . . . 0.0 112.015 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -47.4 -19.68 0.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.138 -1.025 . . . . 0.0 111.212 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.494 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 79.4 m-20 -110.67 -68.58 0.92 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.213 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.556 ' C ' ' HD1' ' S' ' 35' ' ' HIS . 0.1 OUTLIER 160.17 -13.42 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.53 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . 0.435 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 1.4 mm? -54.94 -17.81 4.19 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.941 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . 0.556 ' HD1' ' C ' ' S' ' 33' ' ' ASP . 19.4 p-80 -50.17 -21.12 1.19 Allowed 'General case' 0 C--N 1.292 -1.904 0 C-N-CA 119.486 -0.886 . . . . 0.0 112.338 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.459 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -77.94 -64.1 0.42 Allowed Pre-proline 0 N--CA 1.484 1.239 0 C-N-CA 118.481 -1.288 . . . . 0.0 111.173 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -51.4 -42.31 55.52 Favored 'Trans proline' 0 C--N 1.319 -0.993 0 C-N-CA 120.526 0.817 . . . . 0.0 110.495 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.98 -54.6 44.82 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.589 -0.844 . . . . 0.0 110.416 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . 0.457 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.4 OUTLIER -46.22 -53.21 11.0 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.816 179.864 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -52.36 -10.67 0.15 Allowed 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -107.14 -60.37 1.69 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.726 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 42' ' ' MET . . . . . 0.54 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -89.62 28.51 1.29 Allowed 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.462 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . 0.469 ' C ' ' CD2' ' S' ' 43' ' ' LEU . 5.3 tt -178.13 127.95 0.13 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.468 ' N ' ' CD ' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -178.98 -42.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.484 0 C-N-CA 116.514 -2.074 . . . . 0.0 116.276 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.499 ' C ' ' N ' ' S' ' 47' ' ' GLU . 19.1 Cg_endo -78.72 -107.17 0.01 OUTLIER 'Trans proline' 0 CA--C 1.553 1.464 0 C-N-CA 121.251 1.301 . . . . 0.0 114.12 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -47.52 -16.85 0.07 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.118 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' S' ' 49' ' ' GLU . 22.0 mm-40 -69.42 -76.9 0.09 Allowed 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.149 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' S' ' 47' ' ' GLU . 11.0 ttp85 -38.32 -27.13 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.245 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' S' ' 47' ' ' GLU . 3.3 tt0 -77.47 -62.32 1.7 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 118.239 -1.385 . . . . 0.0 110.821 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . 0.463 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -59.47 -35.64 74.47 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.774 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 95.2 mt -55.41 -72.48 0.07 Allowed 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.419 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.78 -40.32 5.23 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.456 -1.354 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.473 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -50.79 -80.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.616 -0.833 . . . . 0.0 112.496 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.551 HH21 ' CB ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -39.42 -35.34 0.27 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.401 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.3 t -74.66 -31.0 25.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 C-N-CA 118.452 -1.299 . . . . 0.0 111.013 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.473 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.5 -36.89 32.67 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.818 -1.153 . . . . 0.0 111.421 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . 0.406 ' CD1' ' C ' ' S' ' 57' ' ' ILE . 0.0 OUTLIER -72.91 -40.11 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 118.078 -1.449 . . . . 0.0 108.604 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . 0.551 ' CB ' HH21 ' S' ' 54' ' ' ARG . 19.3 t -59.46 -59.25 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 C-N-CA 117.463 -1.695 . . . . 0.0 108.837 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.1 -23.52 5.48 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.544 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.04 -58.09 5.07 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.631 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . 0.614 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -64.85 -9.96 24.75 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 118.564 -1.254 . . . . 0.0 110.737 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . 0.612 ' O ' ' N ' ' S' ' 64' ' ' GLY . 12.6 tp -72.65 28.62 0.06 Allowed 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 119.552 -0.859 . . . . 0.0 109.814 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . 0.614 ' H ' ' C ' ' S' ' 61' ' ' LEU . 47.7 mtt-85 21.07 38.18 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.612 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -97.53 -31.17 6.89 Favored Glycine 0 N--CA 1.493 2.479 0 C-N-CA 119.695 -1.241 . . . . 0.0 110.567 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -142.17 -86.21 0.16 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.491 -0.883 . . . . 0.0 111.104 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 42.9 mtt -82.54 166.72 19.03 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.166 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 67' ' ' SER . . . . . 0.562 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.1 OUTLIER -165.32 -78.75 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.588 -0.845 . . . . 0.0 109.163 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.542 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.5 OUTLIER -38.67 -22.24 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.662 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . 0.562 ' N ' ' O ' ' S' ' 67' ' ' SER . 0.4 OUTLIER -65.79 31.7 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.945 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.542 ' H ' ' C ' ' S' ' 68' ' ' GLN . 26.6 mt-10 -99.25 13.91 31.38 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.705 -0.798 . . . . 0.0 110.788 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 mt -61.71 148.35 43.06 Favored 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.049 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -97.96 85.96 3.63 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 119.852 -0.739 . . . . 0.0 110.758 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -92.01 -103.4 0.11 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.305 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -140.95 -56.65 0.5 Allowed 'General case' 0 C--N 1.279 -2.491 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.884 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.11 5.21 40.29 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.4 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.92 -58.61 12.86 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 119.551 -1.309 . . . . 0.0 110.907 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.85 -82.02 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.126 -1.03 . . . . 0.0 111.003 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 157.23 132.3 1.44 Allowed Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.249 -1.453 . . . . 0.0 110.664 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.472 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -42.26 -45.6 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.127 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.45 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -62.83 -57.33 11.25 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.167 -1.013 . . . . 0.0 111.622 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 23.6 m -47.24 -47.42 24.7 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.764 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 22.1 pt -75.14 -0.61 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.662 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -90.6 -60.84 1.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 118.583 -1.247 . . . . 0.0 111.699 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -13.27 34.64 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.251 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.53 -48.57 83.95 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.373 -1.394 . . . . 0.0 110.699 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -88.46 -25.26 22.71 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.161 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -94.54 8.75 41.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.757 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.07 -28.13 16.38 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.753 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 9.4 mp -42.42 -64.3 0.63 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.864 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' S' ' 91' ' ' ALA . 0.0 OUTLIER -95.77 -51.44 4.49 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.778 -179.869 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . 0.44 ' C ' ' O ' ' S' ' 90' ' ' LYS . . . -34.26 -51.87 0.46 Allowed 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.889 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -82.83 162.71 54.31 Favored Pre-proline 0 C--N 1.303 -1.432 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.464 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 4.4 Cg_exo -56.39 144.67 82.28 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 121.475 1.45 . . . . 0.0 111.222 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . 0.447 ' C ' ' H ' ' S' ' 96' ' ' LEU . 6.0 t -85.15 -6.82 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 119.286 -0.965 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.22 4.48 1.64 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.655 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . 0.447 ' H ' ' C ' ' S' ' 94' ' ' VAL . 8.0 mp -97.02 -19.16 18.94 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.498 -0.881 . . . . 0.0 111.011 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . 0.438 ' N ' ' CD ' ' S' ' 97' ' ' ARG . 3.5 mpt_? -64.2 -42.75 96.51 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.438 -0.905 . . . . 0.0 111.003 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -86.51 -1.78 57.9 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 10.7 t90 -115.63 -66.14 1.12 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.831 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.573 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.6 OUTLIER -52.67 -38.06 59.83 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.514 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.3 mm-40 -41.95 -26.95 0.1 Allowed 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 117.573 -1.651 . . . . 0.0 107.285 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.573 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -95.57 -25.61 16.1 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 113.462 -1.699 . . . . 0.0 112.127 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . 0.517 ' N ' ' O ' ' S' ' 100' ' ' LEU . 8.2 t -84.22 -20.32 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 116.148 -2.221 . . . . 0.0 108.119 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 19.3 tp -81.43 -57.4 3.49 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.857 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 1.1 mt -49.06 -61.89 1.83 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 118.672 -1.211 . . . . 0.0 109.446 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -74.24 170.21 16.02 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.683 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' S' S ' 107' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' S' ' 107' ' ' SER . 29.5 t . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 116.247 -1.835 . . . . 0.0 110.703 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.234 0 CA-C-O 116.391 -1.766 . . . . 0.0 110.523 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.417 ' CZ3' ' CG ' ' S' ' 54' ' ' ARG . 1.1 m-90 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 116.386 -1.769 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.931 0.396 . . . . 0.0 110.039 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' R' R ' 5' ' ' SER . . . . . 0.539 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.3 OUTLIER -63.97 -44.78 79.51 Favored Pre-proline 0 C--N 1.306 -1.292 0 C-N-CA 119.515 -0.874 . . . . 0.0 112.473 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' R' ' 5' ' ' SER . 4.4 Cg_exo -66.12 139.96 57.74 Favored 'Trans proline' 0 C--N 1.322 -0.846 0 C-N-CA 120.952 1.102 . . . . 0.0 111.601 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -115.91 179.31 4.02 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.89 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 83.2 p -65.77 130.08 42.01 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.69 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -87.84 -134.92 0.09 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.092 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.56 102.01 9.5 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.635 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 1.6 ttm -86.91 159.46 19.03 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.372 -0.931 . . . . 0.0 111.14 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.64 108.38 0.13 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 119.223 -0.991 . . . . 0.0 110.509 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . 0.434 ' O ' ' CG ' ' R' ' 13' ' ' GLU . 1.2 pt-20 -112.79 69.37 0.69 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.161 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . 0.42 ' O ' ' O ' ' R' ' 13' ' ' GLU . 1.2 mt-30 45.02 91.14 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.971 -1.092 . . . . 0.0 110.136 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . 0.538 ' C ' ' H ' ' R' ' 17' ' ' GLN . 4.5 mmt85 -101.09 -176.47 3.17 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.577 -0.849 . . . . 0.0 112.326 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . 0.633 ' CD2' ' CD1' ' R' ' 19' ' ' TRP . 10.1 t-80 -69.17 24.81 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.151 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.538 ' H ' ' C ' ' R' ' 15' ' ' ARG . 4.3 mt-30 -85.59 -98.47 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.488 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . 0.496 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.7 mt-10 -32.0 -37.08 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-O 123.259 1.504 . . . . 0.0 108.989 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . 0.633 ' CD1' ' CD2' ' R' ' 16' ' ' HIS . 57.3 t-105 -50.09 -57.96 6.54 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 112.553 -2.112 . . . . 0.0 109.604 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' R' ' 17' ' ' GLN . 7.9 tp -54.64 -46.01 73.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.014 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -45.39 -68.4 0.2 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.456 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.448 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.1 OUTLIER -36.8 -38.81 0.19 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.82 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 97.3 t -73.5 -50.06 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.741 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -41.5 -64.65 0.53 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.877 -0.729 . . . . 0.0 111.24 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . 0.401 ' O ' ' C ' ' R' ' 26' ' ' LEU . 0.8 OUTLIER -54.4 -48.42 71.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.9 -0.72 . . . . 0.0 110.979 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' R' ' 25' ' ' LEU . 1.1 tt -35.31 -62.42 0.39 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.535 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.6 OUTLIER -57.5 -68.03 0.27 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.059 -1.056 . . . . 0.0 112.02 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -44.57 -17.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . 0.441 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -95.93 -31.27 13.18 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.521 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . 0.515 ' CE1' ' NZ ' ' S' ' 27' ' ' LYS . 15.1 t80 -55.86 -40.33 72.74 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.716 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -71.1 -21.97 62.15 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.805 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . 0.527 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 26.5 m120 -100.07 -16.1 17.99 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . 0.527 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 5.3 t70 83.73 23.56 0.13 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 123.671 0.607 . . . . 0.0 110.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -98.58 -14.79 19.76 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.769 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . 0.481 ' HD1' ' N ' ' R' ' 35' ' ' HIS . 1.9 p-80 -48.11 -35.12 10.84 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.294 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.446 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.0 mt -64.82 -63.07 3.99 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 118.024 -1.47 . . . . 0.0 111.697 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.446 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -48.63 -35.03 28.59 Favored 'Trans proline' 0 C--N 1.315 -1.219 0 C-N-CA 120.917 1.078 . . . . 0.0 111.894 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 72.8 mt -76.81 -40.65 47.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.637 -0.825 . . . . 0.0 110.246 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.81 -22.17 34.32 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.681 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -89.44 6.64 39.86 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.176 -1.009 . . . . 0.0 111.117 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . 0.512 ' C ' ' H ' ' R' ' 43' ' ' LEU . 67.3 mt -114.54 -60.88 1.83 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.227 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 42' ' ' MET . . . . . 0.403 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -71.12 16.24 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.348 -1.341 . . . . 0.0 111.535 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . 0.512 ' H ' ' C ' ' R' ' 41' ' ' LEU . 4.8 mp -141.67 159.18 42.76 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.131 -0.627 . . . . 0.0 109.374 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.517 ' CB ' ' CD ' ' R' ' 45' ' ' PRO 0.288 0.3 OUTLIER -107.67 -148.94 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.623 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.453 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.517 ' CD ' ' CB ' ' R' ' 44' ' ' THR . 9.4 Cg_endo -98.12 -39.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.474 0.357 0 CA-C-N 119.945 1.016 . . . . 0.0 110.524 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.379 -0.928 . . . . 0.0 110.165 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.9 -41.77 95.33 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.91 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.03 -34.8 73.73 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.57 -0.852 . . . . 0.0 111.245 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.14 -64.42 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.74 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.433 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -53.95 -39.71 66.18 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.181 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -48.61 -67.6 0.26 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.612 -0.835 . . . . 0.0 110.862 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . 0.408 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -45.32 -52.82 8.35 Favored Glycine 0 N--CA 1.486 2.002 0 C-N-CA 119.283 -1.437 . . . . 0.0 110.644 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' R' ' 50' ' ' ALA . 0.2 OUTLIER -37.7 -78.58 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.276 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 9.6 mtt85 -40.94 -51.89 3.16 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.294 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 59.1 t -64.36 -26.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 C-N-CA 118.344 -1.343 . . . . 0.0 111.34 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.411 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -81.23 -39.28 25.62 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.826 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.441 HD11 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -74.33 -34.78 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 117.718 -1.593 . . . . 0.0 108.465 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.441 ' N ' HD11 ' R' ' 57' ' ' ILE . 4.3 t -61.43 -65.27 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 118.004 -1.478 . . . . 0.0 109.414 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -41.28 -50.73 3.67 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.882 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.64 -47.32 82.56 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.823 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 80.9 mt -83.09 6.09 20.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.538 -0.865 . . . . 0.0 112.241 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 tp -128.12 26.63 5.75 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.365 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -115.08 -61.26 1.77 Allowed 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.021 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -126.84 -94.56 0.89 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.529 ' O ' ' C ' ' R' ' 66' ' ' MET . 9.7 mm-40 -136.49 -61.56 0.68 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.363 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 66' ' ' MET . . . . . 0.529 ' C ' ' O ' ' R' ' 65' ' ' GLU . 1.0 OUTLIER 3.2 101.75 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 124.608 1.192 . . . . 0.0 113.129 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 90.7 p -160.6 67.66 0.34 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.112 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.53 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.9 OUTLIER -125.36 -56.5 1.52 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.382 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.63 31.63 0.11 Allowed 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 120.039 -0.664 . . . . 0.0 111.059 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.53 ' H ' ' C ' ' R' ' 68' ' ' GLN . 0.0 OUTLIER -92.27 24.56 3.31 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.636 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mp -78.99 178.24 8.17 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.988 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -102.39 114.89 29.46 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.453 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -103.5 -107.02 0.27 Allowed 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.61 0.719 . . . . 0.0 111.128 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -146.51 -21.69 0.43 Allowed 'General case' 0 C--N 1.281 -2.395 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.603 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . . . . . . . . . 4.6 mt -123.62 -10.5 7.86 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.467 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -54.96 -67.42 2.21 Favored Glycine 0 N--CA 1.487 2.089 0 C-N-CA 119.628 -1.273 . . . . 0.0 110.944 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -171.6 -74.54 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.109 -1.036 . . . . 0.0 111.002 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.45 138.36 2.69 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.491 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.467 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.28 -38.99 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.221 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.427 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.93 -61.62 1.95 Allowed 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.891 179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 48.9 m -38.75 -38.87 0.45 Allowed 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 13.4 pt -82.27 -22.64 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.45 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -64.85 -55.19 21.0 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 118.693 -1.203 . . . . 0.0 111.663 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . 0.465 ' NE ' ' CD1' ' R' ' 1' ' ' TRP . 0.0 OUTLIER -72.91 -9.71 58.99 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.171 -1.012 . . . . 0.0 111.484 -179.912 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.01 -32.79 52.01 Favored Glycine 0 N--CA 1.49 2.274 0 C-N-CA 119.089 -1.529 . . . . 0.0 110.775 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 86' ' ' SER . . . . . 0.529 ' C ' ' H ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -84.88 -55.82 3.89 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.213 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . 0.402 ' O ' ' C ' ' R' ' 88' ' ' SER . 25.1 m-80 -69.06 11.61 0.2 Allowed 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.324 -0.951 . . . . 0.0 111.264 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 88' ' ' SER . . . . . 0.529 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.3 OUTLIER -42.61 -31.27 0.43 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 1.5 mt -50.22 -45.1 53.54 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.875 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . 0.533 ' O ' ' N ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -107.47 -54.57 2.46 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.772 -0.771 . . . . 0.0 111.112 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.68 -27.78 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.237 -1.347 . . . . 0.0 112.643 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . 0.533 ' N ' ' O ' ' R' ' 90' ' ' LYS . . . -88.0 156.12 52.26 Favored Pre-proline 0 N--CA 1.49 1.535 0 C-N-CA 118.674 -1.21 . . . . 0.0 110.698 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -51.84 129.58 30.86 Favored 'Trans proline' 0 C--N 1.325 -0.7 0 C-N-CA 121.445 1.43 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 4.7 t -62.14 -12.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.992 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -91.45 4.62 52.06 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.514 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -90.24 -49.86 6.31 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.1 -38.8 3.84 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.798 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -58.7 -41.18 85.68 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.516 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 5.3 t90 -84.85 -63.16 1.38 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.281 -0.967 . . . . 0.0 112.323 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.6 mm? -41.06 -38.2 0.98 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 118.952 -1.099 . . . . 0.0 113.96 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.474 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.6 mm-40 -44.99 -29.65 0.87 Allowed 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 117.851 -1.54 . . . . 0.0 107.856 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.465 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.6 mt-10 -94.58 -30.94 14.11 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 113.304 -1.771 . . . . 0.0 111.818 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.6 t -89.67 -6.64 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 117.466 -1.694 . . . . 0.0 110.503 -179.947 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 13.7 tp -104.02 -49.35 3.64 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.25 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.67 -68.5 0.64 Allowed 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.755 -0.778 . . . . 0.0 112.255 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . 0.426 ' O ' ' OG ' ' R' ' 107' ' ' SER . 45.1 tttp -57.33 -11.71 1.99 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 119.955 -0.698 . . . . 0.0 111.821 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' R' R ' 107' ' ' SER . . . . . 0.426 ' OG ' ' O ' ' R' ' 106' ' ' LYS . 1.1 p . . . . . 0 C--N 1.303 -1.455 0 CA-C-O 116.326 -1.797 . . . . 0.0 110.964 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 N--CA 1.487 1.412 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' S' S ' 5' ' ' SER . . . . . 0.47 ' HG ' ' CB ' ' S' ' 8' ' ' SER . 0.0 OUTLIER -100.55 164.24 16.61 Favored Pre-proline 0 N--CA 1.489 1.478 0 C-N-CA 119.665 -0.814 . . . . 0.0 110.829 -179.916 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -59.09 -63.63 0.13 Allowed 'Trans proline' 0 C--N 1.322 -0.828 0 C-N-CA 121.472 1.448 . . . . 0.0 111.401 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -94.14 74.94 4.04 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.751 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 8' ' ' SER . . . . . 0.47 ' CB ' ' HG ' ' S' ' 5' ' ' SER . 83.1 p -158.17 34.94 0.24 Allowed 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.186 -1.006 . . . . 0.0 111.203 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -96.32 -8.84 31.59 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.408 -0.917 . . . . 0.0 111.159 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.91 140.41 29.97 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.554 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 11' ' ' MET . . . . . 0.444 ' N ' ' SD ' ' S' ' 11' ' ' MET . 0.7 OUTLIER -116.58 81.96 1.71 Allowed 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.333 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.15 109.3 3.98 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.113 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -115.43 124.51 51.34 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.909 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . 0.476 ' O ' ' N ' ' S' ' 17' ' ' GLN . 2.0 mt-30 -73.21 108.82 6.31 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 119.199 -1.0 . . . . 0.0 109.556 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . 0.528 ' C ' ' H ' ' S' ' 17' ' ' GLN . 6.1 mtp180 -38.01 -32.41 0.06 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.815 -0.754 . . . . 0.0 111.325 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . 0.548 ' O ' ' CG ' ' S' ' 16' ' ' HIS . 43.6 t-80 -69.15 13.55 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.451 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.528 ' H ' ' C ' ' S' ' 15' ' ' ARG . 1.5 tp60 -91.26 -97.19 0.12 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.416 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.403 ' C ' ' O ' ' S' ' 17' ' ' GLN . 0.6 OUTLIER -44.36 -27.99 0.49 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.537 1.161 . . . . 0.0 108.638 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . 0.451 ' N ' ' C ' ' S' ' 17' ' ' GLN . 11.2 t-105 -48.87 -63.92 0.95 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.782 -1.554 . . . . 0.0 108.444 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -44.51 -39.07 4.56 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.266 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.525 ' O ' ' N ' ' S' ' 24' ' ' ASP . 5.8 mmp_? -51.63 -71.12 0.07 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.181 -1.408 . . . . 0.0 109.344 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.522 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -28.92 -44.7 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.797 -0.761 . . . . 0.0 111.202 179.656 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . 0.424 ' N ' ' O ' ' S' ' 21' ' ' ARG . 99.1 t -70.32 -48.78 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.709 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.525 ' N ' ' O ' ' S' ' 21' ' ' ARG . 63.5 t0 -42.94 -72.83 0.05 Allowed 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.636 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -43.26 -45.97 6.03 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.711 -0.796 . . . . 0.0 109.952 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -40.82 -59.71 1.35 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.941 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . 0.515 ' NZ ' ' CE1' ' R' ' 30' ' ' TYR . 0.1 OUTLIER -50.36 -70.35 0.09 Allowed 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.682 -0.807 . . . . 0.0 112.461 -179.84 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -49.16 -24.72 1.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.73 -56.03 3.46 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 118.898 -1.121 . . . . 0.0 112.262 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -47.86 -33.41 7.42 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 119.657 -0.817 . . . . 0.0 111.157 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.37 -28.9 21.37 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 118.881 -1.128 . . . . 0.0 110.229 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.492 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 7.4 m120 -111.45 -65.44 1.17 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.599 ' C ' ' HD1' ' S' ' 35' ' ' HIS . 0.0 OUTLIER 164.24 -11.54 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.751 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . 0.514 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 3.7 mm? -59.11 -16.7 20.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.177 -0.609 . . . . 0.0 111.821 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . 0.599 ' HD1' ' C ' ' S' ' 33' ' ' ASP . 11.4 p-80 -48.43 -18.15 0.21 Allowed 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 119.356 -0.938 . . . . 0.0 112.134 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.48 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.2 mt -80.92 -65.63 0.26 Allowed Pre-proline 0 C--N 1.308 -1.219 0 C-N-CA 117.995 -1.482 . . . . 0.0 110.931 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.2 Cg_exo -50.31 -28.79 21.51 Favored 'Trans proline' 0 C--N 1.319 -0.987 0 C-N-CA 120.624 0.882 . . . . 0.0 110.975 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.36 -41.54 39.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.326 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . 0.521 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.3 OUTLIER -52.29 -43.34 64.42 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.376 -0.93 . . . . 0.0 109.756 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . 0.416 ' O ' ' OXT' ' R' ' 1' ' ' TRP . 3.5 m-80 -71.39 13.12 0.26 Allowed 'General case' 0 C--N 1.297 -1.684 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.83 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . 0.521 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.1 tp -113.71 -54.38 2.61 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 120.044 -0.662 . . . . 0.0 112.344 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.22 7.12 17.16 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 118.665 -1.214 . . . . 0.0 112.725 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 2.1 pp -177.03 153.35 0.98 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.305 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.49 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.7 OUTLIER -179.05 -42.38 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.175 0 C-N-CA 117.783 -1.567 . . . . 0.0 114.762 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.543 ' C ' ' H ' ' S' ' 47' ' ' GLU . 14.4 Cg_endo -77.15 -105.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 121.037 1.158 . . . . 0.0 112.88 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . 0.4 ' OD1' ' O ' ' S' ' 46' ' ' ASP . 34.8 t0 -55.25 -6.18 0.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.693 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . 0.543 ' H ' ' C ' ' S' ' 45' ' ' PRO . 8.4 mm-40 -82.92 -59.45 2.49 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 119.723 -0.791 . . . . 0.0 109.972 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . 0.621 ' NH1' ' CE3' ' R' ' 19' ' ' TRP . 19.4 tpt180 -54.83 -24.88 24.97 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.918 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . 0.422 ' O ' ' OG1' ' S' ' 53' ' ' THR . 31.8 mt-10 -82.24 -71.13 0.5 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.745 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . 0.437 ' C ' ' HG1' ' S' ' 53' ' ' THR . . . -55.53 -51.13 68.07 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.048 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.26 -61.84 0.84 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.899 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.38 -40.99 78.83 Favored Glycine 0 N--CA 1.489 2.177 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.596 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.477 ' H ' ' HG1' ' S' ' 53' ' ' THR . 0.2 OUTLIER -48.9 -77.27 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.221 179.954 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.746 ' HE ' ' N ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -44.15 -29.49 0.63 Allowed 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.805 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 96.8 t -81.52 -28.57 10.32 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.527 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.65 -36.03 33.07 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.843 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . 0.428 ' N ' ' HG3' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -74.6 -38.94 46.55 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . 0.415 ' N ' HD11 ' S' ' 57' ' ' ILE . 3.1 t -55.81 -68.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 118.635 -1.226 . . . . 0.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -48.11 -33.24 7.92 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.886 179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -67.78 -48.41 66.4 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.078 -1.049 . . . . 0.0 112.18 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . 0.54 ' C ' ' H ' ' S' ' 63' ' ' ARG . 0.5 OUTLIER -61.58 -18.92 61.39 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 118.131 -1.428 . . . . 0.0 108.698 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . 0.614 ' O ' ' N ' ' S' ' 64' ' ' GLY . 1.7 tp -77.92 26.06 0.2 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.858 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . 0.54 ' H ' ' C ' ' S' ' 61' ' ' LEU . 61.5 mtt180 19.34 38.67 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.095 0 O-C-N 124.398 1.061 . . . . 0.0 113.832 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.614 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -70.59 -31.16 68.1 Favored Glycine 0 N--CA 1.49 2.288 0 C-N-CA 119.251 -1.452 . . . . 0.0 109.72 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -116.44 -68.08 0.95 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.335 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 84.1 mtp -125.44 -133.51 0.26 Allowed 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.069 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 67' ' ' SER . . . . . 0.569 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.3 OUTLIER 173.04 -71.78 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 118.903 -1.119 . . . . 0.0 110.544 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.506 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.0 OUTLIER -22.99 -39.91 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 124.395 1.059 . . . . 0.0 113.405 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . 0.569 ' N ' ' O ' ' S' ' 67' ' ' SER . 6.4 tpt180 -71.96 32.43 0.06 Allowed 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.914 -0.714 . . . . 0.0 112.333 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.506 ' H ' ' C ' ' S' ' 68' ' ' GLN . 0.0 OUTLIER -111.68 6.95 20.2 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.755 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 10.9 mt -83.42 145.83 28.77 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.349 -0.94 . . . . 0.0 111.514 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -69.6 93.18 0.68 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.911 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -84.59 -101.71 0.05 Allowed 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.782 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -141.12 -26.25 0.72 Allowed 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.834 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 tp -126.68 7.85 6.88 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.027 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -54.39 -71.11 0.76 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 119.577 -1.296 . . . . 0.0 110.897 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.74 -86.14 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.305 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.69 128.02 1.65 Allowed Glycine 0 N--CA 1.49 2.288 0 C-N-CA 118.913 -1.613 . . . . 0.0 111.367 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.465 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -38.71 -41.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.307 0 CA-C-N 115.393 -0.403 . . . . 0.0 111.099 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.462 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.62 -42.72 86.36 Favored 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 118.807 -1.157 . . . . 0.0 110.835 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 19.1 m -53.17 -49.58 66.36 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 24.8 pt -72.8 11.13 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.462 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -105.96 -63.55 1.24 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.881 -1.128 . . . . 0.0 111.965 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.29 -21.57 49.38 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 118.459 -1.297 . . . . 0.0 110.876 179.99 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.39 -29.96 72.93 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.345 -1.407 . . . . 0.0 110.714 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -27.32 13.48 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.266 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -101.79 10.29 40.07 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.578 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.423 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.3 OUTLIER -46.48 -21.99 0.23 Allowed 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.265 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' S' ' 88' ' ' SER . 75.8 mt -37.69 -72.05 0.07 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' S' ' 92' ' ' ALA . 0.0 OUTLIER -58.93 -55.68 32.0 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.803 -1.159 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.84 -24.17 0.02 OUTLIER 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.87 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . 0.498 ' N ' ' O ' ' S' ' 90' ' ' LYS . . . -120.37 162.34 34.52 Favored Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.618 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -61.6 -178.33 0.28 Allowed 'Trans proline' 0 C--N 1.319 -0.98 0 C-N-CA 121.236 1.291 . . . . 0.0 111.394 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 24.5 t -100.5 -16.48 7.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.116 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -70.41 -6.07 33.0 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.588 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.3 -24.91 62.23 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.993 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 13.7 mtt85 -78.22 -14.39 59.47 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.58 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -104.77 -10.48 17.39 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.979 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -107.02 -58.14 1.98 Allowed 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 122.201 1.0 . . . . 0.0 112.459 -179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.534 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.6 OUTLIER -53.64 -37.56 63.22 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -179.585 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.53 ' C ' ' O ' ' S' ' 100' ' ' LEU . 8.1 mt-10 -43.81 -32.14 0.99 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 116.939 -1.904 . . . . 0.0 106.215 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.534 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 tt0 -83.79 -27.48 28.79 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 112.683 -2.053 . . . . 0.0 112.054 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . 0.521 ' N ' ' O ' ' S' ' 100' ' ' LEU . 45.0 t -85.74 -32.12 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 C-N-CA 116.01 -2.276 . . . . 0.0 111.304 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 mp -97.14 -55.83 2.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.417 179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 15.5 mt -75.79 -81.27 0.08 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 118.703 -1.199 . . . . 0.0 113.416 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . 0.42 ' O ' ' O ' ' S' ' 102' ' ' GLU . 7.2 tttm -86.61 108.25 18.52 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 119.024 -1.07 . . . . 0.0 112.124 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 116.328 -1.796 . . . . 0.0 110.832 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.465 ' CD1' ' NE ' ' R' ' 84' ' ' ARG . 29.9 m-90 . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 116.312 -1.804 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . . . . . . . . . 12.1 m-90 . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 116.477 -1.725 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . 0.417 ' O ' ' OG ' ' R' ' 5' ' ' SER . 7.9 tt0 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.793 0.33 . . . . 0.0 110.207 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 5' ' ' SER . . . . . 0.417 ' OG ' ' O ' ' R' ' 4' ' ' GLN . 3.2 m -172.08 67.99 0.42 Allowed Pre-proline 0 C--N 1.305 -1.357 0 C-N-CA 119.059 -1.057 . . . . 0.0 111.661 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -65.8 -55.09 0.45 Allowed 'Trans proline' 0 C--N 1.313 -1.299 0 C-N-CA 121.373 1.382 . . . . 0.0 110.359 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -138.73 24.27 2.63 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.701 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -39.35 108.28 0.08 Allowed 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.722 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -99.99 -0.38 39.4 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.319 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.6 -88.2 0.5 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.715 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 18.2 mmt -71.18 132.7 45.39 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.445 -0.902 . . . . 0.0 110.833 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -165.25 -29.38 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.588 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -131.88 63.25 1.62 Allowed 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.027 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -89.17 -6.38 56.99 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.106 -1.037 . . . . 0.0 110.786 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -133.7 108.05 8.3 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.763 -0.775 . . . . 0.0 111.19 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -163.58 -13.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.459 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.424 ' C ' ' N ' ' R' ' 19' ' ' TRP . 4.8 tt0 -88.78 -79.25 0.32 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.626 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.2 mp0 -41.9 -34.57 0.69 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 123.339 1.542 . . . . 0.0 108.3 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CZ3' ' CD ' ' S' ' 48' ' ' ARG . 21.9 t-105 -57.19 -55.66 31.86 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 112.381 -2.19 . . . . 0.0 110.038 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' R' ' 17' ' ' GLN . 6.6 tp -56.55 -27.62 58.12 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.788 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' R' ' 24' ' ' ASP . 0.0 OUTLIER -65.33 -62.71 1.37 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.558 -1.257 . . . . 0.0 109.578 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.499 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.2 OUTLIER -33.85 -43.93 0.15 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.305 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 19.7 t -73.27 -35.57 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 119.549 -0.861 . . . . 0.0 110.2 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . 0.592 ' N ' ' O ' ' R' ' 21' ' ' ARG . 34.7 t0 -59.56 -69.79 0.19 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.645 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.24 -41.29 5.75 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.246 -0.981 . . . . 0.0 109.689 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mt -48.86 -62.39 1.55 Allowed 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.225 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -59.94 -38.21 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.528 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -61.52 -35.33 77.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.502 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.31 -39.73 10.34 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.355 -179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -47.74 -29.48 3.13 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.474 -0.89 . . . . 0.0 112.035 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -52.32 -30.92 30.67 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.375 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -109.11 -79.68 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.234 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 p30 173.51 31.07 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.097 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -94.64 -21.95 18.47 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.862 0.839 . . . . 0.0 110.202 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 13.8 p-80 -49.61 -23.49 1.71 Allowed 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 114.296 -1.32 . . . . 0.0 113.962 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.3 mt -74.08 -66.02 0.54 Allowed Pre-proline 0 N--CA 1.487 1.412 0 C-N-CA 118.164 -1.414 . . . . 0.0 111.316 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 1.4 Cg_endo -52.74 -29.54 42.62 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 120.619 0.879 . . . . 0.0 110.301 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 9.0 mp -82.04 -29.27 32.02 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.845 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . 0.501 ' C ' ' H ' ' R' ' 41' ' ' LEU . 0.0 OUTLIER -59.34 -30.66 68.53 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.78 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . 0.438 ' CG ' HH12 ' R' ' 48' ' ' ARG . 0.8 OUTLIER -77.06 11.46 1.8 Allowed 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 118.716 -1.194 . . . . 0.0 109.199 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . 0.501 ' H ' ' C ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -111.28 -69.0 0.89 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.335 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 42' ' ' MET . . . . . 0.413 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -90.35 41.47 1.05 Allowed 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 118.437 -1.305 . . . . 0.0 108.878 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . 0.421 ' O ' ' O ' ' R' ' 39' ' ' LEU . 4.5 tt 173.89 135.02 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.511 -1.662 . . . . 0.0 106.511 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.463 ' N ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -171.25 -38.31 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.892 0 C-N-CA 114.799 -2.76 . . . . 0.0 117.47 -179.437 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' R' ' 44' ' ' THR . 71.7 Cg_endo -98.69 -105.31 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 121.564 1.509 . . . . 0.0 114.869 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -45.1 -28.84 0.78 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.058 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . 0.468 ' O ' ' N ' ' R' ' 49' ' ' GLU . 7.7 mm-40 -57.66 -67.18 0.36 Allowed 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 118.348 -1.341 . . . . 0.0 109.409 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . 0.524 HH21 ' NE2' ' S' ' 14' ' ' GLN . 1.9 tpp180 -42.92 -24.68 0.07 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.063 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . 0.468 ' N ' ' O ' ' R' ' 47' ' ' GLU . 11.9 mt-10 -96.03 -69.41 0.76 Allowed 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.125 -1.03 . . . . 0.0 113.509 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.402 ' C ' ' HG1' ' R' ' 53' ' ' THR . . . -58.8 -27.27 64.89 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . 0.566 ' CD2' ' N ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -71.71 -37.92 70.59 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.039 -1.464 . . . . 0.0 112.306 -179.671 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . 0.566 ' N ' ' CD2' ' R' ' 51' ' ' LEU . . . -71.21 -36.25 63.79 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 108.556 -1.817 . . . . 0.0 108.556 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.536 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -64.25 -79.65 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.341 -0.929 . . . . 0.0 109.997 179.922 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . 0.554 ' NH1' ' CD1' ' R' ' 1' ' ' TRP . 17.1 mtt-85 -32.44 -55.59 0.34 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.213 -1.358 . . . . 0.0 112.977 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 2.1 p -62.89 -30.31 49.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 117.439 -1.704 . . . . 0.0 111.486 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.614 ' NH1' ' HE ' ' S' ' 21' ' ' ARG . 11.1 mmt180 -76.69 -45.29 30.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.297 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -65.61 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 C-N-CA 118.044 -1.462 . . . . 0.0 110.292 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.548 ' CG1' ' H ' ' R' ' 59' ' ' GLU . 9.4 p -45.71 -58.12 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 C-N-CA 117.963 -1.495 . . . . 0.0 111.203 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . 0.548 ' H ' ' CG1' ' R' ' 58' ' ' VAL . 78.6 mt-10 -54.64 -28.19 45.18 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.723 -1.191 . . . . 0.0 112.706 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -79.38 -51.73 9.02 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.937 -1.105 . . . . 0.0 112.98 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 13.3 mt -67.88 -9.82 48.02 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.655 -1.218 . . . . 0.0 111.532 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.55 -37.06 65.7 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.762 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 31.9 ttm-85 -111.19 -45.4 3.43 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.955 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . 0.59 ' C ' ' H ' ' R' ' 66' ' ' MET . . . -58.35 -27.22 60.32 Favored Glycine 0 N--CA 1.492 2.378 0 C-N-CA 119.454 -1.355 . . . . 0.0 110.511 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 61.23 -25.22 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 66' ' ' MET . . . . . 0.59 ' H ' ' C ' ' R' ' 64' ' ' GLY . 30.5 mmm -140.22 109.03 5.97 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.588 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 17.5 p -173.67 76.73 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 119.653 -0.819 . . . . 0.0 109.875 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.474 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.0 OUTLIER -125.3 -34.31 2.74 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.244 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.31 27.25 0.2 Allowed 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.521 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.527 ' CG ' ' H ' ' R' ' 71' ' ' LEU . 0.9 OUTLIER -43.53 -65.09 0.54 Allowed 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 118.915 -1.114 . . . . 0.0 110.546 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . 0.527 ' H ' ' CG ' ' R' ' 70' ' ' GLU . 1.0 OUTLIER 178.61 -11.76 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.465 179.958 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 20.7 tttm 48.44 78.37 0.08 Allowed 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 118.697 -1.201 . . . . 0.0 109.948 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . 0.593 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.5 OUTLIER -90.31 12.45 18.22 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.268 -0.973 . . . . 0.0 110.83 -179.904 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 52.62 -74.78 0.01 OUTLIER 'General case' 0 C--N 1.285 -2.23 0 CA-C-N 113.695 -1.593 . . . . 0.0 111.211 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . 0.593 ' N ' ' O ' ' R' ' 73' ' ' ASN . 1.0 OUTLIER -58.31 -28.96 65.52 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.418 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -70.38 -44.81 57.7 Favored Glycine 0 N--CA 1.486 2.011 0 C-N-CA 119.354 -1.403 . . . . 0.0 109.675 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . 0.422 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . -167.05 90.53 0.37 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.186 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' R' ' 77' ' ' ALA . . . -34.65 135.33 0.35 Allowed Glycine 0 N--CA 1.495 2.584 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.974 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.489 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -35.6 -35.98 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.057 -0.571 . . . . 0.0 111.103 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . . . . . . . . . . . -58.17 -65.83 0.58 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.826 -1.149 . . . . 0.0 110.366 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 81' ' ' THR . . . . . 0.423 ' HA ' ' HE1' ' R' ' 1' ' ' TRP . 53.2 m -40.42 -42.25 1.56 Allowed 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 2.0 pt -85.71 -6.69 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -78.81 -43.18 25.92 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 118.209 -1.397 . . . . 0.0 111.807 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 1.8 ptp180 -67.22 -23.53 65.74 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.653 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.44 3.75 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.229 -1.462 . . . . 0.0 110.194 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 68.0 m -89.4 -32.33 17.32 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.576 -0.85 . . . . 0.0 111.278 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' R' ' 89' ' ' LEU . 5.2 m-20 -86.27 10.66 14.1 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.291 -0.963 . . . . 0.0 110.88 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -40.68 -21.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.698 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' R' ' 87' ' ' ASN . 72.1 mt -58.19 -67.23 0.37 Allowed 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.94 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.8 -27.09 18.21 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.136 -1.026 . . . . 0.0 113.466 -179.812 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -50.84 72.08 Favored 'General case' 0 C--N 1.284 -2.271 0 C-N-CA 118.72 -1.192 . . . . 0.0 112.827 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -91.66 162.46 31.3 Favored Pre-proline 0 N--CA 1.489 1.521 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -51.53 142.13 40.19 Favored 'Trans proline' 0 C--N 1.323 -0.781 0 C-N-CA 121.628 1.552 . . . . 0.0 112.038 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 23.6 t -92.61 -15.63 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.541 -0.864 . . . . 0.0 111.122 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -70.9 -3.8 21.1 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.04 -1.064 . . . . 0.0 110.284 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.6 tp -67.6 -44.11 78.9 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.043 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.81 -19.15 0.89 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.382 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -70.59 -34.25 71.97 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.037 -1.065 . . . . 0.0 110.704 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 15.7 t90 -100.38 -57.46 2.11 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.473 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.0 mm? -41.54 -34.97 0.63 Allowed 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.556 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' R' ' 100' ' ' LEU . 0.5 OUTLIER -44.48 -31.0 0.96 Allowed 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 117.851 -1.54 . . . . 0.0 108.449 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' C ' ' R' ' 100' ' ' LEU . 1.8 mt-10 -95.53 -29.5 14.33 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 114.081 -1.418 . . . . 0.0 111.803 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 4.2 t -81.16 -20.92 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 116.792 -1.963 . . . . 0.0 110.678 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.45 -55.35 3.44 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.158 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tp -50.78 -41.91 57.44 Favored 'General case' 0 C--N 1.308 -1.197 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.291 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 tttt -40.53 -73.95 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 119.688 -0.805 . . . . 0.0 111.297 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 116.32 -1.8 . . . . 0.0 110.717 -179.944 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . 0.422 ' O ' ' O ' ' S' ' 5' ' ' SER . 4.3 tt0 . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 121.079 0.466 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 5' ' ' SER . . . . . 0.422 ' O ' ' O ' ' S' ' 4' ' ' GLN . 0.0 OUTLIER 57.35 157.11 0.08 OUTLIER Pre-proline 0 N--CA 1.492 1.635 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.641 -179.955 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . 0.404 ' N ' ' HG ' ' S' ' 5' ' ' SER . 3.4 Cg_exo -59.05 142.81 99.78 Favored 'Trans proline' 0 C--N 1.324 -0.756 0 C-N-CA 121.574 1.516 . . . . 0.0 111.999 179.874 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -108.04 -19.0 13.65 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.513 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 66.2 m -150.73 146.51 26.48 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.753 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -146.34 173.07 12.58 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.734 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.46 -59.25 2.86 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.287 -0.965 . . . . 0.0 111.205 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 7.9 tpt -164.43 -16.9 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 118.597 -1.241 . . . . 0.0 111.781 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . 61.19 -155.55 0.35 Allowed 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.063 -1.055 . . . . 0.0 110.556 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -139.66 5.81 2.22 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.29 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . 0.524 ' NE2' HH21 ' R' ' 48' ' ' ARG . 51.4 mt-30 -83.5 159.74 21.64 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.173 -1.011 . . . . 0.0 110.356 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -93.97 121.47 35.47 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.706 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -129.26 -11.79 4.59 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.321 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.525 ' OE1' ' N ' ' S' ' 17' ' ' GLN . 4.7 mp0 -89.83 -76.94 0.41 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.627 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.5 mt-10 -42.13 -30.99 0.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 122.721 1.248 . . . . 0.0 108.328 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . 0.472 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.254 56.0 t-105 -49.76 -56.04 11.75 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.809 179.76 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 5.3 tp -52.43 -40.21 61.93 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 113.841 -1.527 . . . . 0.0 112.045 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.614 ' HE ' ' NH1' ' R' ' 56' ' ' ARG . 4.3 mtt-85 -59.21 -72.64 0.1 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.14 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.509 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -32.1 -44.47 0.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.17 179.62 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . 0.464 ' O ' ' N ' ' S' ' 26' ' ' LEU . 71.0 t -63.28 -61.9 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.481 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.414 ' C ' ' O ' ' S' ' 23' ' ' VAL . 41.9 t0 -32.55 -55.37 0.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.137 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -60.78 -42.23 97.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.802 -1.159 . . . . 0.0 110.351 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . 0.464 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -54.2 -56.38 18.86 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 119.668 -0.813 . . . . 0.0 112.06 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -58.46 -56.86 16.7 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -60.9 -49.87 75.72 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.269 -0.973 . . . . 0.0 112.385 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -52.99 -37.93 61.81 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 118.714 -1.194 . . . . 0.0 111.383 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -52.1 -43.42 63.92 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 118.456 -1.297 . . . . 0.0 109.807 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -37.72 74.63 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -89.68 -12.13 40.41 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.366 179.882 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' S' ' 29' ' ' ALA . 3.1 t70 78.57 3.91 2.59 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.3 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . 0.442 ' N ' HD21 ' S' ' 34' ' ' LEU . 0.1 OUTLIER -79.95 -0.06 33.55 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.714 179.937 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . 0.61 ' N ' ' HD1' ' S' ' 35' ' ' HIS . 0.8 OUTLIER -56.91 -15.77 5.52 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.666 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.454 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 9.0 mt -76.68 -63.88 0.52 Allowed Pre-proline 0 C--N 1.304 -1.373 0 C-N-CA 118.37 -1.332 . . . . 0.0 110.299 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.7 Cg_endo -52.32 -37.71 71.71 Favored 'Trans proline' 0 C--N 1.319 -0.991 0 N-CA-C 109.716 -0.917 . . . . 0.0 109.716 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . 0.41 ' C ' ' N ' ' S' ' 40' ' ' ASN . 3.8 mm? -66.65 -41.76 87.71 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.405 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . 0.514 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -59.08 -14.37 9.7 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . 0.41 ' N ' ' C ' ' S' ' 38' ' ' LEU . 0.6 OUTLIER -91.21 -11.51 38.07 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 114.886 -1.052 . . . . 0.0 112.423 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -101.61 -65.82 0.96 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 119.563 -0.855 . . . . 0.0 112.668 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.16 37.54 0.73 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.38 -1.328 . . . . 0.0 110.29 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . 0.514 ' O ' ' O ' ' S' ' 39' ' ' LEU . 1.9 tp 172.5 132.51 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 CA-C-N 114.614 -1.175 . . . . 0.0 107.995 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.437 ' CB ' ' O ' ' S' ' 43' ' ' LEU . 0.7 OUTLIER -176.47 -48.13 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.335 0 C-N-CA 114.927 -2.709 . . . . 0.0 117.569 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.2 -101.81 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.223 0 N-CA-C 115.284 1.225 . . . . 0.0 115.284 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -52.79 -23.36 6.73 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.837 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . 0.554 ' CD ' ' N ' ' S' ' 47' ' ' GLU . 0.0 OUTLIER -62.78 -55.23 28.34 Favored 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.815 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . 0.441 ' CD ' ' CZ3' ' R' ' 19' ' ' TRP . 14.7 mmm-85 -52.47 -39.78 61.55 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.505 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -71.75 0.23 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.422 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . 0.46 ' C ' ' HG1' ' S' ' 53' ' ' THR . . . -48.31 -25.53 1.61 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.557 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.14 -63.95 1.05 Allowed 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 119.383 -0.927 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.26 -40.91 11.04 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.632 -1.747 . . . . 0.0 109.153 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.46 ' HG1' ' C ' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -54.38 -82.2 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.831 -0.748 . . . . 0.0 112.943 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.47 ' HB3' ' CE3' ' R' ' 109' ' ' TRP . 5.3 ptt180 -43.46 -40.79 3.99 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.668 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.61 -34.07 67.34 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.267 0 C-N-CA 117.73 -1.588 . . . . 0.0 110.588 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.6 OUTLIER -82.98 -36.03 25.41 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 118.023 -1.471 . . . . 0.0 112.578 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . 0.473 ' CD1' ' C ' ' S' ' 57' ' ' ILE . 0.3 OUTLIER -64.67 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 115.861 -2.336 . . . . 0.0 106.597 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 38.5 t -62.63 -67.76 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 118.512 -1.275 . . . . 0.0 109.218 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . 0.452 ' O ' ' OE1' ' S' ' 59' ' ' GLU . 0.0 OUTLIER -45.34 -41.89 9.39 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.287 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . 0.438 ' O ' ' N ' ' S' ' 63' ' ' ARG . 16.6 mm-40 -58.75 -45.52 89.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.931 -1.108 . . . . 0.0 111.074 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 16.2 mt -51.31 -47.63 62.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 118.273 -1.371 . . . . 0.0 108.83 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.52 -23.56 58.46 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.653 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . 0.496 ' C ' ' H ' ' S' ' 65' ' ' GLU . 4.3 tpt180 -91.74 22.7 3.98 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.941 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . . . . . . . . . . . -52.25 -8.84 0.52 Allowed Glycine 0 N--CA 1.492 2.432 0 C-N-CA 119.773 -1.203 . . . . 0.0 111.064 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . 0.496 ' H ' ' C ' ' S' ' 63' ' ' ARG . 4.5 mt-10 -47.71 -30.54 3.92 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.116 -1.034 . . . . 0.0 110.54 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.48 127.14 25.29 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.594 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 36.6 t -171.54 73.74 0.05 Allowed 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 118.844 -1.143 . . . . 0.0 111.376 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -117.86 -50.09 2.51 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.616 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -97.56 27.17 4.46 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.115 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -125.56 -13.22 6.57 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.923 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . 0.423 ' O ' ' C ' ' S' ' 72' ' ' LYS . 0.5 OUTLIER -48.83 155.68 0.56 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 118.279 -1.369 . . . . 0.0 111.186 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . 0.423 ' C ' ' O ' ' S' ' 71' ' ' LEU . 0.9 OUTLIER -23.87 109.98 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.919 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' S' ' 75' ' ' LEU . 29.2 t30 -93.97 18.29 10.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 122.231 1.015 . . . . 0.0 108.866 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 43.04 8.47 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 112.382 -2.19 . . . . 0.0 113.449 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' S' ' 73' ' ' ASN . 8.8 mt -128.99 -46.29 1.25 Allowed 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.284 -0.967 . . . . 0.0 111.465 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -66.62 -31.41 78.49 Favored Glycine 0 N--CA 1.492 2.43 0 C-N-CA 119.7 -1.238 . . . . 0.0 112.451 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' S' ' 78' ' ' GLY . . . -176.74 99.75 0.05 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 118.64 -1.224 . . . . 0.0 111.033 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -36.35 142.05 0.18 Allowed Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.427 -0.892 . . . . 0.0 111.791 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.512 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.1 OUTLIER -36.75 -30.77 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -45.98 -66.9 0.33 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.74 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 1.5 m -40.11 -69.53 0.13 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 19.4 pt -52.62 -14.23 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.576 ' C ' ' H ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -94.28 -60.39 1.74 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.367 -1.333 . . . . 0.0 112.792 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -50.16 -5.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.014 -1.074 . . . . 0.0 111.55 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . 0.576 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -48.6 -58.05 7.83 Favored Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.584 -1.293 . . . . 0.0 110.845 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 86' ' ' SER . . . . . 0.424 ' O ' ' OG ' ' S' ' 86' ' ' SER . 17.3 p -174.25 46.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.063 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -98.56 -27.17 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.267 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.495 ' C ' ' H ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -129.79 -38.35 1.49 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.877 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.0 -2.42 1.22 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.306 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . 0.495 ' H ' ' C ' ' S' ' 88' ' ' SER . 0.8 OUTLIER -68.89 -40.68 79.05 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.017 -0.992 . . . . 0.0 113.026 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.69 -22.66 24.53 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -52.02 -56.39 22.16 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 117.836 -1.546 . . . . 0.0 112.084 -179.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 31.4 Cg_endo -83.05 126.41 4.37 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 120.802 1.001 . . . . 0.0 110.03 179.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . 0.554 ' C ' ' H ' ' S' ' 96' ' ' LEU . 15.4 t -86.44 -37.3 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 118.594 -1.242 . . . . 0.0 111.829 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -3.14 0.27 Allowed 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.901 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . 0.554 ' H ' ' C ' ' S' ' 94' ' ' VAL . 0.2 OUTLIER -85.83 -29.84 23.44 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.486 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -8.43 25.25 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -103.79 -6.12 21.76 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.336 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -113.22 -64.43 1.31 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.854 ' CD2' ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -9.2 -84.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 120.865 3.654 . . . . 0.0 120.865 -179.581 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.854 ' H ' ' CD2' ' S' ' 100' ' ' LEU . 3.5 mm-40 -92.71 -37.52 12.33 Favored 'General case' 0 C--N 1.278 -2.507 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.462 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.419 ' C ' ' O ' ' S' ' 101' ' ' GLU . 2.0 tt0 -53.57 -19.06 3.39 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . 0.591 ' N ' ' C ' ' S' ' 101' ' ' GLU . 95.2 t -108.15 -67.13 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.161 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 9.7 mt -43.93 -55.52 4.54 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 117.936 -1.506 . . . . 0.0 111.331 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 12.9 tp -56.85 -71.05 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.836 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 mmtt -48.45 -38.12 19.0 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.97 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 116.398 -1.763 . . . . 0.0 110.851 179.929 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.554 ' CD1' ' NH1' ' R' ' 54' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 116.31 -1.805 . . . . 0.0 110.031 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.47 ' CE3' ' HB3' ' S' ' 54' ' ' ARG . 2.8 p90 . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 116.114 -1.898 . . . . 0.0 108.777 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 . . . . . 0 N--CA 1.485 1.307 0 CA-C-O 120.9 0.381 . . . . 0.0 110.033 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 84.2 p -165.03 68.47 1.31 Allowed Pre-proline 0 N--CA 1.487 1.377 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.082 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.27 -36.48 35.78 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 121.65 1.567 . . . . 0.0 111.454 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 t80 67.07 37.14 3.87 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.768 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 14.7 t -150.93 9.72 0.59 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.814 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . 48.73 70.9 0.41 Allowed 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.819 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -174.58 176.43 2.32 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.782 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 4.5 ptt? -165.81 -19.96 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.907 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . 0.516 ' C ' ' H ' ' R' ' 14' ' ' GLN . . . -70.05 -78.6 0.07 Allowed 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.751 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -76.09 30.68 0.12 Allowed 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.329 -0.949 . . . . 0.0 110.58 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . 0.516 ' H ' ' C ' ' R' ' 12' ' ' ALA . 4.8 tt0 -58.31 137.27 57.28 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.809 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 60.0 mtt85 -74.6 105.15 5.57 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.306 -0.957 . . . . 0.0 110.961 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -147.25 -6.04 0.49 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.572 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' R' ' 20' ' ' LEU . 1.5 mt-30 -97.61 -79.59 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.648 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . 0.467 ' H ' ' CD ' ' R' ' 18' ' ' GLU . 1.9 mp0 -47.21 -28.69 1.98 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . 0.48 ' N ' ' C ' ' R' ' 17' ' ' GLN . 10.9 t-105 -62.56 -53.23 57.78 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.308 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' R' ' 17' ' ' GLN . 0.8 OUTLIER -56.77 -38.06 71.94 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.249 179.708 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.518 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mtt180 -52.59 -70.07 0.1 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 118.352 -1.339 . . . . 0.0 108.625 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.518 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -28.55 -47.65 0.05 Allowed 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.552 0.532 . . . . 0.0 110.698 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 22.6 t -68.94 -49.18 65.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.675 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' R' ' 21' ' ' ARG . 21.6 t70 -46.45 -76.45 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.83 -0.748 . . . . 0.0 110.94 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -41.49 -41.53 2.11 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.828 -179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.35 -59.25 4.17 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.052 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -71.5 -38.21 71.17 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.693 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -15.22 23.01 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.997 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.73 -43.35 5.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.463 -0.895 . . . . 0.0 112.013 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -43.35 -27.76 0.28 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.207 -0.997 . . . . 0.0 110.906 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -51.54 -42.96 62.16 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.524 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . 0.41 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 9.7 m-80 -102.18 -72.14 0.7 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.494 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . 0.445 ' H ' HD23 ' R' ' 34' ' ' LEU . 0.5 OUTLIER 169.77 18.12 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.39 -0.924 . . . . 0.0 112.425 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . 0.631 ' H ' ' CD2' ' R' ' 34' ' ' LEU . 0.1 OUTLIER -92.29 -7.97 46.48 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.126 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -51.72 -13.21 0.24 Allowed 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 119.385 -0.926 . . . . 0.0 111.981 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.5 mt -81.41 -65.55 0.25 Allowed Pre-proline 0 N--CA 1.482 1.131 0 C-N-CA 118.141 -1.424 . . . . 0.0 110.1 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -49.51 -27.62 14.62 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 N-CA-C 109.968 -0.82 . . . . 0.0 109.968 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 8.0 mp -76.41 -41.87 46.21 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.796 179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . 0.465 ' O ' ' O ' ' R' ' 43' ' ' LEU . 1.3 tp -50.17 -47.68 54.33 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.464 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . 0.572 ' O ' ' N ' ' R' ' 109' ' ' TRP . 1.1 m120 -70.78 3.13 3.44 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.056 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 mt -110.76 -62.08 1.59 Allowed 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.764 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -82.57 29.79 0.43 Allowed 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.08 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . 0.465 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.8 OUTLIER 163.39 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.537 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.549 ' N ' ' CD ' ' R' ' 45' ' ' PRO . 0.6 OUTLIER -176.82 -41.22 0.0 OUTLIER Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 117.937 -1.505 . . . . 0.0 114.026 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' R' ' 44' ' ' THR . 14.6 Cg_endo -78.85 -102.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.826 1.017 . . . . 0.0 112.337 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.05 -14.21 2.46 Favored 'General case' 0 C--N 1.308 -1.224 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.172 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . 0.512 ' N ' ' OE1' ' R' ' 47' ' ' GLU . 0.7 OUTLIER -77.64 -55.65 5.17 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.127 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -49.06 -37.83 22.32 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.253 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . 0.442 ' O ' ' OG1' ' R' ' 53' ' ' THR . 6.5 mt-10 -65.52 -67.74 0.42 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.614 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.45 -34.06 15.79 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.036 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 4.2 mp -53.71 -77.65 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.46 -0.896 . . . . 0.0 111.54 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.16 -51.25 11.66 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.784 -1.198 . . . . 0.0 111.548 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' R' ' 49' ' ' GLU . 0.1 OUTLIER -42.08 -81.23 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 121.754 0.788 . . . . 0.0 111.458 -179.955 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . 0.449 ' C ' ' CD ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -34.36 -52.1 0.47 Allowed 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.036 -1.438 . . . . 0.0 112.823 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.7 t -60.62 -32.91 52.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 C-N-CA 119.191 -1.004 . . . . 0.0 112.519 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.35 -33.09 32.64 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.899 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.522 ' C ' ' CD1' ' R' ' 57' ' ' ILE . 0.0 OUTLIER -78.06 -47.59 24.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 C-N-CA 118.67 -1.212 . . . . 0.0 107.763 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . . . . . . . . . 42.9 t -53.77 -63.26 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 119.077 -1.049 . . . . 0.0 110.325 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.13 -38.31 57.09 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 119.581 -0.847 . . . . 0.0 111.875 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -63.24 -30.57 71.68 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.481 -0.887 . . . . 0.0 112.979 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . 0.461 ' C ' ' CD1' ' R' ' 61' ' ' LEU . 0.4 OUTLIER -85.14 -27.55 26.14 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.413 -1.315 . . . . 0.0 111.451 -179.841 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -48.67 64.67 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.184 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 6.3 ptt180 -106.84 1.1 24.49 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.856 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.68 24.92 23.75 Favored Glycine 0 N--CA 1.49 2.295 0 C-N-CA 119.319 -1.42 . . . . 0.0 110.896 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -46.28 -31.69 2.67 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.237 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.1 50.75 0.76 Allowed 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.193 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 67' ' ' SER . . . . . 0.436 ' O ' ' OG ' ' R' ' 67' ' ' SER . 1.4 t 171.89 84.12 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.32 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.021 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.536 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.5 OUTLIER -125.19 -30.57 3.17 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.019 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . 0.45 ' O ' ' CG ' ' R' ' 69' ' ' ARG . 0.0 OUTLIER -80.45 25.2 0.42 Allowed 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 122.467 1.127 . . . . 0.0 109.743 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.536 ' H ' ' C ' ' R' ' 68' ' ' GLN . 0.0 OUTLIER -126.06 -12.54 6.38 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.293 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . 0.409 ' O ' ' N ' ' R' ' 73' ' ' ASN . 4.2 mt -74.57 -24.9 58.99 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.639 -0.824 . . . . 0.0 111.037 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -66.88 75.13 0.11 Allowed 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.253 -0.979 . . . . 0.0 111.169 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . 0.615 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.4 OUTLIER -98.43 10.06 41.69 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.466 -0.894 . . . . 0.0 109.386 179.876 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 48.71 -76.16 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 112.948 -1.933 . . . . 0.0 111.361 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . 0.615 ' N ' ' O ' ' R' ' 73' ' ' ASN . 1.4 tp -56.51 -11.87 1.48 Allowed 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.912 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -102.25 -37.06 3.42 Favored Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.604 -1.284 . . . . 0.0 110.861 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . -169.89 92.97 0.23 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 119.505 -0.878 . . . . 0.0 110.404 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . -34.71 129.33 0.59 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.439 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.553 ' C ' ' H ' ' R' ' 81' ' ' THR . 0.1 OUTLIER -35.91 -29.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-N 115.391 -0.404 . . . . 0.0 111.289 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -52.83 -1.17 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.328 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 81' ' ' THR . . . . . 0.553 ' H ' ' C ' ' R' ' 79' ' ' ILE . 2.2 t -101.11 -36.68 8.88 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.665 -0.814 . . . . 0.0 112.583 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . 0.4 ' N ' ' CG2' ' R' ' 81' ' ' THR . 12.7 pt -79.99 3.77 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.711 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.527 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.2 OUTLIER -77.25 -51.5 10.8 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.051 -1.06 . . . . 0.0 110.148 179.865 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . 0.401 ' N ' ' OG1' ' R' ' 83' ' ' THR . 3.6 ptm180 -81.33 -12.09 59.13 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.477 -0.889 . . . . 0.0 110.685 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.28 -42.66 4.23 Favored Glycine 0 N--CA 1.488 2.158 0 C-N-CA 119.46 -1.352 . . . . 0.0 110.161 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 10.1 t -54.59 -50.81 67.15 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.468 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.1 OUTLIER -93.18 -78.72 0.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.42 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 88' ' ' SER . . . . . 0.479 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.2 OUTLIER 73.57 -40.57 0.47 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.409 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . 0.495 ' H ' ' C ' ' R' ' 87' ' ' ASN . 8.4 mt -49.64 -21.23 0.96 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.141 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . 0.404 ' N ' ' C ' ' R' ' 88' ' ' SER . 4.5 mmtp -45.09 -62.56 1.19 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.894 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.36 -26.99 65.86 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.037 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . 41.57 65.54 4.55 Favored Pre-proline 0 C--N 1.302 -1.459 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.324 179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . 0.524 ' C ' ' H ' ' R' ' 95' ' ' GLU . 11.9 Cg_endo -78.67 100.24 1.34 Allowed 'Trans proline' 0 C--N 1.314 -1.259 0 C-N-CA 121.591 1.528 . . . . 0.0 110.33 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -67.17 10.69 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.63 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . 0.524 ' H ' ' C ' ' R' ' 93' ' ' PRO . 6.6 mt-10 -89.08 -37.64 14.95 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.749 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.12 -56.11 11.37 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.563 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -50.06 -18.0 0.49 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.425 -0.91 . . . . 0.0 111.086 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -93.12 -26.61 17.37 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.574 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . 0.571 ' NE1' ' ND2' ' S' ' 32' ' ' ASN . 4.9 t90 -110.62 -62.43 1.53 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.643 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.472 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.98 -30.3 0.26 Allowed 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.46 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' R' ' 100' ' ' LEU . 18.9 pt-20 -47.08 -36.65 8.43 Favored 'General case' 0 C--N 1.293 -1.861 0 C-N-CA 117.468 -1.693 . . . . 0.0 106.978 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.472 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 4.5 mt-10 -92.04 -28.7 17.01 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.385 -1.734 . . . . 0.0 112.533 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 t -89.74 -7.21 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 C-N-CA 117.423 -1.711 . . . . 0.0 110.417 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' R' ' 100' ' ' LEU . 21.1 tp -99.19 -53.18 3.31 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.907 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . 0.449 ' CD2' ' N ' ' R' ' 105' ' ' LEU . 4.0 mm? -71.22 -66.16 0.65 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.874 -1.13 . . . . 0.0 110.207 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 24.6 tttt -47.08 -34.6 6.07 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.538 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 116.397 -1.763 . . . . 0.0 110.74 179.978 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . 0.717 ' H2 ' ' CD ' ' S' ' 4' ' ' GLN . 1.2 mm100 . . . . . 0 N--CA 1.501 2.117 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 8.0 t -163.17 69.82 1.89 Allowed Pre-proline 0 C--N 1.297 -1.689 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . 0.425 ' O ' ' N ' ' S' ' 8' ' ' SER . 32.4 Cg_exo -29.81 145.54 0.02 OUTLIER 'Trans proline' 0 C--O 1.214 -0.686 0 C-N-CA 122.924 2.416 . . . . 0.0 116.113 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . 0.468 ' O ' ' O ' ' S' ' 8' ' ' SER . 0.1 OUTLIER -31.15 -37.39 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 113.228 -1.806 . . . . 0.0 112.767 -179.869 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 8' ' ' SER . . . . . 0.468 ' O ' ' O ' ' S' ' 7' ' ' TYR . 24.6 p 33.95 99.7 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.975 0 CA-C-O 121.674 0.749 . . . . 0.0 112.646 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.51 101.63 0.62 Allowed 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.786 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . 168.55 1.8 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 179.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 11' ' ' MET . . . . . 0.509 ' O ' ' C ' ' S' ' 12' ' ' ALA . 0.1 OUTLIER -64.15 100.55 0.34 Allowed 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.433 -1.258 . . . . 0.0 112.624 179.961 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . 0.509 ' C ' ' O ' ' S' ' 11' ' ' MET . . . 12.65 88.57 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -83.64 -1.44 53.95 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 118.835 -1.146 . . . . 0.0 111.265 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -145.99 75.51 1.42 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.541 -0.864 . . . . 0.0 112.283 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 16' ' ' HIS . 14.5 ttm-85 -160.54 134.12 6.88 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.007 -1.077 . . . . 0.0 111.255 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . 0.419 ' C ' ' O ' ' S' ' 15' ' ' ARG . 20.8 t-160 33.75 66.57 0.24 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.654 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -117.56 -85.09 0.64 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.042 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' S' ' 21' ' ' ARG . 47.4 mt-10 -75.13 -21.4 58.87 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 122.852 1.311 . . . . 0.0 107.639 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.281 32.0 t-105 -42.19 -43.94 3.55 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 112.803 -1.999 . . . . 0.0 108.294 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.43 -44.98 92.81 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 112.213 -2.267 . . . . 0.0 109.6 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' S' ' 23' ' ' VAL . 3.1 mmm180 -49.96 -69.11 0.12 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 118.393 -1.323 . . . . 0.0 109.925 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.488 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.48 -36.2 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.82 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . 0.496 ' N ' ' O ' ' S' ' 21' ' ' ARG . 31.3 t -78.99 -64.99 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.852 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.412 ' C ' ' O ' ' S' ' 23' ' ' VAL . 25.2 t0 -34.29 -48.08 0.32 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.665 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 mt -74.69 -49.11 22.48 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.951 -1.1 . . . . 0.0 110.237 -179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 4.2 tt -44.83 -28.59 0.66 Allowed 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.248 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -90.11 -68.94 0.75 Allowed 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.913 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . 0.616 ' N ' HD21 ' S' ' 28' ' ' ASN . 1.5 m120 -41.38 -29.03 0.13 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.75 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . 0.464 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -86.11 -31.98 21.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.675 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -43.73 -44.86 6.84 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 119.085 -1.046 . . . . 0.0 110.566 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -32.48 63.11 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.464 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.571 ' ND2' ' NE1' ' R' ' 99' ' ' TRP . 3.8 t-20 -79.05 -10.33 59.8 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.937 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.4 m-20 72.95 9.92 5.39 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.383 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -0.62 57.78 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 118.933 -1.107 . . . . 0.0 109.977 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . 0.538 ' N ' ' HD1' ' S' ' 35' ' ' HIS . 3.8 p-80 -57.23 -23.96 51.48 Favored 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.755 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.463 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.6 mt -70.44 -63.51 1.67 Allowed Pre-proline 0 C--N 1.306 -1.297 0 C-N-CA 118.534 -1.266 . . . . 0.0 110.608 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -51.3 -31.29 36.85 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 120.951 1.101 . . . . 0.0 110.63 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . 0.435 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.4 mp -78.44 -36.89 44.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.432 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.25 -20.92 64.74 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.241 179.842 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -2.94 49.68 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.224 -0.991 . . . . 0.0 109.591 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . 0.535 ' C ' ' H ' ' S' ' 43' ' ' LEU . 7.4 mp -106.78 -70.94 0.77 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.854 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 42' ' ' MET . . . . . 0.435 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.0 OUTLIER -78.87 43.68 0.51 Allowed 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.832 -1.147 . . . . 0.0 108.843 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . 0.535 ' H ' ' C ' ' S' ' 41' ' ' LEU . 0.1 OUTLIER 177.38 124.01 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 105.334 -2.098 . . . . 0.0 105.334 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.408 ' CG2' ' HD3' ' S' ' 45' ' ' PRO 0.316 13.7 m -121.29 -96.15 0.0 OUTLIER Pre-proline 0 CA--C 1.587 2.368 0 CA-C-O 115.731 -2.08 . . . . 0.0 113.485 -179.426 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.544 ' CG ' ' H ' ' S' ' 46' ' ' ASP . 57.3 Cg_endo -107.3 -64.78 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.485 0 CA-C-N 125.235 2.905 . . . . 0.0 111.766 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . 0.544 ' H ' ' CG ' ' S' ' 45' ' ' PRO . 0.1 OUTLIER -50.7 -27.66 7.49 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.037 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . 0.528 ' H ' ' CD ' ' S' ' 47' ' ' GLU . 21.0 mp0 -66.79 -45.83 77.21 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.41 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -71.19 -37.32 72.13 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.202 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.12 -68.94 0.22 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.573 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -46.6 -38.62 9.83 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.266 -0.973 . . . . 0.0 110.518 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 1.7 mp -53.54 -51.56 62.49 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.433 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -46.27 93.82 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 118.842 -1.647 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -44.89 -79.82 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.544 0.688 . . . . 0.0 111.113 179.893 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.646 ' HE ' ' N ' ' S' ' 55' ' ' VAL . 0.1 OUTLIER -44.8 -47.18 10.94 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 115.133 -0.939 . . . . 0.0 112.182 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . 0.646 ' N ' ' HE ' ' S' ' 54' ' ' ARG . 54.7 t -56.5 -28.87 27.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 C-N-CA 117.76 -1.576 . . . . 0.0 109.281 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' S' ' 53' ' ' THR . 36.1 mtp85 -84.51 -36.48 22.18 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.805 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . 0.506 ' CD1' ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -70.57 -32.28 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 C-N-CA 116.032 -2.267 . . . . 0.0 106.695 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . 0.506 ' N ' ' CD1' ' S' ' 57' ' ' ILE . 7.1 t -59.95 -63.36 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 118.982 -1.087 . . . . 0.0 108.521 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . 0.471 ' OE2' ' CZ ' ' R' ' 21' ' ' ARG . 23.1 mt-10 -49.07 -29.56 5.26 Favored 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.294 -0.963 . . . . 0.0 110.215 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -34.68 44.36 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.472 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . 0.532 ' C ' ' H ' ' S' ' 63' ' ' ARG . 17.3 mt -57.4 -33.31 67.72 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.221 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . 0.796 ' O ' ' N ' ' S' ' 64' ' ' GLY . 49.3 tp -60.95 -7.92 2.8 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 119.289 -0.964 . . . . 0.0 108.468 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . 0.532 ' H ' ' C ' ' S' ' 61' ' ' LEU . 4.0 ptt180 4.59 32.49 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.413 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.796 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -49.0 -19.93 1.68 Allowed Glycine 0 N--CA 1.487 2.038 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . 0.455 ' N ' ' C ' ' S' ' 63' ' ' ARG . 39.8 mt-10 -108.28 -66.69 1.02 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.458 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 66' ' ' MET . . . . . 0.46 ' O ' ' CB ' ' S' ' 67' ' ' SER . 1.7 tpt -169.96 164.4 9.55 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.602 -0.839 . . . . 0.0 110.734 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 67' ' ' SER . . . . . 0.559 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.4 OUTLIER 166.42 -65.49 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.522 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.576 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.7 OUTLIER -26.46 -36.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 124.222 0.951 . . . . 0.0 112.908 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . 0.559 ' N ' ' O ' ' S' ' 67' ' ' SER . 2.8 tpt180 -69.98 27.67 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.957 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.576 ' H ' ' C ' ' S' ' 68' ' ' GLN . 4.2 tt0 -107.41 -63.94 1.25 Allowed 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.866 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 tp 61.48 155.09 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.5 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . 0.463 ' O ' ' CG ' ' S' ' 72' ' ' LYS . 6.7 ptmm? -58.1 123.51 16.18 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.206 -0.997 . . . . 0.0 111.033 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' S' ' 74' ' ' GLU . 38.0 t-20 -125.62 -99.71 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.896 0.855 . . . . 0.0 110.885 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . 0.455 ' N ' ' OD1' ' S' ' 73' ' ' ASN . 0.0 OUTLIER -140.04 -23.35 0.84 Allowed 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.008 -1.451 . . . . 0.0 110.98 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 tp -111.12 -14.51 13.87 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.317 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -53.91 -80.73 0.07 OUTLIER Glycine 0 N--CA 1.49 2.269 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.47 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -178.35 -91.31 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.386 -0.925 . . . . 0.0 111.003 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . 0.481 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -167.94 136.11 3.95 Favored Glycine 0 N--CA 1.491 2.316 0 C-N-CA 119.196 -1.478 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.443 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.43 -28.35 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.434 -0.383 . . . . 0.0 111.289 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -67.46 -65.82 0.64 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.701 -0.8 . . . . 0.0 112.588 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.13 -27.56 2.42 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 15.7 pt -92.48 -21.61 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 C-N-CA 118.701 -1.199 . . . . 0.0 112.706 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.457 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.479 -1.288 . . . . 0.0 110.584 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . 0.753 ' HE ' ' H ' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -76.34 -28.46 56.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.64 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.66 -4.5 4.15 Favored Glycine 0 N--CA 1.485 1.922 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 86' ' ' SER . . . . . 0.498 ' H ' ' C ' ' S' ' 84' ' ' ARG . 0.4 OUTLIER -138.38 -63.33 0.55 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.759 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . 0.521 ' O ' ' N ' ' S' ' 89' ' ' LEU . 32.5 m120 -48.04 -16.66 0.09 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.345 -0.942 . . . . 0.0 110.756 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.543 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -41.07 -21.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.991 -0.684 . . . . 0.0 111.372 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' S' ' 87' ' ' ASN . 5.4 mt -39.56 -21.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.713 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . 0.543 ' N ' ' O ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -75.36 -61.76 1.79 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.812 -1.155 . . . . 0.0 110.51 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -46.69 -62.1 1.53 Allowed 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.689 -1.142 . . . . 0.0 110.752 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 46.03 68.18 3.63 Favored Pre-proline 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.266 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -66.01 107.16 1.08 Allowed 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 121.532 1.488 . . . . 0.0 111.267 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . 0.433 ' C ' ' H ' ' S' ' 96' ' ' LEU . 57.4 t -77.45 -35.76 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -54.84 -10.22 0.44 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.904 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . 0.433 ' H ' ' C ' ' S' ' 94' ' ' VAL . 79.3 mt -103.46 -21.9 13.72 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.205 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.06 -29.04 27.76 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.254 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -94.74 -16.68 22.85 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 10.6 t90 -91.41 -58.87 2.3 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.827 -0.749 . . . . 0.0 111.143 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.467 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -38.41 -34.07 0.12 Allowed 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.467 ' C ' ' O ' ' S' ' 100' ' ' LEU . 31.2 mt-10 -45.43 -38.66 6.26 Favored 'General case' 0 C--N 1.297 -1.713 0 C-N-CA 117.661 -1.616 . . . . 0.0 107.177 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -86.29 -29.43 23.06 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.506 -1.679 . . . . 0.0 112.579 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . . . . . . . . . 4.0 t -83.31 -18.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 116.787 -1.965 . . . . 0.0 111.862 -179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 1.4 tp -101.09 -61.67 1.34 Allowed 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.314 179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 34.9 mt -57.58 -74.57 0.05 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.111 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 40.5 tttt -42.0 -50.66 4.59 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.904 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 43.6 t . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 116.375 -1.774 . . . . 0.0 110.704 179.968 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.523 ' HE1' ' CB ' ' R' ' 81' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 116.306 -1.807 . . . . 0.0 110.47 . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.572 ' N ' ' O ' ' R' ' 40' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 116.362 -1.78 . . . . 0.0 110.25 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.878 0.371 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' R' R ' 5' ' ' SER . . . . . 0.556 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.0 OUTLIER -87.44 -43.99 0.51 Allowed Pre-proline 0 C--N 1.305 -1.339 0 C-N-CA 119.288 -0.965 . . . . 0.0 112.021 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . 0.556 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.9 Cg_endo -72.59 151.4 52.59 Favored 'Trans proline' 0 C--N 1.321 -0.904 0 C-N-CA 121.238 1.292 . . . . 0.0 111.189 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -79.3 104.69 10.09 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.251 -0.979 . . . . 0.0 110.711 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 36.3 t -159.05 -45.02 0.06 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 119.361 -0.935 . . . . 0.0 111.011 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -163.54 140.05 6.96 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.09 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -158.39 -36.06 0.07 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.62 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -148.55 -11.92 0.34 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.562 -0.855 . . . . 0.0 110.677 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -170.47 153.42 4.27 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.799 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -79.42 115.06 18.83 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.36 -0.936 . . . . 0.0 110.737 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -75.7 121.79 23.04 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.83 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 -85.83 76.1 9.94 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.06 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -159.08 -15.89 0.06 Allowed 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.565 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.407 ' O ' ' C ' ' R' ' 18' ' ' GLU . 9.7 tt0 -86.23 -85.7 0.15 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.879 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . 0.407 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.4 OUTLIER -45.27 -34.32 2.82 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.628 1.204 . . . . 0.0 108.122 179.762 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CH2' ' CD ' ' S' ' 47' ' ' GLU . 22.7 t-105 -55.04 -55.13 34.36 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.151 -1.84 . . . . 0.0 108.59 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . 0.458 ' C ' ' CD1' ' R' ' 20' ' ' LEU . 2.4 tm? -57.25 -38.68 74.21 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.432 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.512 ' O ' ' C ' ' R' ' 22' ' ' PHE . 17.7 mmt180 -50.42 -73.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.416 -1.314 . . . . 0.0 110.553 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.512 ' C ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t80 -31.02 -41.91 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.087 -1.045 . . . . 0.0 111.842 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' R' ' 21' ' ' ARG . 10.9 t -69.76 -57.91 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.403 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -39.71 -60.21 1.02 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.633 -0.827 . . . . 0.0 111.522 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . 0.528 ' CD2' ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -52.72 -53.01 53.68 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.234 -1.386 . . . . 0.0 109.585 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.2 tt -39.83 -64.43 0.49 Allowed 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.351 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . 0.625 ' NZ ' ' CD1' ' S' ' 30' ' ' TYR . 0.4 OUTLIER -53.44 -76.11 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.868 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . 0.434 ' H ' HD21 ' R' ' 28' ' ' ASN . 5.5 m-80 -34.85 -49.33 0.43 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -63.48 -55.35 24.78 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.409 -0.916 . . . . 0.0 113.078 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 4.9 t80 -40.7 -37.62 0.77 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.774 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -47.37 -43.8 23.55 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.792 -1.163 . . . . 0.0 109.951 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -95.62 -78.25 0.46 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.9 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 169.81 24.71 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.965 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 1.0 OUTLIER -95.85 -9.66 30.92 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.074 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -54.02 -30.85 49.27 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.476 -179.639 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.456 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 9.0 mt -68.28 -58.69 7.08 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 117.878 -1.529 . . . . 0.0 110.318 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.6 Cg_exo -55.18 -43.28 60.54 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 120.563 0.842 . . . . 0.0 110.685 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.49 -43.45 98.84 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.651 0.739 . . . . 0.0 110.387 179.914 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . 0.408 ' C ' ' H ' ' R' ' 41' ' ' LEU . 0.1 OUTLIER -52.3 -48.43 65.37 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.141 179.787 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.57 -5.85 0.25 Allowed 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.656 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . 0.408 ' H ' ' C ' ' R' ' 39' ' ' LEU . 7.9 mp -102.58 -60.18 1.58 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.726 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.14 50.98 1.19 Allowed 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 118.715 -1.194 . . . . 0.0 109.399 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER 173.22 144.89 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.561 -1.199 . . . . 0.0 108.057 -179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -169.21 -43.42 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 115.396 -2.522 . . . . 0.0 117.051 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -104.2 -98.19 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 115.338 1.246 . . . . 0.0 115.338 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.84 -26.19 2.28 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.833 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . 0.417 ' OE2' ' NH2' ' S' ' 54' ' ' ARG . 6.6 mm-40 -51.8 -66.18 0.43 Allowed 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.858 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mmm-85 -58.19 -38.45 76.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.79 -0.764 . . . . 0.0 112.009 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -71.6 -67.18 0.54 Allowed 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.928 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.423 ' O ' ' NE ' ' R' ' 54' ' ' ARG . . . -47.9 -30.28 4.03 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.994 -0.683 . . . . 0.0 112.731 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 4.6 mp -63.88 -67.43 0.43 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 119.237 -0.985 . . . . 0.0 111.65 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.74 -29.55 4.3 Favored Glycine 0 N--CA 1.487 2.089 0 C-N-CA 118.982 -1.58 . . . . 0.0 110.233 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.462 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -65.1 -81.69 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.803 -179.986 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . 0.423 ' NE ' ' O ' ' R' ' 50' ' ' ALA . 10.7 ptp180 -43.31 -43.9 5.21 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.733 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.2 t -62.8 -30.43 49.42 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 C-N-CA 118.341 -1.344 . . . . 0.0 110.296 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' R' ' 53' ' ' THR . 21.1 mtp85 -79.53 -39.62 31.52 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.08 -1.048 . . . . 0.0 111.357 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.513 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.47 -32.77 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 117.008 -1.877 . . . . 0.0 108.289 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.513 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 2.7 t -59.23 -61.21 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 118.75 -1.18 . . . . 0.0 108.484 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -52.12 -30.93 28.61 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.962 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.18 -33.08 75.15 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.416 -0.913 . . . . 0.0 111.471 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . 0.457 ' C ' ' CD1' ' R' ' 61' ' ' LEU . 0.4 OUTLIER -75.1 -28.93 60.47 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.731 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.67 -18.27 58.9 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.677 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' R' ' 65' ' ' GLU . 10.0 ttt180 -117.92 25.97 9.99 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.113 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' R' ' 65' ' ' GLU . . . -40.6 -20.91 0.03 OUTLIER Glycine 0 N--CA 1.493 2.443 0 C-N-CA 120.067 -1.063 . . . . 0.0 111.115 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.535 ' N ' ' O ' ' R' ' 63' ' ' ARG . 4.8 mt-10 -42.09 -30.36 0.28 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.508 -0.877 . . . . 0.0 110.715 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 19.6 mtp -142.29 80.9 1.72 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.696 -0.802 . . . . 0.0 110.582 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 172.72 82.2 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.789 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.551 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.4 OUTLIER -121.82 -38.51 2.73 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.509 179.997 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -75.29 26.89 0.1 Allowed 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 120.209 -0.596 . . . . 0.0 110.943 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.551 ' H ' ' C ' ' R' ' 68' ' ' GLN . 7.7 pt-20 -83.55 25.79 0.73 Allowed 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.02 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -43.14 161.0 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.276 -0.969 . . . . 0.0 110.633 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . 0.415 ' C ' ' H ' ' R' ' 74' ' ' GLU . 4.6 pttp -69.18 130.11 41.74 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.399 -0.92 . . . . 0.0 111.699 -179.843 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . 0.562 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.2 OUTLIER -90.25 17.85 6.67 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 122.1 0.952 . . . . 0.0 109.337 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . 0.415 ' H ' ' C ' ' R' ' 72' ' ' LYS . 9.1 pt-20 38.91 17.37 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.997 -1.91 . . . . 0.0 112.256 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . 0.562 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.3 tp -126.98 -14.1 5.61 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.595 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -100.41 -65.79 0.81 Allowed Glycine 0 N--CA 1.492 2.392 0 C-N-CA 119.764 -1.208 . . . . 0.0 110.959 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.53 -103.91 0.26 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.869 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 172.73 158.54 17.27 Favored Glycine 0 N--CA 1.492 2.407 0 C-N-CA 118.994 -1.574 . . . . 0.0 111.069 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.447 ' O ' ' OG1' ' R' ' 83' ' ' THR . 0.1 OUTLIER -36.59 -27.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 CA-C-N 115.345 -0.428 . . . . 0.0 111.753 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.518 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -65.35 -78.39 0.05 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.401 -0.92 . . . . 0.0 112.683 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -37.47 -31.31 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -179.724 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 22.1 pt -87.06 -28.91 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 C-N-CA 118.418 -1.313 . . . . 0.0 112.85 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.464 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -54.63 -63.69 1.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 118.343 -1.343 . . . . 0.0 110.605 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . 0.725 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -62.58 -24.86 67.77 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 119.323 -0.951 . . . . 0.0 110.312 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.05 4.3 3.43 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.331 -1.414 . . . . 0.0 109.76 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 86' ' ' SER . . . . . 0.514 ' H ' ' C ' ' R' ' 84' ' ' ARG . 33.9 t -138.77 -43.54 0.48 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.618 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -92.96 10.33 31.75 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -42.21 -40.15 2.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.297 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.13 -74.85 0.06 Allowed 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.664 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' R' ' 91' ' ' ALA . 10.9 tptm -41.1 -50.07 3.43 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.525 0.678 . . . . 0.0 111.761 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.64 -62.32 0.36 Allowed 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 113.911 -1.495 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . 0.429 ' O ' ' N ' ' R' ' 94' ' ' VAL . . . -174.34 -54.21 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 118.514 -1.274 . . . . 0.0 113.241 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -57.25 89.38 0.05 OUTLIER 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 120.196 0.597 . . . . 0.0 111.0 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . 0.429 ' N ' ' O ' ' R' ' 92' ' ' ALA . 61.8 t -110.65 -45.59 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.442 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -67.73 -18.1 64.78 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.291 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.15 -43.45 61.24 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.943 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -35.57 59.62 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.296 -0.961 . . . . 0.0 110.707 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.47 -23.18 5.71 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.503 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 5.8 t90 -106.29 -62.19 1.42 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.179 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.471 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -40.74 -30.85 0.13 Allowed 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.104 -1.038 . . . . 0.0 113.704 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.476 ' CG ' ' N ' ' R' ' 102' ' ' GLU . 11.0 pt-20 -46.46 -36.32 6.5 Favored 'General case' 0 C--N 1.297 -1.712 0 C-N-CA 117.529 -1.669 . . . . 0.0 107.121 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.476 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 3.6 mt-10 -91.37 -28.45 17.69 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-N 113.235 -1.802 . . . . 0.0 112.282 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.1 t -93.15 -1.34 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 117.601 -1.64 . . . . 0.0 110.67 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . 0.434 ' N ' ' O ' ' R' ' 100' ' ' LEU . 26.4 tp -105.6 -51.55 2.98 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.757 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . 0.451 ' C ' ' CD2' ' R' ' 105' ' ' LEU . 0.1 OUTLIER -72.79 -10.15 59.47 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 119.285 -0.966 . . . . 0.0 111.18 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . 0.417 ' O ' ' OG ' ' R' ' 107' ' ' SER . 0.0 OUTLIER -53.27 -19.74 3.51 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.015 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' R' R ' 107' ' ' SER . . . . . 0.43 ' OG ' ' O ' ' R' ' 107' ' ' SER . 91.8 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 116.379 -1.772 . . . . 0.0 111.027 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.916 0.389 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 38.7 t -171.45 67.61 0.45 Allowed Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.146 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -66.23 164.65 27.18 Favored 'Trans proline' 0 C--N 1.314 -1.282 0 C-N-CA 121.612 1.542 . . . . 0.0 111.343 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -166.82 -8.4 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.689 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 9.8 t -83.35 84.68 7.42 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.711 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.2 173.18 5.9 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.909 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.91 121.48 9.39 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.834 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 8.5 mmt -92.31 -17.66 24.43 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.1 130.88 37.72 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.929 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -88.17 -177.49 5.72 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.49 -0.884 . . . . 0.0 110.759 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -161.17 75.14 0.5 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.298 -0.961 . . . . 0.0 111.112 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 -164.98 -1.37 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.589 -0.844 . . . . 0.0 110.442 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.82 -20.21 0.41 Allowed 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.043 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.453 ' C ' ' N ' ' S' ' 19' ' ' TRP . 0.9 OUTLIER -92.51 -82.99 0.31 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.389 179.808 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -45.4 -29.32 1.05 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.822 1.296 . . . . 0.0 108.194 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . 0.453 ' N ' ' C ' ' S' ' 17' ' ' GLN . 24.4 t-105 -58.62 -59.87 4.72 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 112.862 -1.972 . . . . 0.0 109.911 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . 0.471 ' C ' ' CD1' ' S' ' 20' ' ' LEU . 0.3 OUTLIER -58.99 -19.03 39.7 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.968 -1.469 . . . . 0.0 111.081 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' S' ' 22' ' ' PHE . 12.1 mmt180 -67.82 -65.14 0.73 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.003 -1.479 . . . . 0.0 108.974 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.438 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.6 t80 -39.5 -41.69 1.03 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.303 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 85.5 t -71.09 -48.36 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.794 179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -40.28 -64.44 0.51 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.492 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . 0.508 ' C ' ' H ' ' S' ' 27' ' ' LYS . 1.9 mt -53.02 -53.4 50.64 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 118.73 -1.188 . . . . 0.0 109.184 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.68 -1.08 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.297 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . 0.508 ' H ' ' C ' ' S' ' 25' ' ' LEU . 25.0 tttm -88.05 -68.48 0.76 Allowed 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.389 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.88 -3.2 50.46 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.363 -0.935 . . . . 0.0 112.139 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.32 -53.27 10.01 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.919 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . 0.625 ' CD1' ' NZ ' ' R' ' 27' ' ' LYS . 14.6 t80 -41.65 -42.14 2.42 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.25 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -45.58 -42.3 10.96 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.57 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.414 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 0.0 OUTLIER -97.37 -77.65 0.49 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.177 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' S' ' 32' ' ' ASN . 0.5 OUTLIER 169.66 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 0.8 OUTLIER -92.82 -15.35 26.61 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.062 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -51.15 -20.75 1.63 Allowed 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.186 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.466 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.0 mt -80.21 -65.03 0.29 Allowed Pre-proline 0 C--N 1.306 -1.302 0 C-N-CA 118.335 -1.346 . . . . 0.0 110.647 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.526 ' O ' ' ND2' ' S' ' 40' ' ' ASN . 2.6 Cg_endo -51.88 -21.32 11.64 Favored 'Trans proline' 0 C--N 1.32 -0.938 0 N-CA-C 109.775 -0.894 . . . . 0.0 109.775 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 49.1 mt -79.87 -38.7 32.13 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.609 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.3 OUTLIER -59.7 -24.75 64.23 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.758 179.696 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . 0.526 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.0 OUTLIER -97.06 10.37 39.49 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.744 179.747 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tp -108.47 -67.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -99.33 36.79 1.67 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 119.019 -1.073 . . . . 0.0 112.143 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' S' ' 39' ' ' LEU . 24.1 tp 172.74 146.04 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.449 ' CB ' ' O ' ' S' ' 43' ' ' LEU . 0.7 OUTLIER 177.98 -46.94 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 117.169 -1.812 . . . . 0.0 114.921 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.487 ' C ' ' N ' ' S' ' 47' ' ' GLU . 6.0 Cg_endo -68.42 -83.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 120.361 0.707 . . . . 0.0 111.584 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . 0.508 ' N ' ' OD1' ' S' ' 46' ' ' ASP . 3.0 p-10 -49.73 -14.42 0.13 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 119.005 -1.078 . . . . 0.0 109.715 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . 0.487 ' N ' ' C ' ' S' ' 45' ' ' PRO . 10.5 tt0 -71.77 -74.94 0.14 Allowed 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.281 -0.967 . . . . 0.0 111.284 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.77 -25.03 0.15 Allowed 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 119.592 -0.843 . . . . 0.0 110.945 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' O ' ' S' ' 47' ' ' GLU . 4.2 mm-40 -100.51 -65.03 0.99 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.978 -1.089 . . . . 0.0 112.786 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . 0.466 ' CB ' ' O ' ' S' ' 46' ' ' ASP . . . -61.82 -42.19 98.71 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.075 -1.05 . . . . 0.0 112.985 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 1.8 tp -54.45 -49.73 69.36 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.761 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.82 -35.76 83.9 Favored Glycine 0 N--CA 1.492 2.373 0 C-N-CA 118.797 -1.668 . . . . 0.0 109.744 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.467 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -64.83 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 115.006 -0.597 . . . . 0.0 112.563 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.438 ' HB3' ' CE3' ' R' ' 109' ' ' TRP . 4.5 ptt180 -42.41 -29.4 0.27 Allowed 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.834 -0.746 . . . . 0.0 112.393 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.7 t -76.47 -31.78 20.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 117.817 -1.553 . . . . 0.0 109.407 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' S' ' 53' ' ' THR . 10.8 mtp180 -63.6 -46.7 84.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 118.894 -1.123 . . . . 0.0 109.825 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -71.68 -57.33 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 C-N-CA 118.024 -1.47 . . . . 0.0 110.219 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 84.8 t -47.26 -64.58 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 C-N-CA 118.288 -1.365 . . . . 0.0 111.459 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.63 -28.72 22.6 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.48 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -80.94 -47.24 13.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 118.474 -1.29 . . . . 0.0 112.789 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 pp -70.09 -5.23 25.42 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 117.859 -1.536 . . . . 0.0 110.613 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -71.06 -61.97 1.57 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.429 179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -118.61 -22.62 7.41 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.508 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.605 ' O ' ' N ' ' S' ' 66' ' ' MET . . . -91.25 28.42 8.13 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . 0.446 ' C ' ' O ' ' S' ' 64' ' ' GLY . 2.2 mt-10 -24.58 -35.84 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 O-C-N 124.62 0.835 . . . . 0.0 112.187 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 66' ' ' MET . . . . . 0.605 ' N ' ' O ' ' S' ' 64' ' ' GLY . 13.5 mmt -56.72 147.15 23.6 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.771 179.778 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -173.31 83.14 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 118.263 -1.375 . . . . 0.0 110.949 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -125.76 -32.42 2.84 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.649 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.61 18.83 3.7 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.663 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.433 ' O ' ' C ' ' S' ' 71' ' ' LEU . 2.8 mm-40 -125.91 -74.0 0.61 Allowed 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.15 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . 0.433 ' C ' ' O ' ' S' ' 70' ' ' GLU . 2.9 tp 38.79 -149.73 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.439 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.33 149.87 24.97 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.495 -0.882 . . . . 0.0 109.304 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . 0.484 ' CG ' ' N ' ' S' ' 74' ' ' GLU . 1.1 t-20 -97.25 -95.7 0.21 Allowed 'General case' 0 C--N 1.297 -1.701 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.551 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' S' ' 73' ' ' ASN . 18.2 mt-10 -163.31 -43.1 0.03 OUTLIER 'General case' 0 C--N 1.278 -2.538 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.36 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -114.72 -30.74 6.38 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.56 -1.655 . . . . 0.0 111.181 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -36.79 -73.59 0.12 Allowed Glycine 0 N--CA 1.497 2.745 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.208 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . 0.542 ' O ' ' O ' ' S' ' 78' ' ' GLY . . . -166.69 64.8 0.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.075 -1.05 . . . . 0.0 111.429 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' S' ' 77' ' ' ALA . . . 29.96 -162.89 0.0 OUTLIER Glycine 0 N--CA 1.5 2.928 0 CA-C-N 114.933 -1.031 . . . . 0.0 112.628 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -110.63 -18.92 7.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-N 114.679 -0.761 . . . . 0.0 111.96 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.28 86.27 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.338 -1.345 . . . . 0.0 111.135 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 81' ' ' THR . . . . . 0.602 ' CG2' ' HE1' ' R' ' 109' ' ' TRP . 47.1 m -46.68 -61.94 1.61 Allowed 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 8.0 pt -64.75 -2.58 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.27 -41.62 8.57 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.398 -1.321 . . . . 0.0 113.511 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -62.95 -12.98 29.2 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -99.75 25.52 27.94 Favored Glycine 0 N--CA 1.5 2.921 0 C-N-CA 119.148 -1.501 . . . . 0.0 111.023 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -119.44 -31.34 4.64 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.432 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . 0.433 ' ND2' ' N ' ' S' ' 87' ' ' ASN . 0.0 OUTLIER -100.08 -21.01 15.75 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.689 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.35 -23.59 0.97 Allowed 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.683 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 34.9 mt -63.65 -39.01 93.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.361 -0.935 . . . . 0.0 112.113 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.76 -28.32 17.46 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 118.666 -1.214 . . . . 0.0 111.282 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -43.47 -57.77 2.93 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 114.972 -1.013 . . . . 0.0 112.888 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . 0.519 ' O ' ' N ' ' S' ' 94' ' ' VAL . . . -158.8 -58.79 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.766 0 C-N-CA 118.556 -1.258 . . . . 0.0 114.014 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . 0.464 ' HD2' ' H ' ' S' ' 92' ' ' ALA . 6.5 Cg_exo -45.98 89.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.325 -0.684 0 C-N-CA 120.607 0.871 . . . . 0.0 112.224 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . 0.519 ' N ' ' O ' ' S' ' 92' ' ' ALA . 2.4 t -111.2 -28.83 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.479 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.19 -25.31 68.28 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.91 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' S' ' 97' ' ' ARG . 8.7 mp -45.91 -48.78 16.12 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.746 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' S' ' 96' ' ' LEU . 0.3 OUTLIER -42.64 -47.14 5.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.57 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -61.28 -46.11 91.71 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.915 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . 0.409 ' O ' ' N ' ' S' ' 102' ' ' GLU . 9.6 t90 -74.42 -62.04 1.66 Allowed 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.925 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.473 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -34.64 -39.67 0.09 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' S' ' 100' ' ' LEU . 2.0 mm-40 -42.27 -42.87 3.23 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.048 -1.461 . . . . 0.0 107.135 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.409 ' N ' ' O ' ' S' ' 99' ' ' TRP . 3.3 mt-10 -82.86 -27.06 31.03 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.894 -179.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . . . . . . . . . 8.0 t -83.4 -39.14 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 C-N-CA 116.66 -2.016 . . . . 0.0 112.962 -179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.55 -50.17 7.03 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 118.743 -1.183 . . . . 0.0 111.35 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . 0.458 ' H ' HD21 ' S' ' 105' ' ' LEU . 1.0 OUTLIER -87.15 11.74 13.25 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.913 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' S' ' 105' ' ' LEU . 21.2 tttm -32.3 -41.87 0.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.598 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.873 -179.977 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.501 ' N ' ' O ' ' S' ' 40' ' ' ASN . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 116.285 -1.817 . . . . 0.0 110.247 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.602 ' HE1' ' CG2' ' S' ' 81' ' ' THR . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 116.459 -1.734 . . . . 0.0 109.438 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.802 0.334 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.88 165.45 14.58 Favored Pre-proline 0 N--CA 1.489 1.487 0 C-N-CA 119.752 -0.779 . . . . 0.0 110.836 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . 0.49 ' O ' ' N ' ' R' ' 8' ' ' SER . 3.0 Cg_exo -54.75 124.56 16.51 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 121.477 1.452 . . . . 0.0 112.453 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 58.27 -76.02 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.788 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 8' ' ' SER . . . . . 0.49 ' N ' ' O ' ' R' ' 6' ' ' PRO . 0.7 OUTLIER -166.7 -59.23 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 118.242 -1.383 . . . . 0.0 112.481 -179.967 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -127.35 111.11 13.51 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.96 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -83.15 -172.98 4.44 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.301 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 32.3 mmm -59.81 -108.27 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.582 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -171.11 -102.65 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.508 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -128.13 -81.22 0.59 Allowed 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.296 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -66.32 165.24 14.41 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.319 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -176.08 -32.73 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 119.196 -1.002 . . . . 0.0 110.825 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 9.75 10.39 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.125 -1.03 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.425 ' C ' ' N ' ' R' ' 19' ' ' TRP . 6.2 tt0 -85.7 -84.36 0.16 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.66 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -44.63 -30.84 0.99 Allowed 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 122.897 1.332 . . . . 0.0 109.008 179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . 0.425 ' N ' ' C ' ' R' ' 17' ' ' GLN . 54.3 t-105 -55.12 -56.75 16.33 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.804 -1.998 . . . . 0.0 109.059 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.3 tp -51.85 -38.16 54.87 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.898 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' R' ' 22' ' ' PHE . 21.9 mtp180 -56.82 -64.34 0.91 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.781 -1.168 . . . . 0.0 111.195 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.474 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -35.82 -48.12 0.54 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 118.813 -1.155 . . . . 0.0 111.435 179.71 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . 0.471 ' O ' ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -76.61 -68.44 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.975 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 9.0 t70 -39.84 -28.49 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.112 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . 0.471 ' N ' ' O ' ' R' ' 23' ' ' VAL . 10.2 tp -77.73 -56.77 4.24 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.347 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 tt -41.09 -59.43 1.49 Allowed 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . 0.426 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.1 OUTLIER -54.45 -60.9 2.72 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.287 -0.965 . . . . 0.0 111.088 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -43.21 -24.29 0.08 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.401 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -97.9 -31.89 11.96 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.197 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -50.73 -38.08 45.45 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 118.794 -1.163 . . . . 0.0 110.105 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -27.37 69.09 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.082 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . 0.437 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.4 m120 -101.61 -10.15 20.32 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.087 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . 0.437 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.5 m-20 75.71 17.32 2.35 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.413 0.625 . . . . 0.0 110.291 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -85.27 -15.33 43.81 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.621 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 9.5 p-80 -52.24 -13.94 0.39 Allowed 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.797 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 8.2 mt -79.27 -66.01 0.28 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 117.504 -1.679 . . . . 0.0 110.147 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.2 Cg_endo -53.98 -26.97 42.92 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 N-CA-C 109.501 -1.0 . . . . 0.0 109.501 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 1.5 tp -77.48 -35.53 53.6 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.947 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.68 -33.74 64.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.602 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -74.64 5.18 5.12 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.256 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mt -113.23 -58.08 2.2 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 119.817 -0.753 . . . . 0.0 112.812 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.91 36.29 0.72 Allowed 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 118.381 -1.328 . . . . 0.0 112.876 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 165.24 140.64 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 114.719 -1.128 . . . . 0.0 108.591 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.565 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -33.35 0.0 OUTLIER Pre-proline 0 N--CA 1.496 1.838 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.565 ' CD ' ' H ' ' R' ' 44' ' ' THR . 34.9 Cg_endo -88.99 -103.16 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.146 0 C-N-CA 121.054 1.169 . . . . 0.0 112.16 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . 0.562 ' O ' ' N ' ' R' ' 50' ' ' ALA . 0.6 OUTLIER -52.21 -13.56 0.34 Allowed 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.411 -179.883 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . 0.475 ' N ' ' C ' ' R' ' 45' ' ' PRO . 7.1 mm-40 -69.79 -61.67 1.69 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.079 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -21.92 13.14 Favored 'General case' 0 C--N 1.299 -1.604 0 C-N-CA 118.94 -1.104 . . . . 0.0 110.39 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -108.08 -71.68 0.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.595 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.562 ' N ' ' O ' ' R' ' 46' ' ' ASP . . . -48.86 -36.99 18.25 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . 0.402 ' HG ' ' N ' ' R' ' 52' ' ' GLY . 0.2 OUTLIER -69.57 -38.67 77.48 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.932 -179.892 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . 0.402 ' N ' ' HG ' ' R' ' 51' ' ' LEU . . . -65.99 -28.14 73.42 Favored Glycine 0 N--CA 1.485 1.901 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.552 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -63.61 -79.45 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.54 -0.83 . . . . 0.0 110.594 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . 0.438 ' C ' ' O ' ' R' ' 53' ' ' THR . 1.2 ptp180 -36.02 -50.5 0.69 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 123.796 0.685 . . . . 0.0 111.286 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.69 -36.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 118.04 -1.464 . . . . 0.0 110.314 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' R' ' 53' ' ' THR . 2.8 mtm180 -75.37 -40.44 58.04 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.533 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.559 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -70.34 -38.99 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 116.869 -1.933 . . . . 0.0 109.532 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.559 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 54.3 t -59.82 -59.28 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 117.73 -1.588 . . . . 0.0 109.33 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.59 -24.73 5.78 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.781 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.77 -50.73 16.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.942 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.89 -31.6 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.368 -0.933 . . . . 0.0 112.562 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tp -43.26 -53.57 5.08 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.327 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -125.21 26.59 6.86 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.51 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . 0.598 ' O ' ' N ' ' R' ' 66' ' ' MET . . . -116.54 29.31 7.01 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.531 ' C ' ' O ' ' R' ' 64' ' ' GLY . 1.7 mt-10 -18.15 -46.24 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 124.244 0.614 . . . . 0.0 111.935 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 66' ' ' MET . . . . . 0.598 ' N ' ' O ' ' R' ' 64' ' ' GLY . 0.6 OUTLIER -67.91 131.96 46.46 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.149 -1.02 . . . . 0.0 108.608 179.798 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 8.0 t -154.12 70.02 0.8 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 117.672 -1.611 . . . . 0.0 111.654 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.436 ' OE1' ' CA ' ' R' ' 68' ' ' GLN . 0.5 OUTLIER -114.64 -44.22 3.09 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.787 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -76.24 27.31 0.12 Allowed 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.641 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.428 ' H ' ' C ' ' R' ' 68' ' ' GLN . 36.1 mt-10 -61.96 -23.73 66.56 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 118.265 -1.374 . . . . 0.0 109.179 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 58.89 109.4 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.35 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . 0.567 ' C ' ' H ' ' R' ' 74' ' ' GLU . 15.6 tttm -98.41 66.82 1.76 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.834 -0.746 . . . . 0.0 110.103 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . 0.619 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.8 OUTLIER -71.81 16.61 0.11 Allowed 'General case' 0 N--CA 1.491 1.592 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.661 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . 0.567 ' H ' ' C ' ' R' ' 72' ' ' LYS . 22.6 mt-10 49.95 -78.58 0.01 OUTLIER 'General case' 0 C--N 1.286 -2.189 0 CA-C-N 114.418 -1.264 . . . . 0.0 111.098 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . 0.619 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.5 mt -56.05 -15.93 4.27 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.417 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . 0.402 ' N ' ' C ' ' R' ' 74' ' ' GLU . . . -60.52 -65.17 3.52 Favored Glycine 0 N--CA 1.49 2.246 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.935 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -134.65 -18.63 1.89 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 119.128 -1.029 . . . . 0.0 112.226 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 87.56 97.34 0.9 Allowed Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.047 -1.549 . . . . 0.0 109.927 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.426 ' C ' ' O ' ' R' ' 78' ' ' GLY . 0.1 OUTLIER -20.71 -44.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.969 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.499 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -50.01 -12.83 0.09 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.285 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 81' ' ' THR . . . . . 0.493 ' HA ' ' HE1' ' R' ' 1' ' ' TRP . 17.0 m -88.95 -51.13 5.78 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -80.5 6.83 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -179.719 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.423 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -105.34 -13.55 15.62 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.649 -1.22 . . . . 0.0 112.737 -179.92 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . 0.619 ' NE ' ' CE3' ' R' ' 1' ' ' TRP . 0.2 OUTLIER -96.73 -33.52 11.68 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.408 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.35 -29.34 2.51 Favored Glycine 0 N--CA 1.484 1.89 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.729 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 86' ' ' SER . . . . . 0.415 ' C ' ' H ' ' R' ' 88' ' ' SER . 0.4 OUTLIER -96.41 -50.69 4.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 118.629 -1.229 . . . . 0.0 112.219 -179.899 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . 0.539 ' N ' ' OD1' ' R' ' 87' ' ' ASN . 0.7 OUTLIER -68.14 5.83 0.87 Allowed 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.651 -0.82 . . . . 0.0 112.489 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' R' R ' 88' ' ' SER . . . . . 0.415 ' H ' ' C ' ' R' ' 86' ' ' SER . 42.5 m -116.45 -46.9 2.76 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.401 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.2 tt -46.65 -36.4 6.98 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.199 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -66.14 -70.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 122.062 0.935 . . . . 0.0 112.393 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 92' ' ' ALA . . . -58.86 -82.52 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 113.813 -1.54 . . . . 0.0 112.781 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 91' ' ' ALA . . . 58.1 150.27 0.07 OUTLIER Pre-proline 0 N--CA 1.492 1.634 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.037 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -54.3 152.88 23.99 Favored 'Trans proline' 0 C--O 1.214 -0.701 0 C-N-CA 121.079 1.186 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 33.5 t -74.51 -61.49 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 C-N-CA 119.36 -0.936 . . . . 0.0 112.992 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.46 -16.98 41.85 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.466 -0.893 . . . . 0.0 112.997 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -79.6 -35.72 39.15 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 118.775 -1.17 . . . . 0.0 111.308 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.85 -24.97 55.8 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 118.892 -1.123 . . . . 0.0 109.918 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -65.69 -19.3 65.85 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.053 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 21.0 t90 -97.16 -55.02 2.98 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.99 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.443 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.0 mm? -39.59 -28.84 0.05 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.02 -1.072 . . . . 0.0 113.542 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' R' ' 100' ' ' LEU . 10.2 mm-40 -47.1 -39.02 12.41 Favored 'General case' 0 C--N 1.292 -1.93 0 C-N-CA 117.717 -1.593 . . . . 0.0 107.519 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -89.47 -28.55 19.61 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 113.936 -1.483 . . . . 0.0 112.415 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 10.4 t -78.82 -34.0 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.16 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.0 -48.86 16.78 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.315 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . 0.529 ' O ' ' N ' ' R' ' 107' ' ' SER . 2.4 tm? -58.05 -44.04 87.22 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.837 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -41.92 -20.18 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.3 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 107' ' ' SER . . . . . 0.529 ' N ' ' O ' ' R' ' 105' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 116.398 -1.763 . . . . 0.0 110.86 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . 0.469 ' H1 ' ' H ' ' S' ' 5' ' ' SER . 37.1 mt-30 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.917 0.389 . . . . 0.0 109.977 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 5' ' ' SER . . . . . 0.574 ' N ' ' CD ' ' S' ' 6' ' ' PRO . 0.0 OUTLIER -93.42 -43.09 0.32 Allowed Pre-proline 0 C--N 1.305 -1.327 0 C-N-CA 119.562 -0.855 . . . . 0.0 112.311 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' S' ' 5' ' ' SER . 4.6 Cg_endo -73.21 -52.99 0.14 Allowed 'Trans proline' 0 C--N 1.32 -0.956 0 C-N-CA 121.038 1.159 . . . . 0.0 111.544 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -54.57 -6.13 0.1 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.993 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 8' ' ' SER . . . . . 0.472 ' H ' ' C ' ' S' ' 6' ' ' PRO . 3.5 m -86.4 105.01 16.43 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 118.989 -1.084 . . . . 0.0 110.895 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . 50.78 93.74 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.78 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.44 110.98 1.6 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.03 -1.068 . . . . 0.0 111.265 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -125.71 -6.79 6.82 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.405 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.7 -3.64 51.45 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.424 -0.91 . . . . 0.0 110.48 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.99 151.57 47.4 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.009 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -63.2 146.21 53.86 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.641 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.9 73.67 0.43 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 119.192 -1.003 . . . . 0.0 110.684 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -117.46 12.6 14.23 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.447 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.478 ' C ' ' N ' ' S' ' 19' ' ' TRP . 1.2 mt-30 -89.62 -81.41 0.28 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.115 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.539 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 3.1 mp0 -42.12 -30.61 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 122.942 1.353 . . . . 0.0 108.158 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . 0.478 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.26 72.2 t-105 -56.44 -56.09 25.5 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.269 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' S' ' 17' ' ' GLN . 5.9 tp -58.87 -27.34 65.08 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.845 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.457 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.9 mtt85 -66.49 -74.42 0.11 Allowed 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.48 -1.288 . . . . 0.0 109.65 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.457 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -36.34 -42.45 0.32 Allowed 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.172 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . 0.416 ' O ' ' C ' ' S' ' 24' ' ' ASP . 3.0 t -69.79 -56.03 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.7 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' S' ' 23' ' ' VAL . 22.6 t0 -35.94 -73.31 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.725 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . 0.402 ' CD2' ' N ' ' S' ' 25' ' ' LEU . 0.1 OUTLIER -49.97 -46.16 52.15 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.584 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 tp -45.18 -30.5 1.19 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.057 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.25 -71.77 0.34 Allowed 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.464 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -50.62 -27.04 6.11 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -78.59 -50.1 12.1 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.94 -179.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . 0.443 ' CD1' ' C ' ' S' ' 30' ' ' TYR . 11.2 t80 -44.55 -38.24 4.07 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.247 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -46.38 -37.23 7.29 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.711 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.65 -79.34 0.54 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.788 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 172.73 35.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.953 0.882 . . . . 0.0 109.322 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -100.95 -19.37 15.9 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.767 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -57.08 -17.98 12.58 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.544 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.2 mt -76.84 -63.33 0.54 Allowed Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 118.263 -1.375 . . . . 0.0 110.304 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 5.4 Cg_exo -50.98 -32.0 36.66 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 N-CA-C 109.863 -0.861 . . . . 0.0 109.863 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 mt -67.85 -43.54 79.25 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . 0.458 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.3 OUTLIER -54.78 -34.06 62.17 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.101 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -83.89 10.69 9.1 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.81 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.38 -63.58 1.39 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.929 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mtt -91.39 33.58 0.99 Allowed 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.709 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . 0.458 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.6 OUTLIER 164.91 142.23 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 O-C-N 123.439 0.462 . . . . 0.0 110.021 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.503 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.25 -42.41 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.313 0 C-N-CA 117.196 -1.802 . . . . 0.0 115.238 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.503 ' HD2' ' H ' ' S' ' 44' ' ' THR . 16.0 Cg_endo -76.64 -110.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 121.12 1.213 . . . . 0.0 113.403 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . 0.428 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 1.0 OUTLIER -51.28 -16.95 0.6 Allowed 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.49 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . 0.401 ' N ' ' C ' ' S' ' 45' ' ' PRO . 5.9 mm-40 -65.76 -66.99 0.48 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.016 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -51.82 -42.2 62.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.113 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.08 -68.9 0.31 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.051 -1.06 . . . . 0.0 112.208 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.44 -22.57 21.01 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.191 -1.004 . . . . 0.0 111.257 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 5.7 tt -67.68 -53.27 29.08 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.87 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.69 -52.1 52.67 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.684 -1.766 . . . . 0.0 108.684 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.551 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.1 OUTLIER -39.83 -74.46 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.982 0.896 . . . . 0.0 111.071 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.536 ' HE ' ' CG2' ' S' ' 55' ' ' VAL . 0.0 OUTLIER -41.76 -39.03 1.61 Allowed 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 113.868 -1.514 . . . . 0.0 112.638 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . 0.536 ' CG2' ' HE ' ' S' ' 54' ' ' ARG . 13.4 t -73.6 -27.68 23.63 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 C-N-CA 117.874 -1.53 . . . . 0.0 108.209 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.1 OUTLIER -80.97 -35.28 32.33 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.91 -1.041 . . . . 0.0 112.306 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . 0.524 ' CD1' ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -73.08 -35.98 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 116.662 -2.015 . . . . 0.0 106.997 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . 0.524 ' N ' ' CD1' ' S' ' 57' ' ' ILE . 9.9 t -62.25 -63.32 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 C-N-CA 118.68 -1.208 . . . . 0.0 109.536 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -50.57 -32.01 17.41 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.926 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -73.76 -54.17 8.65 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.859 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 15.6 mt -46.68 -26.5 0.93 Allowed 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.934 -1.106 . . . . 0.0 109.903 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.16 -35.62 64.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.841 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . 0.485 ' O ' ' N ' ' S' ' 65' ' ' GLU . 7.8 mtt-85 -117.36 25.81 10.19 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.167 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.414 ' O ' ' C ' ' S' ' 65' ' ' GLU . . . -43.84 -18.89 0.09 OUTLIER Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.754 -1.212 . . . . 0.0 111.165 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . 0.485 ' N ' ' O ' ' S' ' 63' ' ' ARG . 1.0 OUTLIER -39.79 -42.78 1.33 Allowed 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.767 -0.773 . . . . 0.0 111.277 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 82.3 mmm -57.14 -99.48 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.885 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 4.1 t -178.76 78.97 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.586 -0.846 . . . . 0.0 109.37 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.656 ' C ' ' H ' ' S' ' 70' ' ' GLU . 1.3 pp0? -112.17 -15.45 13.22 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.922 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.08 25.93 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.738 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.656 ' H ' ' C ' ' S' ' 68' ' ' GLN . 49.2 mt-10 -126.29 4.23 7.03 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.698 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mt -79.77 14.39 1.75 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 118.819 -1.152 . . . . 0.0 110.541 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 tttm -69.45 87.84 0.46 Allowed 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 118.289 -1.365 . . . . 0.0 110.561 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . 0.533 ' O ' ' N ' ' S' ' 75' ' ' LEU . 1.0 OUTLIER -110.16 21.73 16.4 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.885 0.85 . . . . 0.0 110.088 -179.947 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 58.69 -66.64 0.03 OUTLIER 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 112.901 -1.954 . . . . 0.0 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' S' ' 73' ' ' ASN . 4.0 mt -75.1 -15.5 60.6 Favored 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.957 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -74.46 -28.54 63.42 Favored Glycine 0 N--CA 1.491 2.317 0 C-N-CA 119.635 -1.269 . . . . 0.0 110.868 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -159.85 -77.65 0.06 Allowed 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.727 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' S' ' 81' ' ' THR . . . 140.85 109.76 0.8 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.618 -1.793 . . . . 0.0 108.618 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.498 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -29.46 -45.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -179.777 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.54 -46.84 87.7 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.982 -1.087 . . . . 0.0 111.077 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 81' ' ' THR . . . . . 0.471 ' N ' ' O ' ' S' ' 78' ' ' GLY . 61.0 m -53.57 -45.01 69.78 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 pt -84.74 10.15 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 118.71 -1.196 . . . . 0.0 113.986 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.522 ' C ' ' H ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -108.06 -52.71 2.73 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.324 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -63.17 0.38 0.63 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.466 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . 0.522 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -70.86 -9.82 66.74 Favored Glycine 0 N--CA 1.487 2.038 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.212 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 86' ' ' SER . . . . . 0.493 ' C ' ' H ' ' S' ' 88' ' ' SER . 9.4 p -126.72 -42.92 1.74 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.028 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . 0.436 ' N ' ' OG ' ' S' ' 86' ' ' SER . 0.9 OUTLIER -57.95 -7.19 0.7 Allowed 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.026 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.493 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -66.29 -31.16 71.8 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.946 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 4.5 mt -45.68 -28.27 0.97 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.018 -1.073 . . . . 0.0 109.758 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' S' ' 92' ' ' ALA . 60.6 mttt -92.25 -75.73 0.48 Allowed 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.122 0.963 . . . . 0.0 110.385 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -40.21 -27.08 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.921 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . 0.444 ' N ' ' O ' ' S' ' 90' ' ' LYS . . . -91.1 149.71 40.41 Favored Pre-proline 0 N--CA 1.489 1.488 0 C-N-CA 118.972 -1.091 . . . . 0.0 111.707 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -54.8 160.68 7.18 Favored 'Trans proline' 0 C--O 1.215 -0.673 0 C-N-CA 121.403 1.402 . . . . 0.0 111.699 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . 0.405 ' C ' ' H ' ' S' ' 96' ' ' LEU . 83.6 t -88.42 -26.57 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 118.774 -1.171 . . . . 0.0 109.63 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -58.87 -8.82 1.5 Allowed 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.732 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' S' ' 94' ' ' VAL . 2.5 mt -66.1 -51.66 55.95 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.817 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.21 -50.38 3.59 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.041 -0.663 . . . . 0.0 111.911 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -55.98 -30.12 61.31 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.837 -0.745 . . . . 0.0 112.791 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . 0.427 ' O ' ' N ' ' S' ' 102' ' ' GLU . 7.8 t90 -86.07 -54.13 4.66 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.808 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.451 ' O ' ' C ' ' S' ' 101' ' ' GLU . 2.1 mm? -40.14 -41.49 1.28 Allowed 'General case' 0 C--N 1.293 -1.871 0 C-N-CA 118.802 -1.159 . . . . 0.0 113.663 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' S' ' 100' ' ' LEU . 4.5 mt-10 -46.11 -30.33 1.86 Allowed 'General case' 0 C--N 1.289 -2.064 0 C-N-CA 118.26 -1.376 . . . . 0.0 108.229 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.427 ' N ' ' O ' ' S' ' 99' ' ' TRP . 3.9 mm-40 -87.79 -39.25 15.05 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.319 -1.31 . . . . 0.0 114.026 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -82.77 -18.8 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 C-N-CA 114.826 -2.749 . . . . 0.0 111.192 -179.829 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -87.28 -50.92 6.26 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.732 179.866 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.77 -53.26 58.81 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.46 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -56.31 -59.94 4.23 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.976 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 116.431 -1.747 . . . . 0.0 110.344 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.619 ' CE3' ' NE ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 116.343 -1.789 . . . . 0.0 109.898 . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.535 ' CZ3' ' HB2' ' S' ' 54' ' ' ARG . 11.6 m95 . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 116.047 -1.93 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 28.9 m -154.42 68.18 5.75 Favored Pre-proline 0 N--CA 1.486 1.359 0 C-N-CA 119.176 -1.01 . . . . 0.0 111.399 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -67.45 145.78 72.25 Favored 'Trans proline' 0 C--N 1.315 -1.233 0 C-N-CA 121.648 1.565 . . . . 0.0 111.2 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.51 150.0 41.87 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.179 -1.008 . . . . 0.0 110.711 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 95.5 p -145.99 73.87 1.35 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.856 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.36 -44.96 93.3 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.813 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.3 -74.95 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.743 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 10.7 ttm 45.59 92.89 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.916 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -176.38 60.61 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.862 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -51.31 -74.99 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.629 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 45.88 91.03 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.225 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -143.2 -40.08 0.32 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.479 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -158.87 27.11 0.22 Allowed 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.604 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -110.44 -79.15 0.58 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -61.41 -30.69 70.72 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 9.6 t-105 -62.02 -55.0 33.73 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.146 -1.843 . . . . 0.0 107.417 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . 0.472 ' C ' ' CD1' ' R' ' 20' ' ' LEU . 1.9 tm? -56.05 -39.67 72.38 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 112.681 -2.054 . . . . 0.0 109.544 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.479 ' O ' ' C ' ' R' ' 22' ' ' PHE . 4.6 mtt-85 -50.47 -69.68 0.11 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 117.858 -1.537 . . . . 0.0 109.044 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.546 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -32.77 -47.05 0.16 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 119.811 -0.755 . . . . 0.0 111.009 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 77.2 t -66.84 -59.23 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.378 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -37.66 -63.47 0.46 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.857 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . 0.529 ' CD2' ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -65.14 -41.94 94.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.253 -1.379 . . . . 0.0 112.205 -179.838 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . 0.449 ' CD1' ' C ' ' R' ' 26' ' ' LEU . 2.8 tm? -47.41 -54.65 10.75 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.145 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . 0.504 ' O ' ' NZ ' ' S' ' 27' ' ' LYS . 0.0 OUTLIER -78.66 -24.35 45.23 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.046 -1.062 . . . . 0.0 112.203 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.71 -14.09 59.0 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.891 -1.124 . . . . 0.0 110.891 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -98.49 -45.85 5.97 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.462 -179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -42.69 -27.4 0.17 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.467 -0.893 . . . . 0.0 110.855 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -56.4 -43.58 79.44 Favored 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.037 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -96.4 -79.66 0.44 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.62 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 172.56 27.74 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.693 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . 0.564 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 0.8 OUTLIER -95.03 -14.27 24.46 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.816 -179.889 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 16.7 p-80 -52.14 -24.84 7.63 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.12 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.438 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -74.33 -62.75 0.95 Allowed Pre-proline 0 C--N 1.301 -1.517 0 C-N-CA 117.965 -1.494 . . . . 0.0 110.538 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.0 Cg_endo -54.31 -22.12 25.42 Favored 'Trans proline' 0 C--N 1.32 -0.949 0 C-N-CA 120.544 0.829 . . . . 0.0 110.469 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.41 -30.13 23.83 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.889 -0.724 . . . . 0.0 110.257 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . 0.487 ' O ' ' CD1' ' R' ' 43' ' ' LEU . 0.1 OUTLIER -64.41 -29.36 70.42 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.166 -1.013 . . . . 0.0 108.393 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . 0.438 ' O ' ' OD1' ' R' ' 40' ' ' ASN . 0.0 OUTLIER -82.23 6.49 16.54 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.495 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 mt -106.91 -55.48 2.32 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 119.975 -0.69 . . . . 0.0 112.509 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -96.65 34.2 1.71 Allowed 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.074 -1.051 . . . . 0.0 112.762 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . 0.487 ' CD1' ' O ' ' R' ' 39' ' ' LEU . 0.7 OUTLIER 169.21 150.41 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 179.893 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 44' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -166.12 -40.94 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 116.152 -2.219 . . . . 0.0 115.898 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -105.99 -98.96 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.121 1.214 . . . . 0.0 113.954 -179.541 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -50.18 -24.35 2.76 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.08 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.33 -48.71 80.1 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 118.78 -1.168 . . . . 0.0 110.087 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ttp180 -66.11 -38.0 87.14 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.977 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -62.59 -70.73 0.19 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.906 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.27 -31.73 1.67 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.223 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 1.1 mp -58.72 -69.68 0.18 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.565 -0.854 . . . . 0.0 110.591 179.973 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.34 -52.59 6.08 Favored Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.697 -1.239 . . . . 0.0 110.104 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.487 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -43.29 -76.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.022 0.915 . . . . 0.0 111.521 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . 0.457 ' C ' ' CD ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -37.72 -49.0 1.12 Allowed 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.518 -1.674 . . . . 0.0 114.176 -179.878 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . 0.456 ' N ' ' HG3' ' R' ' 54' ' ' ARG . 64.0 t -66.28 -23.12 31.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 C-N-CA 117.561 -1.655 . . . . 0.0 109.489 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' R' ' 53' ' ' THR . 3.0 ptt180 -81.64 -39.57 24.21 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.602 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.467 ' C ' ' CD1' ' R' ' 57' ' ' ILE . 0.4 OUTLIER -71.46 -37.75 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 117.545 -1.662 . . . . 0.0 107.185 179.784 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . . . . . . . . . 25.6 t -63.15 -69.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 119.111 -1.035 . . . . 0.0 109.905 179.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 9.2 tt0 -48.43 -21.25 0.51 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.389 -0.924 . . . . 0.0 111.363 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . 0.433 ' O ' ' N ' ' R' ' 64' ' ' GLY . 33.8 mt-10 -76.29 -53.47 8.17 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.186 -1.006 . . . . 0.0 112.814 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pp -62.43 -24.69 67.56 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 118.228 -1.389 . . . . 0.0 111.204 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mt -52.47 -50.42 62.71 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.763 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -117.27 15.01 14.88 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.814 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' R' ' 60' ' ' GLU . . . -100.2 25.89 26.59 Favored Glycine 0 N--CA 1.491 2.314 0 C-N-CA 119.893 -1.146 . . . . 0.0 110.405 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' R' ' 64' ' ' GLY . 3.5 mt-10 -38.89 -31.83 0.07 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.913 -0.715 . . . . 0.0 111.18 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 1.2 mtm -90.87 111.53 22.98 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.402 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 67' ' ' SER . . . . . 0.784 ' H ' HE21 ' R' ' 68' ' ' GLN . 3.4 t 177.49 76.53 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 119.414 -0.914 . . . . 0.0 109.933 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.784 HE21 ' H ' ' R' ' 67' ' ' SER . 6.1 mm-40 -101.82 -65.12 1.0 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.067 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . 0.48 ' O ' ' CD ' ' R' ' 69' ' ' ARG . 0.0 OUTLIER -83.36 24.04 0.86 Allowed 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 122.49 1.138 . . . . 0.0 109.392 179.885 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.503 ' H ' ' C ' ' R' ' 68' ' ' GLN . 5.4 mt-10 -125.79 25.02 6.98 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.894 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . 0.455 ' CD1' ' O ' ' R' ' 68' ' ' GLN . 1.0 OUTLIER -62.92 -139.04 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.973 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -46.99 144.1 2.66 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.754 -0.778 . . . . 0.0 111.204 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . 0.574 ' O ' ' N ' ' R' ' 75' ' ' LEU . 1.3 t30 -119.61 14.57 12.7 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 122.073 0.94 . . . . 0.0 109.128 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 39.61 15.16 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.015 0 CA-C-N 112.971 -1.922 . . . . 0.0 112.4 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . 0.574 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.8 mt -127.66 -40.43 1.75 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.715 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -75.3 -69.02 1.45 Allowed Glycine 0 N--CA 1.491 2.339 0 C-N-CA 119.622 -1.275 . . . . 0.0 111.315 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -138.53 -104.98 0.18 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 119.435 -0.906 . . . . 0.0 111.303 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 146.44 9.03 Favored Glycine 0 N--CA 1.488 2.156 0 C-N-CA 119.525 -1.322 . . . . 0.0 110.751 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.488 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -39.84 -36.64 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.642 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.531 ' O ' ' NE ' ' R' ' 84' ' ' ARG . . . -52.75 -37.11 58.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.672 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 81' ' ' THR . . . . . 0.541 ' CG2' ' N ' ' R' ' 82' ' ' ILE . 3.9 t -68.81 -50.9 46.31 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.388 -0.925 . . . . 0.0 113.129 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . 0.541 ' N ' ' CG2' ' R' ' 81' ' ' THR . 12.2 pt -73.09 10.69 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.334 -1.346 . . . . 0.0 112.447 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -93.52 -68.25 0.81 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.801 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . 0.692 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.51 -23.57 10.78 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.63 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.72 -50.17 55.02 Favored Glycine 0 N--CA 1.49 2.283 0 C-N-CA 119.422 -1.37 . . . . 0.0 110.331 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 56.1 m -93.65 -26.27 17.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -86.07 3.66 41.48 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.435 -0.906 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -26.04 59.73 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.703 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.77 -30.34 61.11 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.146 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.24 -51.69 3.07 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.306 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.18 0.11 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.537 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -96.74 163.99 19.06 Favored Pre-proline 0 N--CA 1.489 1.518 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.583 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -49.37 152.55 5.66 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 C-N-CA 121.438 1.425 . . . . 0.0 111.507 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.54 10.52 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 119.933 -0.707 . . . . 0.0 111.409 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.62 -11.69 58.74 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.188 -1.005 . . . . 0.0 111.619 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 pp -97.37 -32.9 11.63 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.359 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.39 -29.17 3.74 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.212 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -82.77 -42.03 18.45 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.788 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 10.0 t90 -62.23 -60.01 4.2 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.602 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.28 -26.5 0.06 Allowed 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.127 -1.029 . . . . 0.0 113.244 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.452 ' C ' ' O ' ' R' ' 100' ' ' LEU . 2.1 mm-40 -48.62 -38.9 22.19 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 117.412 -1.715 . . . . 0.0 106.563 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -88.65 -28.78 20.4 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 113.26 -1.791 . . . . 0.0 112.276 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.2 t -91.22 -3.45 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 117.489 -1.684 . . . . 0.0 110.813 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' R' ' 100' ' ' LEU . 29.3 tp -101.33 -51.79 3.4 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.692 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . 0.489 ' C ' ' CD1' ' R' ' 105' ' ' LEU . 0.5 OUTLIER -66.17 -26.57 67.48 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 118.905 -1.118 . . . . 0.0 110.525 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -81.07 -2.21 47.29 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.553 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.304 -1.38 0 CA-C-O 116.319 -1.8 . . . . 0.0 110.644 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.864 0.364 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 4.8 m 46.8 68.9 3.04 Favored Pre-proline 0 N--CA 1.486 1.366 0 C-N-CA 119.405 -0.918 . . . . 0.0 111.285 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . 0.484 ' O ' ' N ' ' S' ' 8' ' ' SER . 2.3 Cg_endo -65.55 -24.14 56.48 Favored 'Trans proline' 0 C--N 1.314 -1.263 0 C-N-CA 121.587 1.525 . . . . 0.0 111.366 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 15.6 t80 61.37 -75.22 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.171 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 8' ' ' SER . . . . . 0.484 ' N ' ' O ' ' S' ' 6' ' ' PRO . 10.9 t 51.35 91.48 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.857 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -171.65 -70.31 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.863 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -156.33 129.91 8.29 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.636 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 4.1 mmt -85.95 148.77 25.61 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.04 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . 60.39 179.86 0.1 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.802 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -48.95 151.27 1.28 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.833 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . 0.429 ' O ' ' O ' ' S' ' 15' ' ' ARG . 38.4 mt-30 -65.1 -45.06 86.77 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.41 -0.916 . . . . 0.0 110.711 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' S' ' 14' ' ' GLN . 9.7 mtt180 50.7 102.54 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.431 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -133.68 -4.28 2.9 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' S' ' 18' ' ' GLU . 5.6 mt-30 -87.78 -84.19 0.2 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.977 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.403 ' C ' ' O ' ' S' ' 17' ' ' GLN . 3.1 mp0 -45.54 -35.26 3.78 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -44.44 -53.93 6.43 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.564 -1.653 . . . . 0.0 108.685 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . 0.415 ' O ' ' C ' ' S' ' 21' ' ' ARG . 7.5 tp -59.78 -46.32 89.54 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 113.758 -1.565 . . . . 0.0 111.758 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.473 ' N ' ' CD ' ' S' ' 21' ' ' ARG . 3.4 mpt_? -44.48 -66.17 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.578 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.471 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -35.59 -51.03 0.63 Allowed 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.862 179.527 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' S' ' 26' ' ' LEU . 30.7 t -67.76 -68.51 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.815 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' S' ' 23' ' ' VAL . 13.2 t0 -20.86 -54.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 124.248 0.968 . . . . 0.0 113.107 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . 0.453 ' C ' ' N ' ' S' ' 27' ' ' LYS . 1.7 mt -74.26 -47.58 34.2 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.778 -1.169 . . . . 0.0 109.695 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' S' ' 23' ' ' VAL . 0.2 OUTLIER -47.42 -16.73 0.06 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.409 -0.916 . . . . 0.0 110.974 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . 0.529 ' O ' ' N ' ' S' ' 29' ' ' ALA . 5.7 tptm -93.95 -73.53 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.591 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -46.33 -9.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.607 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . 0.529 ' N ' ' O ' ' S' ' 27' ' ' LYS . . . -91.72 -42.22 10.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.722 -1.191 . . . . 0.0 112.331 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . 0.449 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 28.1 t80 -43.78 -29.82 0.58 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 118.916 -1.114 . . . . 0.0 110.802 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -36.09 66.13 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.196 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 29.9 m120 -92.78 -7.17 47.27 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.656 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.418 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.7 OUTLIER 76.43 29.58 0.7 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.388 0.613 . . . . 0.0 110.249 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -95.71 -14.25 23.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.999 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 -45.56 -33.72 2.93 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 113.813 -1.54 . . . . 0.0 113.334 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.46 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.9 mt -68.24 -64.58 1.77 Allowed Pre-proline 0 C--N 1.304 -1.378 0 C-N-CA 117.442 -1.703 . . . . 0.0 110.12 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.46 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.6 Cg_exo -47.42 -26.83 6.43 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 C-N-CA 120.524 0.816 . . . . 0.0 110.184 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.93 -37.65 34.12 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.429 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . 0.482 ' O ' ' CD1' ' S' ' 43' ' ' LEU . 0.4 OUTLIER -57.38 -27.29 62.18 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.695 179.865 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.4 5.91 39.92 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.45 -63.05 1.46 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 42' ' ' MET . . . . . 0.592 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -89.04 34.13 0.79 Allowed 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 118.578 -1.249 . . . . 0.0 112.397 -179.713 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . 0.482 ' CD1' ' O ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER 170.26 141.54 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.776 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.711 ' HG1' HH21 ' S' ' 48' ' ' ARG . 0.3 OUTLIER -176.22 -32.19 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 115.972 1.842 . . . . 0.0 115.972 -179.699 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' S' ' 44' ' ' THR . 24.6 Cg_endo -87.64 -102.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 121.609 1.539 . . . . 0.0 112.529 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' S' ' 50' ' ' ALA . 8.7 m-20 -49.74 -34.93 20.46 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 118.556 -1.258 . . . . 0.0 108.047 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -49.61 -61.63 2.0 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.507 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . 0.711 HH21 ' HG1' ' S' ' 44' ' ' THR . 0.0 OUTLIER -45.63 -47.46 14.79 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.891 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -83.79 -65.83 0.96 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.478 -1.289 . . . . 0.0 113.009 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . 0.47 ' N ' ' O ' ' S' ' 46' ' ' ASP . . . -44.57 -46.5 9.98 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.417 -0.913 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 44.3 mt -45.98 -58.04 3.9 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 118.844 -1.142 . . . . 0.0 110.832 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.63 -54.15 18.28 Favored Glycine 0 N--CA 1.483 1.806 0 C-N-CA 118.84 -1.648 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.45 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.1 OUTLIER -43.14 -83.32 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -179.84 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.59 ' CZ ' ' N ' ' R' ' 109' ' ' TRP . 0.0 OUTLIER -43.76 -63.7 0.8 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 58.8 t -45.13 -29.42 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.968 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.525 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -92.2 -36.9 13.01 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 118.18 -1.408 . . . . 0.0 112.21 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . 0.465 ' CD1' ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -62.99 -31.35 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 C-N-CA 115.419 -2.513 . . . . 0.0 105.064 179.876 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . 0.465 ' N ' ' CD1' ' S' ' 57' ' ' ILE . 31.3 t -62.0 -64.84 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 CA-C-N 114.879 -1.055 . . . . 0.0 108.19 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.8 -33.1 15.58 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.746 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' S' ' 64' ' ' GLY . 3.5 tt0 -70.43 -54.11 13.7 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.559 -0.857 . . . . 0.0 111.719 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 31.5 mt -53.13 -24.18 9.87 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.681 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 tp -57.47 -38.89 75.25 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.045 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -122.42 5.0 9.64 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.972 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' S' ' 60' ' ' GLU . . . -102.5 11.17 56.58 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -43.87 -51.1 7.72 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.547 -0.861 . . . . 0.0 110.44 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -83.02 27.47 0.55 Allowed 'General case' 0 N--CA 1.49 1.55 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.069 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 7.1 t -167.78 70.49 0.09 Allowed 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 118.895 -1.122 . . . . 0.0 110.702 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.08 -11.48 8.05 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 122.077 0.942 . . . . 0.0 109.278 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -87.05 12.03 12.35 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 113.094 -1.866 . . . . 0.0 113.23 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.62 14.26 20.08 Favored 'General case' 0 N--CA 1.504 2.259 0 C-N-CA 119.529 -0.868 . . . . 0.0 113.012 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . 0.45 ' O ' ' CB ' ' S' ' 72' ' ' LYS . 1.0 OUTLIER -127.57 96.27 4.49 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.025 -179.884 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' S' ' 71' ' ' LEU . 5.2 tttm 165.92 98.29 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.673 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . 0.408 ' O ' ' CB ' ' S' ' 74' ' ' GLU . 0.2 OUTLIER -113.99 -31.38 6.4 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.541 0.686 . . . . 0.0 109.638 179.974 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' S' ' 73' ' ' ASN . 2.9 pt-20 153.76 -58.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.042 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . 0.406 ' H ' ' CG ' ' S' ' 74' ' ' GLU . 0.3 OUTLIER -108.93 21.48 17.17 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 119.837 -0.745 . . . . 0.0 109.237 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -97.6 -49.19 1.85 Allowed Glycine 0 N--CA 1.492 2.396 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.436 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . 175.94 97.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.517 0.675 . . . . 0.0 110.352 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.71 159.97 8.59 Favored Glycine 0 N--CA 1.482 1.713 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.809 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.503 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.6 OUTLIER -49.33 -38.0 11.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 CA-C-N 114.399 -0.901 . . . . 0.0 110.266 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.414 ' C ' ' O ' ' S' ' 79' ' ' ILE . . . -38.44 -44.31 0.92 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.226 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 81' ' ' THR . . . . . 0.42 ' HA ' ' HE1' ' R' ' 109' ' ' TRP . 24.4 m -71.81 -43.75 65.09 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 122.082 0.944 . . . . 0.0 112.211 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -81.33 12.31 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.26 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 -179.534 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.503 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -126.25 -18.91 4.83 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 118.934 -1.106 . . . . 0.0 113.508 179.729 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . 0.622 ' CZ ' ' CZ3' ' R' ' 109' ' ' TRP . 0.0 OUTLIER -87.06 -19.99 27.79 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 118.254 -1.378 . . . . 0.0 109.05 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.0 -18.75 49.58 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.274 -1.441 . . . . 0.0 110.102 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t -84.35 -60.34 2.11 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.913 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.49 2.92 20.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.625 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.457 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.2 OUTLIER -55.79 -48.9 74.55 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.768 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 pp -46.88 -14.48 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.386 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . 0.457 ' N ' ' O ' ' S' ' 88' ' ' SER . 17.7 tptt -49.09 -52.89 23.09 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.64 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.49 -38.25 13.5 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.258 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 54.6 60.32 10.44 Favored Pre-proline 0 C--N 1.303 -1.424 0 C-N-CA 119.833 -0.747 . . . . 0.0 111.842 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -63.07 97.49 0.19 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 121.239 1.292 . . . . 0.0 110.667 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -56.75 -10.42 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.905 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -83.48 -24.09 31.92 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.548 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . 0.421 ' O ' ' N ' ' S' ' 99' ' ' TRP . 3.7 mp -84.29 -51.31 7.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.211 -0.996 . . . . 0.0 111.181 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.52 -32.82 3.6 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.95 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -82.13 -24.26 35.19 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.387 -0.925 . . . . 0.0 110.584 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . 0.421 ' N ' ' O ' ' S' ' 96' ' ' LEU . 4.7 t90 -95.09 -63.54 1.16 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.256 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.511 ' O ' ' C ' ' S' ' 101' ' ' GLU . 2.0 mm? -35.58 -39.57 0.14 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.511 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -40.72 -41.47 1.54 Allowed 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 118.155 -1.418 . . . . 0.0 107.571 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.9 -28.09 23.0 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 113.756 -1.565 . . . . 0.0 112.652 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . 0.405 ' O ' ' OG ' ' S' ' 107' ' ' SER . 3.3 t -84.03 -15.36 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 116.615 -2.034 . . . . 0.0 111.888 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 4.9 mt -99.8 -61.94 1.3 Allowed 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.826 -0.75 . . . . 0.0 111.913 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' S' ' 107' ' ' SER . 4.5 mm? -63.86 -75.21 0.08 Allowed 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.231 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -42.17 -23.44 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.731 -0.787 . . . . 0.0 110.841 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' S' S ' 107' ' ' SER . . . . . 0.477 ' N ' ' O ' ' S' ' 105' ' ' LEU . 19.6 p . . . . . 0 C--N 1.304 -1.371 0 CA-C-O 116.253 -1.832 . . . . 0.0 110.83 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.447 ' CZ3' ' HB2' ' R' ' 54' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 116.426 -1.75 . . . . 0.0 109.918 . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.622 ' CZ3' ' CZ ' ' S' ' 84' ' ' ARG . 1.5 p90 . . . . . 0 N--CA 1.484 1.244 0 CA-C-O 117.224 -1.37 . . . . 0.0 108.821 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 . . . . . 0 N--CA 1.486 1.356 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' R' R ' 5' ' ' SER . . . . . 0.407 ' N ' ' HD2' ' R' ' 6' ' ' PRO . 0.5 OUTLIER -85.79 -52.97 0.45 Allowed Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 119.248 -0.981 . . . . 0.0 112.532 179.918 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . 0.407 ' HD2' ' N ' ' R' ' 5' ' ' SER . 2.5 Cg_endo -61.25 161.2 23.98 Favored 'Trans proline' 0 C--O 1.213 -0.752 0 C-N-CA 120.721 0.947 . . . . 0.0 111.575 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . 0.402 ' CD1' ' N ' ' R' ' 7' ' ' TYR . 0.0 OUTLIER -128.3 143.95 51.07 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.033 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 5.6 t -167.86 128.71 1.41 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.137 -1.025 . . . . 0.0 111.394 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -84.06 -43.8 14.73 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.472 -0.891 . . . . 0.0 110.734 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . 50.49 57.08 7.0 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.88 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 11' ' ' MET . . . . . 0.432 ' O ' ' O ' ' R' ' 12' ' ' ALA . 22.8 mmm -76.64 65.44 2.43 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.453 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . 0.432 ' O ' ' O ' ' R' ' 11' ' ' MET . . . 44.27 -170.01 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.605 -0.838 . . . . 0.0 111.225 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -164.0 -40.95 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.11 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -101.45 119.49 38.85 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.299 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -166.01 -30.51 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.456 -0.897 . . . . 0.0 110.136 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -80.37 7.56 9.41 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.798 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.421 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.1 mp0 -84.97 -75.6 0.35 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.285 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -46.16 -30.7 2.05 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 122.804 1.288 . . . . 0.0 108.466 179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . 0.421 ' N ' ' C ' ' R' ' 17' ' ' GLN . 67.2 t-105 -55.61 -58.51 7.48 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 112.645 -2.07 . . . . 0.0 110.229 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.9 tp -50.06 -23.6 2.18 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.521 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.541 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mmt85 -71.68 -69.7 0.37 Allowed 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.813 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.541 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.41 -37.39 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.19 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t -74.24 -50.48 27.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.413 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' R' ' 21' ' ' ARG . 38.5 t70 -41.17 -72.87 0.05 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.567 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -47.5 -44.85 25.81 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.579 -0.848 . . . . 0.0 111.13 -179.995 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.88 -56.91 7.4 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.149 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -62.54 -35.9 80.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -81.24 -7.58 59.59 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.886 -1.126 . . . . 0.0 112.537 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' R' ' 31' ' ' GLN . . . -99.94 -57.98 2.02 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.105 -1.038 . . . . 0.0 112.83 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . 0.419 ' C ' ' O ' ' R' ' 29' ' ' ALA . 0.2 OUTLIER -34.53 -27.67 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.859 -179.771 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' R' ' 29' ' ' ALA . 1.2 tt0 -54.84 -44.54 74.03 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.801 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -103.43 -76.48 0.59 Allowed 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.965 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 178.8 27.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.966 -1.094 . . . . 0.0 112.06 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . 0.596 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 1.0 OUTLIER -99.61 -11.59 20.82 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.249 -0.981 . . . . 0.0 110.869 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . 0.424 ' N ' ' HB2' ' R' ' 29' ' ' ALA . 47.0 p-80 -59.25 -24.34 63.13 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.829 -179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.408 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 8.1 mt -76.13 -59.56 1.09 Allowed Pre-proline 0 C--N 1.303 -1.436 0 C-N-CA 118.018 -1.473 . . . . 0.0 110.81 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.408 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.5 Cg_exo -54.88 -36.29 91.2 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 N-CA-C 109.404 -1.037 . . . . 0.0 109.404 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.77 -43.84 95.21 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.619 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.55 -34.25 49.37 Favored 'General case' 0 C--O 1.203 -1.344 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.628 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -74.12 5.75 4.09 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.316 -0.953 . . . . 0.0 111.542 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.01 -56.64 2.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.46 12.33 2.53 Favored 'General case' 0 N--CA 1.501 2.098 0 C-N-CA 117.429 -1.709 . . . . 0.0 112.841 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 2.2 pp 179.95 146.58 0.24 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.548 ' N ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -175.44 -38.07 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 116.075 -2.25 . . . . 0.0 116.14 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' R' ' 44' ' ' THR . 41.4 Cg_endo -87.26 -109.43 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 121.444 1.429 . . . . 0.0 113.183 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 3.7 p-10 -54.48 -32.75 58.43 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 119.721 -0.791 . . . . 0.0 110.275 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . 0.486 ' OE2' ' OXT' ' R' ' 109' ' ' TRP . 30.6 mt-10 -54.6 -64.6 0.78 Allowed 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.081 -1.047 . . . . 0.0 110.49 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.19 -38.32 11.75 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.171 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.52 -68.02 0.4 Allowed 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.351 -1.34 . . . . 0.0 111.938 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.499 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -65.84 -52.54 49.61 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.205 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . 0.499 ' C ' ' O ' ' R' ' 50' ' ' ALA . 3.2 tt -33.77 -48.89 0.3 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.526 -0.87 . . . . 0.0 110.357 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -64.85 -69.37 1.35 Allowed Glycine 0 N--CA 1.482 1.753 0 C-N-CA 119.564 -1.303 . . . . 0.0 110.104 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.449 ' C ' ' O ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -34.02 -69.14 0.1 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 122.319 1.057 . . . . 0.0 110.748 179.764 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . 0.471 ' CD ' ' N ' ' R' ' 54' ' ' ARG . 0.1 OUTLIER -35.18 -63.82 0.31 Allowed 'General case' 0 C--N 1.286 -2.156 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.908 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 12.0 p -60.52 -19.24 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 C-N-CA 116.739 -1.984 . . . . 0.0 111.947 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.595 HH22 ' CZ ' ' R' ' 69' ' ' ARG . 0.0 OUTLIER -83.62 -38.07 22.06 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.38 -0.928 . . . . 0.0 112.422 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.543 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -81.83 -34.58 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.872 -179.639 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.543 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 4.8 p -69.31 -39.92 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 118.045 -1.462 . . . . 0.0 111.37 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . 0.467 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 3.3 pt-20 -72.2 -30.57 65.07 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 118.383 -1.327 . . . . 0.0 110.584 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -74.63 -47.47 31.91 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.609 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.53 -26.71 67.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.015 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -50.35 -30.4 12.09 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 118.918 -1.113 . . . . 0.0 109.537 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.69 -2.09 7.89 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.014 -0.993 . . . . 0.0 109.971 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . 0.403 ' O ' ' C ' ' R' ' 65' ' ' GLU . . . -113.7 21.15 16.93 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.556 ' O ' ' C ' ' R' ' 66' ' ' MET . 76.5 mt-10 -35.95 -50.6 0.68 Allowed 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.295 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 66' ' ' MET . . . . . 0.556 ' C ' ' O ' ' R' ' 65' ' ' GLU . 34.6 ttm 6.45 -110.21 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 O-C-N 124.854 1.346 . . . . 0.0 112.377 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 38.4 t -175.67 73.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.133 -1.027 . . . . 0.0 110.73 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.56 -42.46 1.8 Allowed 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.343 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . 0.595 ' CZ ' HH22 ' R' ' 56' ' ' ARG . 0.7 OUTLIER -92.38 26.93 2.4 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.319 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -92.02 19.0 7.17 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.639 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 11.8 mt -115.3 133.84 55.67 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.256 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.07 91.37 4.52 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.866 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . 0.538 ' O ' ' N ' ' R' ' 75' ' ' LEU . 47.7 t-20 -87.41 11.72 13.88 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 118.541 -1.264 . . . . 0.0 109.945 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 58.89 -67.75 0.03 OUTLIER 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 113.248 -1.796 . . . . 0.0 111.037 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . 0.538 ' N ' ' O ' ' R' ' 73' ' ' ASN . 0.4 OUTLIER -63.03 -31.75 72.95 Favored 'General case' 0 C--N 1.297 -1.675 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.202 179.887 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -53.07 -57.57 14.43 Favored Glycine 0 N--CA 1.489 2.209 0 C-N-CA 119.494 -1.336 . . . . 0.0 110.266 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -153.26 -74.13 0.13 Allowed 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.725 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 156.29 122.99 0.77 Allowed Glycine 0 N--CA 1.491 2.357 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.647 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.474 ' O ' ' OG1' ' R' ' 83' ' ' THR . 0.1 OUTLIER -37.14 -32.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.622 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.446 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.66 -56.02 14.39 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.962 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 19.7 m -42.89 -50.2 5.79 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 12.1 pt -71.0 -28.72 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 C-N-CA 119.0 -1.08 . . . . 0.0 113.02 -179.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -61.02 -73.15 0.1 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 118.648 -1.221 . . . . 0.0 110.922 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -11.37 1.4 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.102 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -69.73 -28.76 71.7 Favored Glycine 0 N--CA 1.486 1.999 0 C-N-CA 119.775 -1.203 . . . . 0.0 110.99 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 40.2 t -150.32 57.24 0.95 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 118.603 -1.239 . . . . 0.0 112.197 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . 0.464 ' O ' ' CB ' ' R' ' 88' ' ' SER . 32.1 t-20 -94.36 -13.22 26.58 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 88' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER 75.1 -45.36 0.56 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.088 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.73 -25.93 65.89 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.55 -0.86 . . . . 0.0 111.302 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . 0.62 ' C ' ' H ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -48.9 -37.65 20.37 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.526 -1.27 . . . . 0.0 110.797 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' R' ' 92' ' ' ALA . . . -61.03 11.54 0.02 OUTLIER 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.032 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . 0.62 ' H ' ' C ' ' R' ' 90' ' ' LYS . . . -31.34 -59.65 0.32 Allowed Pre-proline 0 N--CA 1.493 1.698 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -51.31 95.28 0.03 OUTLIER 'Trans proline' 0 C--N 1.324 -0.763 0 C-N-CA 120.506 0.804 . . . . 0.0 110.725 179.848 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.13 -16.95 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.588 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.82 -28.62 67.73 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.362 -0.935 . . . . 0.0 111.274 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 4.3 mt -61.88 -41.05 97.4 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.481 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -55.86 -37.81 69.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.645 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.55 -29.37 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.6 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 3.0 t90 -99.2 -67.49 0.85 Allowed 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.362 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.578 ' O ' ' N ' ' R' ' 102' ' ' GLU . 1.3 mm? -38.6 -55.46 1.43 Allowed 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.545 ' C ' ' O ' ' R' ' 100' ' ' LEU . 12.7 pt-20 -33.24 -33.11 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.85 -1.14 . . . . 0.0 109.51 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' R' ' 100' ' ' LEU . 1.8 tm-20 -92.54 -32.41 14.85 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.802 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . 0.577 ' N ' ' O ' ' R' ' 100' ' ' LEU . 9.8 t -80.81 -15.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 116.959 -1.896 . . . . 0.0 110.883 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 1.8 tp -102.14 -55.25 2.52 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.937 179.768 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.16 -66.65 0.35 Allowed 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.983 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 26.2 tttt -58.55 -73.03 0.08 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.503 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.305 -1.349 0 CA-C-O 116.282 -1.818 . . . . 0.0 111.035 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 46.5 t -156.75 77.87 4.06 Favored Pre-proline 0 N--CA 1.487 1.383 0 C-N-CA 119.836 -0.746 . . . . 0.0 110.847 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -62.11 163.87 18.61 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 121.587 1.525 . . . . 0.0 112.185 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -101.38 158.62 15.93 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.773 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 54.5 m -92.03 -165.35 1.33 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.461 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' S' ' 10' ' ' ALA . . . -81.4 90.78 6.2 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.344 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' S' ' 9' ' ' ALA . . . 57.46 161.09 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.933 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 4.7 ttp -136.81 -30.07 0.9 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.786 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -171.12 127.99 0.71 Allowed 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.972 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . 0.571 ' H ' ' CD ' ' S' ' 13' ' ' GLU . 0.0 OUTLIER -90.11 143.1 27.07 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.177 -1.009 . . . . 0.0 110.892 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -63.97 119.26 9.75 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.233 -0.987 . . . . 0.0 110.103 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -78.67 63.06 3.36 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 118.813 -1.155 . . . . 0.0 111.221 -179.913 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -84.92 10.86 10.58 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.588 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . 0.417 ' C ' ' N ' ' S' ' 19' ' ' TRP . 20.8 mt-30 -76.99 -92.11 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.047 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.512 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 0.4 OUTLIER -44.25 -27.45 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 122.164 0.983 . . . . 0.0 109.54 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . 0.417 ' N ' ' C ' ' S' ' 17' ' ' GLN . 32.8 t-105 -53.6 -48.64 69.07 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.627 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' S' ' 17' ' ' GLN . 1.2 tt -59.84 -36.1 76.14 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 113.253 -1.794 . . . . 0.0 111.016 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 1.4 mpt_? -58.17 -73.02 0.08 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.28 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.556 ' C ' ' CD1' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -25.6 -50.67 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.78 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . 0.402 ' N ' ' O ' ' S' ' 21' ' ' ARG . 30.6 t -68.89 -63.05 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.745 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' S' ' 24' ' ' ASP . 21.7 t0 -35.55 -60.65 0.5 Allowed 'General case' 0 N--CA 1.488 1.469 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.838 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . 0.406 ' O ' ' N ' ' S' ' 27' ' ' LYS . 2.7 mt -57.24 -57.09 14.16 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.161 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -42.37 -25.05 0.07 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.243 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' S' ' 25' ' ' LEU . 3.3 mtpm? -82.45 -39.28 22.77 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.716 -1.194 . . . . 0.0 113.005 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -83.23 -20.7 34.08 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.42 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.95 -32.78 26.95 Favored 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.703 -179.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . 0.498 ' O ' ' CD1' ' S' ' 30' ' ' TYR . 0.0 OUTLIER -56.59 -32.53 65.33 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.004 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -47.67 77.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.878 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.57 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 1.8 m120 -84.09 -41.96 16.6 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.781 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 22.1 t70 116.56 49.35 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.713 0 O-C-N 125.059 1.474 . . . . 0.0 109.393 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . 0.44 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 1.4 mm? -112.55 -14.0 13.26 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.996 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 15.6 p-80 -52.22 -13.39 0.33 Allowed 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.528 -1.215 . . . . 0.0 112.89 -179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.481 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.5 mt -80.87 -66.19 0.25 Allowed Pre-proline 0 N--CA 1.486 1.34 0 C-N-CA 118.217 -1.393 . . . . 0.0 110.093 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.481 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.0 Cg_exo -49.55 -29.04 17.82 Favored 'Trans proline' 0 C--N 1.322 -0.862 0 N-CA-C 109.961 -0.823 . . . . 0.0 109.961 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . 0.558 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.2 mp -71.25 -51.49 24.28 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.469 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.57 -41.6 6.65 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.678 179.869 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -18.08 33.44 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.275 -0.97 . . . . 0.0 111.921 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . 0.475 ' O ' ' O ' ' R' ' 1' ' ' TRP . 16.5 mt -94.25 -62.03 1.41 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.527 -0.869 . . . . 0.0 112.918 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 42' ' ' MET . . . . . 0.558 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.2 OUTLIER -81.46 10.55 5.6 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 117.927 -1.509 . . . . 0.0 111.781 -179.881 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.53 126.7 7.8 Favored 'General case' 0 N--CA 1.509 2.505 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.536 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.412 ' N ' ' CD ' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -166.53 -42.53 0.0 OUTLIER Pre-proline 0 N--CA 1.499 2.018 0 C-N-CA 116.456 -2.098 . . . . 0.0 116.506 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.507 ' CG ' ' H ' ' R' ' 1' ' ' TRP . 43.7 Cg_endo -89.97 -105.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 120.771 0.98 . . . . 0.0 114.577 -179.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -57.33 -22.79 44.56 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.94 -179.732 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . 0.431 ' OE1' ' OE1' ' R' ' 47' ' ' GLU . 5.0 mm-40 -56.97 -61.3 2.54 Favored 'General case' 0 C--N 1.296 -1.741 0 C-N-CA 118.534 -1.266 . . . . 0.0 109.315 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 4.8 mmt85 -55.2 -33.07 62.73 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.936 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -82.67 -66.67 0.86 Allowed 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 118.405 -1.318 . . . . 0.0 114.365 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -50.49 -41.15 52.97 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . 0.457 ' CD1' ' N ' ' S' ' 52' ' ' GLY . 3.7 pp -64.52 -42.25 95.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 117.456 -1.697 . . . . 0.0 111.333 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . 0.457 ' N ' ' CD1' ' S' ' 51' ' ' LEU . . . -55.45 -44.53 85.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 107.632 -2.187 . . . . 0.0 107.632 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.2 OUTLIER -46.71 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.921 -1.139 . . . . 0.0 113.096 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.512 ' CB ' ' CZ3' ' R' ' 109' ' ' TRP . 3.9 ppt_? -48.39 -37.48 17.03 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 119.17 -1.012 . . . . 0.0 113.442 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 35.2 t -57.6 -28.69 32.46 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.864 0 C-N-CA 117.841 -1.544 . . . . 0.0 109.192 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -83.15 -33.23 26.3 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . 0.498 ' CD1' ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -82.57 -29.58 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.105 0 C-N-CA 117.489 -1.684 . . . . 0.0 108.041 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . 0.498 ' N ' ' CD1' ' S' ' 57' ' ' ILE . 10.2 t -63.28 -48.99 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.81 -43.04 98.72 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.91 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.35 -45.76 92.32 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.021 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 97.7 mt -74.72 -31.83 61.96 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.15 -1.02 . . . . 0.0 113.131 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 12.8 tp -77.05 -43.08 35.84 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 118.419 -1.313 . . . . 0.0 112.272 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.35 -39.84 67.8 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.297 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.63 ' C ' ' H ' ' S' ' 66' ' ' MET . . . -69.44 -23.03 76.64 Favored Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.483 -1.341 . . . . 0.0 111.106 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 59.35 -23.95 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 66' ' ' MET . . . . . 0.63 ' H ' ' C ' ' S' ' 64' ' ' GLY . 8.6 mtp -79.89 168.45 19.23 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.752 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 1.7 t -162.26 69.21 0.27 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.759 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.459 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.0 OUTLIER -116.88 -24.8 7.5 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.919 -179.86 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . 0.557 ' C ' ' H ' ' S' ' 71' ' ' LEU . 0.2 OUTLIER -78.81 28.45 0.21 Allowed 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.307 179.981 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.459 ' H ' ' C ' ' S' ' 68' ' ' GLN . 88.2 mt-10 -67.49 24.93 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.432 -0.803 . . . . 0.0 112.233 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . 0.557 ' H ' ' C ' ' S' ' 69' ' ' ARG . 6.7 mp -120.07 133.62 55.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.42 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . 0.553 ' H ' ' CD ' ' S' ' 72' ' ' LYS . 0.0 OUTLIER -51.11 96.3 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -179.822 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . 0.661 ' O ' ' N ' ' S' ' 75' ' ' LEU . 0.7 OUTLIER -90.5 26.2 2.05 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 122.097 0.951 . . . . 0.0 108.671 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' S' ' 76' ' ' GLY . 1.0 OUTLIER 39.6 -71.22 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 112.586 -2.097 . . . . 0.0 112.722 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . 0.661 ' N ' ' O ' ' S' ' 73' ' ' ASN . 0.8 OUTLIER -40.78 -21.3 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.789 -179.981 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' S' ' 74' ' ' GLU . . . -84.01 -65.44 1.54 Allowed Glycine 0 N--CA 1.487 2.081 0 C-N-CA 119.678 -1.249 . . . . 0.0 110.348 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.03 -103.11 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.897 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . 0.405 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . -164.49 146.49 11.43 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.501 ' C ' ' CD1' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -37.43 -39.09 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.886 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.9 -84.33 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 81' ' ' THR . . . . . 0.422 ' HA ' ' HE1' ' R' ' 109' ' ' TRP . 1.0 OUTLIER -45.11 -19.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -179.625 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 4.1 pt -102.12 6.34 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 C-N-CA 118.38 -1.328 . . . . 0.0 113.523 -179.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 83' ' ' THR . . . . . 0.496 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -99.68 -13.41 19.35 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.778 -1.169 . . . . 0.0 112.302 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . 0.439 ' NE ' ' CH2' ' R' ' 109' ' ' TRP . 0.0 OUTLIER -101.56 -36.09 8.9 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.704 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.11 71.69 Favored Glycine 0 N--CA 1.49 2.273 0 C-N-CA 119.66 -1.257 . . . . 0.0 110.83 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.1 p -88.79 -50.03 6.47 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.076 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . 0.516 ' C ' ' H ' ' S' ' 89' ' ' LEU . 1.4 p30 -87.63 -80.46 0.26 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.414 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.482 ' H ' ' CG ' ' S' ' 87' ' ' ASN . 0.2 OUTLIER 73.09 -37.65 0.39 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.338 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . 0.516 ' H ' ' C ' ' S' ' 87' ' ' ASN . 4.7 mt -64.32 -10.41 23.97 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.149 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . 0.402 ' O ' ' C ' ' S' ' 91' ' ' ALA . 16.3 mmtm -75.0 -58.64 3.16 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.241 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . 0.508 ' O ' ' CB ' ' S' ' 92' ' ' ALA . . . -36.14 -78.42 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.181 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.762 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . 0.602 ' N ' ' CD ' ' S' ' 93' ' ' PRO . . . 161.15 -33.68 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.71 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . 0.602 ' CD ' ' N ' ' S' ' 92' ' ' ALA . 6.2 Cg_exo -58.89 95.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.325 -0.695 0 C-N-CA 120.524 0.816 . . . . 0.0 112.607 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 58.4 t -95.13 -18.24 6.79 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.423 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.15 -2.99 6.43 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 3.6 tp -82.53 -36.54 26.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.435 -0.906 . . . . 0.0 111.62 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -1.39 7.34 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.93 -0.708 . . . . 0.0 112.771 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -106.06 -0.41 24.85 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . 0.572 ' O ' ' N ' ' S' ' 103' ' ' VAL . 5.7 t90 -112.53 -64.28 1.32 Allowed 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 114.17 -1.377 . . . . 0.0 113.467 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.865 ' CD2' ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -20.75 -82.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 119.058 2.984 . . . . 0.0 119.058 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.865 ' H ' ' CD2' ' S' ' 100' ' ' LEU . 0.0 OUTLIER -58.58 -43.66 89.53 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 119.15 -1.02 . . . . 0.0 109.071 -179.425 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.427 ' H ' ' HG3' ' S' ' 101' ' ' GLU . 1.6 tm-20 -63.15 -18.39 63.41 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . 0.572 ' N ' ' O ' ' S' ' 99' ' ' TRP . 0.5 OUTLIER -91.22 -54.13 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 C-N-CA 117.154 -1.819 . . . . 0.0 111.036 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . 0.464 ' N ' ' CG1' ' S' ' 103' ' ' VAL . 17.5 mt -51.98 -69.01 0.12 Allowed 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.442 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 8.1 mt -45.84 -74.46 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.888 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -43.49 -57.82 2.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.725 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 116.257 -1.83 . . . . 0.0 111.252 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.507 ' H ' ' CG ' ' S' ' 45' ' ' PRO . 70.5 m95 . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 116.506 -1.711 . . . . 0.0 109.976 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.512 ' CZ3' ' CB ' ' S' ' 54' ' ' ARG . 93.7 m95 . . . . . 0 N--CA 1.484 1.242 0 CA-C-O 115.943 -1.979 . . . . 0.0 109.049 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.883 0.373 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.03 164.63 57.31 Favored Pre-proline 0 N--CA 1.486 1.373 0 C-N-CA 119.515 -0.874 . . . . 0.0 110.542 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -56.81 -34.11 95.89 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 C-N-CA 121.323 1.348 . . . . 0.0 111.298 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.43 177.58 0.85 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.727 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 8.6 t 46.53 36.06 3.33 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.938 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . 63.81 179.88 0.16 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.85 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -171.73 -34.64 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.41 -0.916 . . . . 0.0 110.92 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 2.0 mmm -160.63 -50.87 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.07 20.87 1.11 Allowed 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.844 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 57.13 92.75 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.774 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -76.44 141.11 41.48 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.47 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 -94.38 163.7 13.31 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.231 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -150.37 -3.26 0.36 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.421 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 17' ' ' GLN . . . . . 0.44 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.4 mt-30 -92.42 -79.52 0.39 Allowed 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.855 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 18' ' ' GLU . . . . . 0.596 ' H ' ' CD ' ' R' ' 18' ' ' GLU . 0.0 OUTLIER -48.57 -27.71 2.95 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.888 1.327 . . . . 0.0 107.779 179.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 19' ' ' TRP . . . . . 0.44 ' N ' ' C ' ' R' ' 17' ' ' GLN . 71.8 t-105 -51.62 -60.42 3.18 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 112.912 -1.949 . . . . 0.0 109.127 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -49.5 -31.61 10.47 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.404 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 21' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.3 mmt180 -61.91 -75.68 0.07 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 118.387 -1.325 . . . . 0.0 109.865 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 22' ' ' PHE . . . . . 0.465 ' C ' ' O ' ' R' ' 21' ' ' ARG . 8.7 t80 -36.32 -39.91 0.21 Allowed 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.404 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 23' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' R' ' 25' ' ' LEU . 46.6 t -73.05 -74.39 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.598 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 24' ' ' ASP . . . . . 0.437 ' C ' ' O ' ' R' ' 23' ' ' VAL . 29.8 t70 -37.85 -29.67 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.757 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 25' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' R' ' 23' ' ' VAL . 13.5 tp -70.54 -66.26 0.63 Allowed 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.142 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 tp -48.11 -56.25 8.27 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.372 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 27' ' ' LYS . . . . . 0.623 ' NZ ' ' CE1' ' S' ' 30' ' ' TYR . 0.1 OUTLIER -41.37 -57.13 2.26 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.256 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -78.35 -5.55 52.52 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.554 -0.858 . . . . 0.0 112.353 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 29' ' ' ALA . . . . . 0.425 ' O ' ' N ' ' R' ' 32' ' ' ASN . . . -83.24 -51.26 7.61 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.829 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 30' ' ' TYR . . . . . 0.418 ' O ' ' N ' ' R' ' 33' ' ' ASP . 24.0 t80 -41.23 -67.3 0.26 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.155 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -45.95 -25.82 0.61 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.653 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 32' ' ' ASN . . . . . 0.518 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 0.3 OUTLIER -93.19 -23.48 18.55 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.296 -179.909 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 33' ' ' ASP . . . . . 0.518 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 3.3 t0 85.69 23.09 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 123.695 0.622 . . . . 0.0 111.346 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 34' ' ' LEU . . . . . 0.484 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 0.6 OUTLIER -104.27 -13.37 16.18 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.679 0.752 . . . . 0.0 109.003 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 27.1 p-80 -49.38 -24.88 2.13 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 114.301 -1.318 . . . . 0.0 113.007 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.2 mt -77.83 -64.33 0.42 Allowed Pre-proline 0 N--CA 1.484 1.235 0 C-N-CA 118.081 -1.447 . . . . 0.0 110.893 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 37' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.2 Cg_endo -53.83 -23.9 28.95 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 N-CA-C 109.978 -0.816 . . . . 0.0 109.978 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 78.0 mt -83.9 -33.09 24.84 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.155 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 39' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 43' ' ' LEU . 1.0 OUTLIER -56.43 -32.53 64.97 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.814 179.752 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 40' ' ' ASN . . . . . 0.532 ' O ' ' N ' ' R' ' 109' ' ' TRP . 1.0 OUTLIER -81.77 3.52 25.49 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.792 -179.954 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 4.9 mp -105.6 -65.17 1.08 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.255 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 42' ' ' MET . . . . . 0.512 ' N ' ' SD ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -94.65 37.59 1.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.23 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 43' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 39' ' ' LEU . 1.1 tp 179.31 127.06 0.07 Allowed 'General case' 0 N--CA 1.505 2.294 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 44' ' ' THR . . . . . 0.561 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.93 -39.22 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.669 0 C-N-CA 117.639 -1.624 . . . . 0.0 115.251 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 45' ' ' PRO . . . . . 0.561 ' HD2' ' H ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -76.14 -95.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.288 0 C-N-CA 120.814 1.009 . . . . 0.0 112.165 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 46' ' ' ASP . . . . . 0.417 ' O ' ' CB ' ' R' ' 50' ' ' ALA . 0.8 OUTLIER -55.86 -6.89 0.25 Allowed 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 118.804 -1.158 . . . . 0.0 109.454 -179.857 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 47' ' ' GLU . . . . . 0.605 ' OE2' ' CH2' ' S' ' 19' ' ' TRP . 25.2 tt0 -72.11 -79.92 0.07 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.044 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 48' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' R' ' 47' ' ' GLU . 9.7 mmm-85 -43.04 -24.59 0.07 Allowed 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.104 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 49' ' ' GLU . . . . . 0.486 ' N ' ' O ' ' R' ' 47' ' ' GLU . 5.4 mt-10 -88.57 -68.23 0.78 Allowed 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.648 -1.221 . . . . 0.0 111.822 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 50' ' ' ALA . . . . . 0.517 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -57.98 -60.55 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 51' ' ' LEU . . . . . 0.475 ' C ' ' O ' ' R' ' 50' ' ' ALA . 2.4 mp -33.48 -62.9 0.27 Allowed 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.439 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.36 -47.38 35.3 Favored Glycine 0 N--CA 1.485 1.929 0 C-N-CA 118.74 -1.695 . . . . 0.0 109.416 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 53' ' ' THR . . . . . 0.525 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -58.99 -81.22 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -34.04 -60.53 0.39 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.578 -179.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.04 -31.08 35.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 C-N-CA 118.136 -1.426 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 56' ' ' ARG . . . . . 0.525 ' N ' ' O ' ' R' ' 53' ' ' THR . 22.2 mtp85 -80.73 -37.25 30.89 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.655 -1.218 . . . . 0.0 112.396 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 57' ' ' ILE . . . . . 0.446 ' CD1' ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.45 -31.9 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 C-N-CA 116.801 -1.96 . . . . 0.0 108.297 -179.862 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 58' ' ' VAL . . . . . 0.446 ' N ' ' CD1' ' R' ' 57' ' ' ILE . 2.7 t -61.96 -60.17 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 118.679 -1.208 . . . . 0.0 109.176 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -52.96 -34.88 57.8 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.808 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.73 -45.89 64.04 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.845 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 65.5 mt -84.82 0.24 51.54 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.563 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.32 -63.72 1.15 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.699 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 46.0 mtp180 -104.49 7.41 35.32 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.642 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 64' ' ' GLY . . . . . 0.549 ' O ' ' N ' ' R' ' 66' ' ' MET . . . -93.87 27.61 12.36 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.5 -1.04 . . . . 0.0 110.5 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 65' ' ' GLU . . . . . 0.44 ' C ' ' O ' ' R' ' 64' ' ' GLY . 2.0 mt-10 -32.51 -30.63 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.572 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 66' ' ' MET . . . . . 0.549 ' N ' ' O ' ' R' ' 64' ' ' GLY . 7.2 mmt -85.3 98.77 10.71 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.299 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 67' ' ' SER . . . . . 0.429 ' O ' ' OG ' ' R' ' 67' ' ' SER . 2.1 t 174.17 80.77 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 119.598 -0.841 . . . . 0.0 109.997 -179.914 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 68' ' ' GLN . . . . . 0.571 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.2 OUTLIER -114.11 -23.36 9.55 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.651 -179.874 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -73.69 27.22 0.07 Allowed 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.405 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 70' ' ' GLU . . . . . 0.571 ' H ' ' C ' ' R' ' 68' ' ' GLN . 1.3 pt-20 -122.92 25.97 8.36 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.584 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -39.55 159.18 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.477 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 72' ' ' LYS . . . . . 0.444 ' O ' ' CG ' ' R' ' 72' ' ' LYS . 0.1 OUTLIER -44.45 127.4 5.88 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.706 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 73' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' R' ' 75' ' ' LEU . 1.1 t30 -118.33 16.0 13.92 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 122.084 0.945 . . . . 0.0 109.356 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 37.91 19.06 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 113.037 -1.892 . . . . 0.0 112.127 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 75' ' ' LEU . . . . . 0.575 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.9 tp -126.84 -25.47 3.34 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.678 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -89.83 -54.73 2.13 Favored Glycine 0 N--CA 1.489 2.187 0 C-N-CA 119.515 -1.326 . . . . 0.0 110.68 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.73 -102.29 0.11 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.189 -1.004 . . . . 0.0 110.965 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.76 145.23 7.27 Favored Glycine 0 N--CA 1.489 2.222 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.476 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 79' ' ' ILE . . . . . 0.495 ' C ' ' CD1' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -44.75 -36.38 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.855 179.995 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 80' ' ' ALA . . . . . 0.539 ' O ' ' NH1' ' R' ' 84' ' ' ARG . . . -62.26 -31.44 72.01 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.511 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 81' ' ' THR . . . . . 0.514 ' C ' ' H ' ' R' ' 83' ' ' THR . 0.9 OUTLIER -86.6 -50.94 6.46 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.113 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -63.51 7.53 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.899 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 83' ' ' THR . . . . . 0.514 ' H ' ' C ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -91.54 -79.31 0.38 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.077 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 84' ' ' ARG . . . . . 0.733 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.58 -26.8 23.13 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.348 179.86 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.85 -44.69 81.53 Favored Glycine 0 N--CA 1.488 2.143 0 C-N-CA 119.343 -1.408 . . . . 0.0 109.924 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 86' ' ' SER . . . . . 0.423 ' C ' ' H ' ' R' ' 88' ' ' SER . 0.3 OUTLIER -94.23 -49.29 5.8 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.527 179.99 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 87' ' ' ASN . . . . . 0.552 ' ND2' ' N ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER -75.81 10.6 1.73 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.655 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 88' ' ' SER . . . . . 0.423 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.5 OUTLIER -41.51 -27.29 0.09 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.423 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 89' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' R' ' 87' ' ' ASN . 5.6 mt -61.02 -68.6 0.29 Allowed 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.722 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 90' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' R' ' 91' ' ' ALA . 9.4 mmtp -69.5 -75.37 0.11 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.665 0.745 . . . . 0.0 112.622 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 91' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -30.69 -64.83 0.13 Allowed 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.664 -1.607 . . . . 0.0 112.89 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.23 163.08 55.34 Favored Pre-proline 0 N--CA 1.49 1.527 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.774 -179.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -59.23 131.58 41.91 Favored 'Trans proline' 0 C--N 1.32 -0.936 0 C-N-CA 121.656 1.571 . . . . 0.0 111.868 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 94' ' ' VAL . . . . . 0.472 ' C ' ' H ' ' R' ' 96' ' ' LEU . 96.7 t -78.78 -18.74 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.379 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.73 6.36 1.18 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.504 -0.878 . . . . 0.0 110.484 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 96' ' ' LEU . . . . . 0.472 ' H ' ' C ' ' R' ' 94' ' ' VAL . 2.2 tp -80.12 -33.55 38.57 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.717 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -63.63 -25.56 68.28 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.97 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.17 -26.42 68.32 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.863 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 99' ' ' TRP . . . . . . . . . . . . . 5.7 t90 -110.48 -62.36 1.53 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.372 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 100' ' ' LEU . . . . . 0.49 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -40.96 -33.03 0.27 Allowed 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 118.999 -1.08 . . . . 0.0 113.334 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 101' ' ' GLU . . . . . 0.49 ' C ' ' O ' ' R' ' 100' ' ' LEU . 6.7 mm-40 -43.76 -37.92 2.95 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 117.668 -1.613 . . . . 0.0 107.366 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 102' ' ' GLU . . . . . 0.405 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.2 mt-10 -90.81 -27.28 18.97 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.567 -1.651 . . . . 0.0 112.05 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 103' ' ' VAL . . . . . . . . . . . . . 2.1 t -93.52 -1.25 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 117.651 -1.62 . . . . 0.0 110.79 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 104' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' R' ' 100' ' ' LEU . 20.1 tp -108.22 -51.47 2.89 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.629 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 105' ' ' LEU . . . . . 0.472 ' C ' ' CD1' ' R' ' 105' ' ' LEU . 0.4 OUTLIER -78.19 -28.52 48.16 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 118.845 -1.142 . . . . 0.0 111.73 -179.894 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttm -68.33 -21.47 64.74 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 118.937 -1.105 . . . . 0.0 110.583 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.304 -1.38 0 CA-C-O 116.276 -1.821 . . . . 0.0 110.732 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 4' ' ' GLN . . . . . 0.447 ' H1 ' ' H ' ' S' ' 5' ' ' SER . 11.7 pt20 . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.956 0.408 . . . . 0.0 110.149 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 5' ' ' SER . . . . . 0.447 ' H ' ' H1 ' ' S' ' 4' ' ' GLN . 26.6 t -150.16 68.49 8.73 Favored Pre-proline 0 C--N 1.305 -1.362 0 C-N-CA 119.447 -0.901 . . . . 0.0 111.136 179.95 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.18 -37.47 31.88 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 121.581 1.52 . . . . 0.0 111.439 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -71.53 151.28 44.01 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.905 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 1.5 p -63.37 -165.36 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.93 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 9' ' ' ALA . . . . . 0.481 ' C ' ' H ' ' S' ' 11' ' ' MET . . . -168.22 40.96 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 119.399 -0.92 . . . . 0.0 110.937 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . 51.16 11.45 0.1 Allowed 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.924 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 11' ' ' MET . . . . . 0.481 ' H ' ' C ' ' S' ' 9' ' ' ALA . 11.8 ptm -69.7 160.46 31.6 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.956 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.43 -60.21 4.06 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 119.521 -0.871 . . . . 0.0 110.927 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -170.85 145.58 2.41 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.756 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 14' ' ' GLN . . . . . 0.45 ' CD ' ' H ' ' S' ' 14' ' ' GLN . 0.0 OUTLIER -74.79 121.64 22.09 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.036 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -140.46 45.71 1.83 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.105 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 26.3 t-80 -161.78 -12.54 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.606 -0.837 . . . . 0.0 110.637 179.899 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 17' ' ' GLN . . . . . . . . . . . . . 4.3 mt-30 -86.26 -85.69 0.15 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.499 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 18' ' ' GLU . . . . . 0.503 ' N ' ' CD ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -47.28 -33.6 5.77 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.901 -1.12 . . . . 0.0 108.116 179.791 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 19' ' ' TRP . . . . . 0.605 ' CH2' ' OE2' ' R' ' 47' ' ' GLU . 27.7 t-105 -51.34 -61.52 2.19 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.437 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 20' ' ' LEU . . . . . 0.439 ' O ' ' N ' ' S' ' 24' ' ' ASP . 1.3 mt -56.34 -41.72 76.55 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.511 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 21' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' S' ' 22' ' ' PHE . 20.4 mmt180 -44.15 -64.3 0.7 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.523 -1.271 . . . . 0.0 109.64 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 22' ' ' PHE . . . . . 0.442 ' C ' ' O ' ' S' ' 21' ' ' ARG . 4.3 t80 -40.27 -40.39 1.13 Allowed 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 119.062 -1.055 . . . . 0.0 109.765 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 23' ' ' VAL . . . . . 0.462 ' O ' ' N ' ' S' ' 26' ' ' LEU . 45.1 t -80.56 -74.09 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 119.953 -0.699 . . . . 0.0 111.065 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 24' ' ' ASP . . . . . 0.511 ' O ' ' ND2' ' S' ' 28' ' ' ASN . 0.7 OUTLIER -36.63 -32.17 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.097 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 25' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' S' ' 23' ' ' VAL . 63.0 tp -73.54 -49.78 24.72 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.676 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 26' ' ' LEU . . . . . 0.462 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.4 mp -49.75 -59.78 3.5 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.931 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 27' ' ' LYS . . . . . 0.408 ' O ' ' NE2' ' S' ' 31' ' ' GLN . 0.4 OUTLIER -54.74 -21.39 10.8 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.603 -0.839 . . . . 0.0 113.244 -179.711 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 28' ' ' ASN . . . . . 0.511 ' ND2' ' O ' ' S' ' 24' ' ' ASP . 74.6 m-20 -89.89 -21.15 22.65 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 118.754 -1.179 . . . . 0.0 111.421 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 29' ' ' ALA . . . . . 0.43 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -95.42 -29.8 14.23 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.256 -0.978 . . . . 0.0 111.842 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 30' ' ' TYR . . . . . 0.623 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 6.9 t80 -46.83 -58.26 4.09 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 118.906 -1.118 . . . . 0.0 110.887 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 31' ' ' GLN . . . . . 0.536 ' CD ' ' H ' ' S' ' 31' ' ' GLN . 0.0 OUTLIER -56.6 -18.26 11.36 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.211 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 32' ' ' ASN . . . . . 0.442 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -98.69 -17.38 18.59 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.926 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 33' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.8 OUTLIER 78.73 27.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.608 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -103.9 -13.76 16.25 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.017 179.955 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 24.8 p-80 -51.53 -24.63 5.46 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.387 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 36' ' ' LEU . . . . . 0.485 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.0 mt -70.64 -63.92 1.47 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 117.94 -1.504 . . . . 0.0 110.359 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 37' ' ' PRO . . . . . 0.485 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.6 Cg_endo -52.43 -33.67 57.93 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 120.719 0.946 . . . . 0.0 110.8 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.31 -41.28 63.73 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.02 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 39' ' ' LEU . . . . . 0.516 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.3 OUTLIER -51.55 -44.62 62.75 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.443 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 40' ' ' ASN . . . . . 0.551 ' O ' ' N ' ' R' ' 1' ' ' TRP . 1.0 OUTLIER -71.86 10.92 0.6 Allowed 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.608 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 41' ' ' LEU . . . . . 0.516 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.2 tp -106.87 -61.68 1.5 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.983 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 42' ' ' MET . . . . . 0.453 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 0.1 OUTLIER -100.16 39.34 1.35 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.196 -179.792 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 43' ' ' LEU . . . . . 0.479 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.3 OUTLIER 163.08 129.88 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 44' ' ' THR . . . . . 0.572 ' N ' ' CD ' ' S' ' 45' ' ' PRO . 0.3 OUTLIER 178.7 -35.72 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.665 0 C-N-CA 117.469 -1.693 . . . . 0.0 115.298 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 45' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' S' ' 44' ' ' THR . 18.8 Cg_endo -78.89 -109.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 120.81 1.006 . . . . 0.0 112.793 -179.497 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.57 -15.97 43.7 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.016 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 47' ' ' GLU . . . . . 0.408 ' O ' ' CB ' ' S' ' 51' ' ' LEU . 45.5 mt-10 -70.48 -57.4 4.82 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 119.334 -0.947 . . . . 0.0 110.298 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -55.09 -40.38 70.36 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.724 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.23 -66.14 0.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.147 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 50' ' ' ALA . . . . . 0.591 ' O ' HG21 ' S' ' 53' ' ' THR . . . -63.13 -33.13 74.81 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.778 -1.169 . . . . 0.0 111.044 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 51' ' ' LEU . . . . . 0.408 ' CB ' ' O ' ' S' ' 47' ' ' GLU . 1.7 tt -50.42 -28.71 8.69 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 52' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' S' ' 50' ' ' ALA . . . -83.05 -39.14 10.35 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 112.695 -2.048 . . . . 0.0 114.002 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 53' ' ' THR . . . . . 0.591 HG21 ' O ' ' S' ' 50' ' ' ALA . 0.5 OUTLIER -55.04 -60.46 3.34 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 116.039 -2.264 . . . . 0.0 108.309 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 54' ' ' ARG . . . . . 0.416 ' O ' ' CG2' ' S' ' 58' ' ' VAL . 3.0 ptp180 -48.56 -45.12 37.25 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.416 -1.314 . . . . 0.0 109.665 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 97.7 t -67.71 -21.91 27.8 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 C-N-CA 116.949 -1.9 . . . . 0.0 109.125 179.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 56' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' S' ' 53' ' ' THR . 2.4 ptt180 -83.29 -42.64 16.92 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 118.672 -1.211 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 57' ' ' ILE . . . . . 0.45 ' CD1' ' C ' ' S' ' 57' ' ' ILE . 0.0 OUTLIER -70.81 -31.93 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 115.99 -2.284 . . . . 0.0 105.745 -179.803 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 58' ' ' VAL . . . . . 0.42 ' N ' ' CD1' ' S' ' 57' ' ' ILE . 24.4 t -57.64 -63.83 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 118.541 -1.263 . . . . 0.0 108.307 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -43.79 -26.86 0.28 Allowed 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.205 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 60' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' S' ' 60' ' ' GLU . 0.0 OUTLIER -88.36 -32.92 18.14 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.585 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 61' ' ' LEU . . . . . 0.611 ' C ' ' H ' ' S' ' 63' ' ' ARG . 0.5 OUTLIER -55.09 -20.79 10.66 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 117.254 -1.779 . . . . 0.0 106.623 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 62' ' ' LEU . . . . . 0.705 ' O ' ' N ' ' S' ' 64' ' ' GLY . 0.6 OUTLIER -78.28 30.14 0.18 Allowed 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.874 -1.512 . . . . 0.0 107.736 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 63' ' ' ARG . . . . . 0.611 ' H ' ' C ' ' S' ' 61' ' ' LEU . 0.4 OUTLIER -30.29 -14.03 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 64' ' ' GLY . . . . . 0.705 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -37.91 -27.96 0.04 OUTLIER Glycine 0 N--CA 1.496 2.696 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 65' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' S' ' 63' ' ' ARG . 31.7 mt-10 -102.66 -63.94 1.12 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.222 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 2.5 ttt -162.88 153.39 16.58 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 118.767 -1.173 . . . . 0.0 112.257 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 67' ' ' SER . . . . . 0.402 ' OG ' ' CB ' ' S' ' 63' ' ' ARG . 1.1 p 171.91 82.53 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 68' ' ' GLN . . . . . 0.534 ' C ' ' H ' ' S' ' 70' ' ' GLU . 6.7 pt20 -115.1 -40.83 3.41 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.932 -1.031 . . . . 0.0 113.402 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.74 28.03 0.05 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.622 -0.831 . . . . 0.0 112.493 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 70' ' ' GLU . . . . . 0.534 ' H ' ' C ' ' S' ' 68' ' ' GLN . 9.2 mm-40 -83.93 -66.46 0.89 Allowed 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.043 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 71' ' ' LEU . . . . . 0.533 ' C ' ' O ' ' S' ' 70' ' ' GLU . 2.0 mp -8.14 116.24 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.21 0 O-C-N 124.743 1.277 . . . . 0.0 112.707 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.68 147.37 0.3 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -125.92 -92.13 0.51 Allowed 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.22 -1.355 . . . . 0.0 109.318 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 74' ' ' GLU . . . . . 0.46 ' HG3' ' H ' ' S' ' 75' ' ' LEU . 0.0 OUTLIER -171.75 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.301 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.87 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 75' ' ' LEU . . . . . 0.46 ' H ' ' HG3' ' S' ' 74' ' ' GLU . 1.7 tm? -112.99 -15.98 12.75 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -46.8 -59.86 5.24 Favored Glycine 0 N--CA 1.479 1.526 0 C-N-CA 119.307 -1.425 . . . . 0.0 109.834 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.0 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 117.443 -1.703 . . . . 0.0 114.714 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.62 134.74 6.75 Favored Glycine 0 N--CA 1.501 2.968 0 N-CA-C 106.717 -2.553 . . . . 0.0 106.717 -179.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 79' ' ' ILE . . . . . 0.564 ' O ' ' N ' ' S' ' 81' ' ' THR . 0.0 OUTLIER -56.97 -34.96 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 C-N-CA 118.397 -1.321 . . . . 0.0 112.95 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 80' ' ' ALA . . . . . 0.495 ' C ' ' O ' ' S' ' 79' ' ' ILE . . . -35.3 -31.08 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.366 -0.934 . . . . 0.0 109.378 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 81' ' ' THR . . . . . 0.564 ' N ' ' O ' ' S' ' 79' ' ' ILE . 0.2 OUTLIER -78.16 -60.39 2.39 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 114.299 -1.318 . . . . 0.0 111.344 179.683 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 1.5 pt -63.62 -10.91 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.783 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.66 -51.02 15.52 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.2 -1.8 . . . . 0.0 109.549 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 84' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 85' ' ' GLY . 1.8 mpt_? -48.93 -70.88 0.08 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.027 0.918 . . . . 0.0 110.669 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 85' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' S' ' 84' ' ' ARG . . . -20.11 -55.84 0.01 OUTLIER Glycine 0 N--CA 1.487 2.073 0 CA-C-N 113.017 -1.901 . . . . 0.0 114.346 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 86' ' ' SER . . . . . 0.569 ' C ' ' H ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -86.39 -61.83 1.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 118.215 -1.394 . . . . 0.0 112.905 -179.776 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -56.73 5.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.235 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 88' ' ' SER . . . . . 0.569 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -52.61 -36.33 56.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.849 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 89' ' ' LEU . . . . . 0.594 ' H ' ' CD1' ' S' ' 89' ' ' LEU . 2.4 mp -75.46 -54.21 7.41 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.957 -1.097 . . . . 0.0 110.872 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 90' ' ' LYS . . . . . 0.464 ' O ' ' C ' ' S' ' 91' ' ' ALA . 23.8 mttt -45.28 -64.05 0.8 Allowed 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.67 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 91' ' ' ALA . . . . . 0.464 ' C ' ' O ' ' S' ' 90' ' ' LYS . . . -23.76 -66.76 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 113.676 -1.602 . . . . 0.0 112.914 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 92' ' ' ALA . . . . . 0.402 ' N ' ' HD2' ' S' ' 93' ' ' PRO . . . 178.39 -51.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.52 0 C-N-CA 118.792 -1.163 . . . . 0.0 113.181 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 93' ' ' PRO . . . . . 0.402 ' HD2' ' N ' ' S' ' 92' ' ' ALA . 5.6 Cg_exo -58.36 97.51 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.829 0 C-N-CA 120.66 0.906 . . . . 0.0 111.807 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 94' ' ' VAL . . . . . 0.405 ' O ' ' CG1' ' S' ' 94' ' ' VAL . 28.8 t -110.86 -12.4 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -78.14 -28.81 48.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.209 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 71.3 mt -46.55 -33.3 4.0 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.719 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.76 -36.95 85.57 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.771 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -65.31 -31.34 72.42 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.659 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 99' ' ' TRP . . . . . 0.423 ' O ' ' C ' ' S' ' 100' ' ' LEU . 14.2 t90 -86.8 -58.73 2.49 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.988 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 100' ' ' LEU . . . . . 0.519 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -36.72 -38.29 0.17 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.352 -0.939 . . . . 0.0 112.929 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 101' ' ' GLU . . . . . 0.519 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.8 mt-10 -41.43 -44.82 2.97 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 102' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' S' ' 99' ' ' TRP . 1.8 tt0 -75.8 -33.77 60.15 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.493 -1.685 . . . . 0.0 111.49 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 103' ' ' VAL . . . . . 0.432 ' N ' ' O ' ' S' ' 100' ' ' LEU . 3.6 t -85.16 -52.63 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 116.881 -1.928 . . . . 0.0 111.707 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' S' S ' 104' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' S' ' 100' ' ' LEU . 0.9 OUTLIER -56.54 -57.3 12.94 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.935 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 95.1 mt -51.13 -68.11 0.2 Allowed 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.445 -1.302 . . . . 0.0 110.473 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mttp -44.85 -56.86 4.16 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.651 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 116.399 -1.762 . . . . 0.0 110.848 179.99 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' R' R ' 1' ' ' TRP . . . . . 0.551 ' N ' ' O ' ' S' ' 40' ' ' ASN . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.286 0 CA-C-O 116.37 -1.776 . . . . 0.0 110.175 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' R' R ' 109' ' ' TRP . . . . . 0.532 ' N ' ' O ' ' R' ' 40' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 116.319 -1.8 . . . . 0.0 110.615 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.072 0.463 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -144.21 -11.08 0.64 Allowed 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.18 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -90.09 -72.38 0.57 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -49.26 -35.28 17.24 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -51.05 -62.52 1.56 Allowed 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 113.628 -1.624 . . . . 0.0 107.2 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tp -45.79 -38.09 6.76 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 112.938 -1.937 . . . . 0.0 110.316 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' R' ' 22' ' ' PHE . 26.5 mmt180 -55.93 -66.42 0.43 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 117.17 -1.812 . . . . 0.0 107.69 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.454 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -39.35 -43.24 1.15 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.068 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 23' ' ' VAL . . . . . 0.463 ' O ' ' N ' ' R' ' 26' ' ' LEU . 40.4 t -68.11 -70.67 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 119.384 -0.927 . . . . 0.0 111.108 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' R' ' 23' ' ' VAL . 4.7 t0 -25.98 -48.83 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.19 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.689 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -77.3 -45.71 25.34 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 117.017 -1.873 . . . . 0.0 109.322 -179.923 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 26' ' ' LEU . . . . . 0.662 HD12 ' C ' ' R' ' 26' ' ' LEU . 0.2 OUTLIER -47.12 -52.74 14.57 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.101 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 27' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' R' ' 29' ' ' ALA . 18.4 tptm -66.95 -68.46 0.37 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.103 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -41.86 -20.51 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.241 -0.984 . . . . 0.0 112.071 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.487 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -83.59 -54.22 5.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -43.79 -25.97 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.939 -1.104 . . . . 0.0 110.346 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 31' ' ' GLN . . . . . 0.413 ' N ' ' C ' ' R' ' 29' ' ' ALA . 2.6 tt0 -50.8 -41.92 57.63 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.548 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -106.1 -72.17 0.72 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.813 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 33' ' ' ASP . . . . . 0.631 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.7 OUTLIER 170.7 17.43 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.049 -1.06 . . . . 0.0 112.881 -179.746 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 34' ' ' LEU . . . . . 1.022 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.0 OUTLIER -92.69 -10.53 36.86 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.251 -1.379 . . . . 0.0 110.614 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 35' ' ' HIS . . . . . 0.444 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 11.0 p-80 -44.47 -30.88 0.94 Allowed 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.446 -0.901 . . . . 0.0 112.929 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 36' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.68 -58.11 5.96 Favored Pre-proline 0 N--CA 1.487 1.409 0 C-N-CA 117.884 -1.526 . . . . 0.0 109.906 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 37' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.18 -29.98 89.15 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 C-N-CA 119.923 0.415 . . . . 0.0 111.618 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.53 -45.97 34.91 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.694 -0.803 . . . . 0.0 109.283 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 43' ' ' LEU . 0.2 OUTLIER -45.87 -44.15 14.2 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.777 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -70.21 -16.48 63.07 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.16 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tp -78.62 -48.61 14.76 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.738 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.13 47.39 2.42 Favored 'General case' 0 N--CA 1.511 2.593 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.512 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 43' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER 173.26 117.47 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.387 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.614 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -35.86 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.513 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.614 ' CD ' ' H ' ' R' ' 44' ' ' THR . 32.9 Cg_endo -80.91 -101.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.363 0 C-N-CA 121.154 1.236 . . . . 0.0 114.197 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -53.44 -18.92 3.02 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.516 ' OE2' ' NH1' ' S' ' 54' ' ' ARG . 0.4 OUTLIER -63.76 -65.74 0.64 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.395 -1.73 . . . . 0.0 109.832 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 48' ' ' ARG . . . . . 0.461 ' NH2' ' O ' ' S' ' 15' ' ' ARG . 2.7 mmm180 -51.62 -30.56 21.88 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 118.773 -1.171 . . . . 0.0 110.912 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 49' ' ' GLU . . . . . 0.435 ' O ' ' OG1' ' R' ' 53' ' ' THR . 4.6 mt-10 -82.89 -72.81 0.43 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -62.19 -43.03 99.74 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 51' ' ' LEU . . . . . 0.678 ' C ' HD12 ' R' ' 51' ' ' LEU . 0.2 OUTLIER -58.51 -46.84 85.92 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 117.986 -1.486 . . . . 0.0 111.248 -179.802 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 52' ' ' GLY . . . . . 0.413 ' N ' ' HG ' ' R' ' 51' ' ' LEU . . . -53.95 -59.26 10.14 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 107.496 -2.241 . . . . 0.0 107.496 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.528 ' O ' HG23 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -34.3 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.183 -1.008 . . . . 0.0 112.239 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.459 ' O ' HG12 ' R' ' 58' ' ' VAL . 0.0 OUTLIER -41.77 -56.42 2.68 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.644 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 14.9 p -67.01 -18.86 24.87 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 114.956 -2.698 . . . . 0.0 110.548 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' R' ' 60' ' ' GLU . 0.0 OUTLIER -93.02 -29.38 15.85 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 118.016 -1.474 . . . . 0.0 112.418 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 0.67 HD12 ' C ' ' R' ' 57' ' ' ILE . 0.2 OUTLIER -76.31 -41.43 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 115.663 -2.415 . . . . 0.0 106.872 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 0.609 HG13 ' N ' ' R' ' 59' ' ' GLU . 7.3 p -66.33 -52.94 41.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 117.391 -1.724 . . . . 0.0 110.822 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.609 ' N ' HG13 ' R' ' 58' ' ' VAL . 5.7 tt0 -64.03 -12.99 43.57 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.33 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 60' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' R' ' 56' ' ' ARG . 3.4 mm-40 -78.97 -52.3 8.44 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.739 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 pp -89.4 -25.85 21.33 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.067 -1.453 . . . . 0.0 111.554 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp . . . . . 0 N--CA 1.486 1.336 0 C-N-CA 118.321 -1.351 . . . . 0.0 110.696 179.997 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.54 1.01 46.76 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.867 -1.159 . . . . 0.0 113.958 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.845 ' H ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -122.11 -72.98 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.824 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.534 ' O ' ' N ' ' R' ' 82' ' ' ILE . . . -102.34 -71.28 0.72 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -37.09 -21.13 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 82' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -79.75 -31.26 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 118.118 -1.433 . . . . 0.0 112.389 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.35 19.71 16.14 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 84' ' ' ARG . . . . . 0.501 HH22 ' CD1' ' S' ' 41' ' ' LEU . 0.1 OUTLIER -93.46 -39.74 10.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 117.575 -1.65 . . . . 0.0 107.804 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 85' ' ' GLY . . . . . 0.418 ' N ' ' CD ' ' R' ' 84' ' ' ARG . . . -40.57 -24.72 0.08 OUTLIER Glycine 0 N--CA 1.481 1.699 0 CA-C-N 113.48 -1.691 . . . . 0.0 110.561 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 86' ' ' SER . . . . . 0.478 ' N ' ' O ' ' R' ' 84' ' ' ARG . 1.8 t -81.48 -70.3 0.55 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.281 -0.968 . . . . 0.0 110.312 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -60.26 -3.59 0.65 Allowed 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.97 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 88' ' ' SER . . . . . 0.477 ' HA ' ' HB3' ' R' ' 91' ' ' ALA . 0.6 OUTLIER -48.48 -26.73 2.29 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.98 -1.088 . . . . 0.0 110.698 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -41.18 -42.12 1.98 Allowed 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.957 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.97 -50.26 3.03 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.799 0.809 . . . . 0.0 110.399 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 91' ' ' ALA . . . . . 0.477 ' HB3' ' HA ' ' R' ' 88' ' ' SER . . . -39.26 -55.34 1.71 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.351 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -63.45 162.77 23.44 Favored Pre-proline 0 N--CA 1.489 1.503 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.814 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 93' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 1.5 Cg_endo -56.82 170.04 1.58 Allowed 'Trans proline' 0 C--N 1.316 -1.143 0 C-N-CA 121.02 1.146 . . . . 0.0 111.593 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 94' ' ' VAL . . . . . 0.445 ' C ' ' H ' ' R' ' 96' ' ' LEU . 79.5 t -93.98 -31.08 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.797 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.47 3.6 0.93 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.894 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 96' ' ' LEU . . . . . 0.486 HD13 ' HG2' ' R' ' 93' ' ' PRO . 1.3 tp -84.69 -44.93 12.95 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.593 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -59.07 -24.32 62.8 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.764 -0.775 . . . . 0.0 109.543 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -63.25 -40.08 96.41 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.435 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.635 ' CE3' HG21 ' R' ' 103' ' ' VAL . 7.3 t90 -101.2 -60.04 1.59 Allowed 'General case' 0 N--CA 1.512 2.672 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.327 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -43.67 -19.74 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 118.386 -1.325 . . . . 0.0 113.57 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.455 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.2 mm-40 -53.23 -37.13 61.79 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 102' ' ' GLU . . . . . 0.418 ' N ' ' C ' ' R' ' 100' ' ' LEU . 3.7 mt-10 -86.81 -37.66 17.57 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 111.622 -2.535 . . . . 0.0 114.556 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.635 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.0 t -82.62 -9.53 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 116.08 -2.248 . . . . 0.0 111.69 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 tp -94.37 -56.2 2.9 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.12 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' R' R ' 105' ' ' LEU . . . . . 0.654 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.4 OUTLIER -68.3 -27.17 66.06 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.847 -1.141 . . . . 0.0 111.548 -179.643 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 27.2 tttp . . . . . 0 N--CA 1.488 1.425 0 C-N-CA 119.111 -1.036 . . . . 0.0 110.438 179.89 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' S' S ' 15' ' ' ARG . . . . . 0.461 ' O ' ' NH2' ' R' ' 48' ' ' ARG . 4.1 mtt180 . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.798 0.333 . . . . 0.0 110.656 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -157.32 -0.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.223 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.444 ' C ' ' N ' ' S' ' 19' ' ' TRP . 6.1 mt-30 -95.4 -83.33 0.36 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.833 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' S' ' 17' ' ' GLN . 9.2 pt-20 -45.22 -30.52 1.23 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 19' ' ' TRP . . . . . 0.444 ' N ' ' C ' ' S' ' 17' ' ' GLN . 62.4 t-105 -55.89 -64.01 0.99 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.146 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 20' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' S' ' 24' ' ' ASP . 6.5 tp -48.14 -36.71 13.92 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.92 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' S' ' 22' ' ' PHE . 17.6 mmt180 -56.53 -67.39 0.31 Allowed 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 117.383 -1.727 . . . . 0.0 106.361 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.459 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -37.55 -47.29 0.91 Allowed 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.58 178.924 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.433 HG23 ' CD2' ' S' ' 22' ' ' PHE . 48.6 t -74.27 -74.7 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.594 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' S' ' 20' ' ' LEU . 14.3 t0 -37.1 -41.73 0.38 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.596 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.517 HD23 ' SD ' ' S' ' 42' ' ' MET . 58.6 tp -60.62 -53.11 61.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.07 -61.51 2.34 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.361 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 21.8 tptp -39.67 -53.97 2.1 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.047 -0.661 . . . . 0.0 112.572 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -65.97 -25.28 67.03 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.473 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 29' ' ' ALA . . . . . 0.549 ' HB1' HD13 ' S' ' 34' ' ' LEU . . . -82.99 -48.95 10.08 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.875 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 30' ' ' TYR . . . . . 0.485 ' CE2' ' NE2' ' S' ' 35' ' ' HIS . 9.4 t80 -42.09 -21.7 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.916 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 31' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' S' ' 29' ' ' ALA . 0.9 OUTLIER -69.63 -47.18 64.29 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.926 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.8 OUTLIER -74.72 -27.74 60.5 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.504 -0.879 . . . . 0.0 109.293 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.5 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 1.3 t70 86.49 50.72 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.479 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 34' ' ' LEU . . . . . 0.58 ' CD1' ' N ' ' S' ' 34' ' ' LEU . 0.0 OUTLIER -136.08 14.62 3.3 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.708 1.242 . . . . 0.0 109.223 179.672 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 35' ' ' HIS . . . . . 0.485 ' NE2' ' CE2' ' S' ' 30' ' ' TYR . 31.1 p-80 -61.73 -19.15 62.11 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 112.904 -1.953 . . . . 0.0 111.526 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' S' ' 36' ' ' LEU . 7.8 mt -69.61 -59.01 5.09 Favored Pre-proline 0 N--CA 1.483 1.184 0 C-N-CA 118.894 -1.122 . . . . 0.0 109.213 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -54.31 -34.83 81.77 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 N-CA-C 110.115 -0.763 . . . . 0.0 110.115 179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 38' ' ' LEU . . . . . 0.474 HD22 HD21 ' S' ' 25' ' ' LEU . 19.5 mt -72.13 -40.45 68.07 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 118.991 -1.084 . . . . 0.0 110.523 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.494 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.4 OUTLIER -50.61 -50.8 53.15 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-O 121.523 0.678 . . . . 0.0 109.315 179.644 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.49 -6.06 0.26 Allowed 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.349 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 41' ' ' LEU . . . . . 0.501 ' CD1' HH22 ' R' ' 84' ' ' ARG . 1.8 tp -100.43 -67.87 0.84 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.901 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 42' ' ' MET . . . . . 0.517 ' SD ' HD23 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -70.6 -3.88 20.43 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.658 -1.217 . . . . 0.0 111.172 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 43' ' ' LEU . . . . . 0.448 ' O ' ' O ' ' S' ' 39' ' ' LEU . 1.5 mp -157.0 132.91 9.52 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.177 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.597 ' H ' ' CD ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -170.42 -30.45 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 115.916 -2.314 . . . . 0.0 116.407 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.597 ' CD ' ' H ' ' S' ' 44' ' ' THR . 34.1 Cg_endo -99.03 -102.97 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.398 0 CA-C-N 119.277 0.777 . . . . 0.0 113.701 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.44 -16.75 2.48 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 118.142 -1.423 . . . . 0.0 107.831 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 47' ' ' GLU . . . . . 0.457 ' N ' ' C ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -68.27 -67.48 0.46 Allowed 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.554 -1.203 . . . . 0.0 107.804 179.498 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.56 -33.81 0.5 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.927 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 49' ' ' GLU . . . . . 0.441 ' O ' ' OG1' ' S' ' 53' ' ' THR . 4.2 mt-10 -84.79 -67.83 0.77 Allowed 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 119.536 -0.866 . . . . 0.0 113.041 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 50' ' ' ALA . . . . . 0.574 ' HB1' HH12 ' S' ' 54' ' ' ARG . . . -45.88 -23.67 0.31 Allowed 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.195 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 51' ' ' LEU . . . . . 0.411 ' C ' ' N ' ' S' ' 53' ' ' THR . 4.2 mp -77.46 -56.74 4.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.086 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -21.63 4.07 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 118.635 -1.745 . . . . 0.0 109.434 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.441 ' OG1' ' O ' ' S' ' 49' ' ' GLU . 0.1 OUTLIER -73.64 -78.67 0.09 Allowed 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 114.173 -1.013 . . . . 0.0 111.007 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.574 HH12 ' HB1' ' S' ' 50' ' ' ALA . 23.3 mtt85 -41.58 -26.99 0.08 Allowed 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.742 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 98.7 t -80.0 -41.5 21.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 C-N-CA 119.022 -1.071 . . . . 0.0 108.845 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' S' ' 53' ' ' THR . 19.7 mtt180 -58.33 -50.61 73.01 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 116.993 -1.883 . . . . 0.0 107.34 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -66.57 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 C-N-CA 117.035 -1.866 . . . . 0.0 111.293 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 52.0 t -42.93 -64.45 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 C-N-CA 118.424 -1.31 . . . . 0.0 113.318 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -48.55 -46.7 39.23 Favored 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.985 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.74 -30.63 70.16 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 119.297 -0.961 . . . . 0.0 112.227 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.15 -27.46 69.39 Favored 'General case' 0 C--N 1.284 -2.252 0 C-N-CA 118.467 -1.293 . . . . 0.0 110.757 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 62' ' ' LEU . . . . . 0.624 HD13 HD21 ' S' ' 104' ' ' LEU . 4.9 mt -81.87 -62.91 1.5 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 116.479 2.029 . . . . 0.0 116.479 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 . . . . . 0 N--CA 1.504 2.234 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.814 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' S' S ' 72' ' ' LYS . . . . . 0.788 ' C ' ' H ' ' S' ' 74' ' ' GLU . 14.8 tttt . . . . . 0 N--CA 1.525 3.282 1 N-CA-C 122.063 4.097 . . . . 0.0 122.063 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . 0.26 0.2 OUTLIER -74.1 18.18 0.15 Allowed 'General case' 0 N--CA 1.519 2.989 0 O-C-N 118.418 -2.677 . . . . 0.0 108.844 179.455 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 74' ' ' GLU . . . . . 0.788 ' H ' ' C ' ' S' ' 72' ' ' LYS 0.363 0.0 OUTLIER 40.81 -51.1 0.0 OUTLIER 'General case' 1 N--CA 1.58 6.033 1 N-CA-C 126.846 5.869 . . . . 0.0 126.846 -171.986 . . . . . . . . 6 4 . 1 . 001 nuclear build core ' S' S ' 75' ' ' LEU . . . . . 0.501 HD12 ' N ' ' S' ' 76' ' ' GLY . 3.4 pp -91.29 -20.36 21.97 Favored 'General case' 0 C--N 1.267 -2.982 0 CA-C-N 118.796 0.725 . . . . 0.0 112.039 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 76' ' ' GLY . . . . . 0.501 ' N ' HD12 ' S' ' 75' ' ' LEU . . . -82.18 -16.38 72.03 Favored Glycine 1 N--CA 1.548 6.125 0 CA-C-N 112.728 -2.033 . . . . 0.0 115.106 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -136.72 -69.18 0.47 Allowed 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 115.923 -2.311 . . . . 0.0 113.344 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 78' ' ' GLY . . . . . 0.439 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 149.12 127.72 1.61 Allowed Glycine 0 CA--C 1.456 -3.644 1 N-CA-C 98.104 -5.999 . . . . 0.0 98.104 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.21 -22.61 27.71 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.211 1 C-N-CA 111.581 -4.047 . . . . 0.0 106.397 -178.572 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.478 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -63.66 -37.32 86.88 Favored 'General case' 0 N--CA 1.511 2.619 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 81' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' S' ' 78' ' ' GLY . 9.1 p -53.67 -55.94 21.62 Favored 'General case' 0 C--N 1.297 -1.683 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.296 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 82' ' ' ILE . . . . . 0.468 HG21 HD13 ' S' ' 82' ' ' ILE 0.37 0.3 OUTLIER -63.28 11.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 117.812 2.523 . . . . 0.0 117.812 -178.761 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -96.55 -62.28 1.29 Allowed 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 118.402 -1.319 . . . . 0.0 108.063 178.686 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 84' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -52.34 -23.7 6.34 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 118.357 -1.337 . . . . 0.0 109.006 179.241 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.63 -11.1 59.45 Favored Glycine 0 N--CA 1.498 2.825 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.386 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -100.49 -23.16 14.78 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 87' ' ' ASN . . . . . 0.462 ' C ' ' N ' ' S' ' 89' ' ' LEU . 4.5 m120 -105.49 -3.8 22.05 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.573 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 88' ' ' SER . . . . . 0.51 ' N ' ' O ' ' S' ' 84' ' ' ARG . 0.2 OUTLIER -62.01 -15.6 45.36 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 89' ' ' LEU . . . . . 0.462 ' N ' ' C ' ' S' ' 87' ' ' ASN . 3.4 mt -71.72 -78.9 0.08 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.221 -1.809 . . . . 0.0 111.366 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -53.96 -66.61 0.36 Allowed 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.54 0.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 160.04 76.9 Favored Pre-proline 0 N--CA 1.501 2.085 0 C-N-CA 118.482 -1.287 . . . . 0.0 110.359 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -68.27 158.22 58.46 Favored 'Trans proline' 0 C--N 1.324 -0.723 0 N-CA-C 108.29 -1.465 . . . . 0.0 108.29 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 94' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' S' ' 96' ' ' LEU . 36.4 t -88.04 -65.12 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.353 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -45.37 -12.39 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 C-N-CA 119.065 -1.054 . . . . 0.0 112.783 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 96' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' S' ' 94' ' ' VAL . 0.9 OUTLIER -65.59 -34.95 79.42 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.04 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -54.08 -24.18 16.51 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.559 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -82.81 -28.92 29.9 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 118.516 -1.274 . . . . 0.0 110.814 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.712 ' CE3' HG21 ' S' ' 103' ' ' VAL . 6.2 t90 -90.34 -56.25 3.28 Favored 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.518 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.611 HD12 HD23 ' S' ' 104' ' ' LEU . 1.6 mm? -40.18 -31.58 0.14 Allowed 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 118.954 -1.098 . . . . 0.0 113.829 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.484 ' C ' ' O ' ' S' ' 100' ' ' LEU . 42.5 mt-10 -46.72 -39.7 12.05 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 105.02 -2.215 . . . . 0.0 105.02 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -86.01 -32.76 21.31 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 112.79 -2.004 . . . . 0.0 114.333 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.712 HG21 ' CE3' ' S' ' 99' ' ' TRP . 2.8 t -90.64 -2.43 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 116.64 -2.024 . . . . 0.0 113.125 -179.294 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 104' ' ' LEU . . . . . 0.624 HD21 HD13 ' S' ' 62' ' ' LEU . 0.2 OUTLIER -109.06 -49.36 3.14 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.92 -179.922 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' S' S ' 105' ' ' LEU . . . . . 0.433 ' N ' ' CD2' ' S' ' 105' ' ' LEU . 3.9 mm? -69.04 -64.2 0.91 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 118.832 -1.147 . . . . 0.0 109.602 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -57.83 10.49 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.646 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 116.371 -1.776 . . . . 0.0 109.858 -179.996 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmm-85 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 120.702 0.287 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -147.94 -2.2 0.55 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.934 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.416 ' C ' ' N ' ' R' ' 19' ' ' TRP . 2.7 mt-30 -83.88 -80.24 0.19 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.022 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 18' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' R' ' 17' ' ' GLN . 5.3 mt-10 -44.2 -31.5 1.0 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 122.708 1.242 . . . . 0.0 108.666 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 19' ' ' TRP . . . . . 0.416 ' N ' ' C ' ' R' ' 17' ' ' GLN . 74.7 t-105 -56.82 -61.5 2.39 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.78 -2.009 . . . . 0.0 110.823 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 tt -48.11 -24.89 1.24 Allowed 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.533 ' O ' ' N ' ' R' ' 23' ' ' VAL . 10.1 mmt180 -69.78 -70.61 0.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.017 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.472 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.35 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.318 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 23' ' ' VAL . . . . . 0.533 ' N ' ' O ' ' R' ' 21' ' ' ARG . 48.9 t -75.22 -55.88 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.323 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -38.64 -52.84 1.65 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.459 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.413 ' N ' HD23 ' R' ' 25' ' ' LEU . 0.5 OUTLIER -64.38 -55.85 18.33 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.698 -1.201 . . . . 0.0 110.432 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 26' ' ' LEU . . . . . 0.501 HD11 HD11 ' R' ' 39' ' ' LEU . 0.4 OUTLIER -63.54 -7.05 6.04 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.149 -179.91 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -83.66 -36.15 24.01 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 118.882 -1.127 . . . . 0.0 112.821 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -113.08 -0.14 14.8 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 119.69 -0.804 . . . . 0.0 113.098 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 30' ' ' TYR . . . -80.2 -53.17 6.92 Favored 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 118.884 -1.127 . . . . 0.0 112.647 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 30' ' ' TYR . . . . . 0.436 ' C ' ' O ' ' R' ' 29' ' ' ALA . 14.8 t80 -30.75 -46.63 0.08 Allowed 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -58.7 -52.43 65.71 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.346 -0.942 . . . . 0.0 111.191 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 32' ' ' ASN . . . . . 0.507 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 15.9 m120 -78.03 -12.14 59.96 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.245 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 33' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.9 t70 78.91 36.24 0.18 Allowed 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.233 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -99.48 -15.04 18.83 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.022 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 35' ' ' HIS . . . . . 0.446 ' O ' HD13 ' R' ' 39' ' ' LEU . 29.4 p-80 -52.42 -31.67 35.4 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.358 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' R' ' 36' ' ' LEU . 5.8 mt -69.95 -61.52 2.88 Favored Pre-proline 0 C--N 1.303 -1.431 0 C-N-CA 117.849 -1.541 . . . . 0.0 111.768 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 1.5 Cg_endo -54.3 -25.44 38.88 Favored 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 120.493 0.795 . . . . 0.0 111.208 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 46.5 mt -85.26 -35.81 21.3 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.123 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.501 HD11 HD11 ' R' ' 26' ' ' LEU . 0.1 OUTLIER -53.91 -36.15 62.42 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.514 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 12.6 m-20 -73.31 4.57 4.46 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.012 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 41' ' ' LEU . . . . . 0.437 HD12 HD23 ' R' ' 38' ' ' LEU . 50.3 mt -110.68 -67.32 1.0 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.857 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.0 OUTLIER -83.8 40.29 0.73 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.778 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -154.92 165.84 35.43 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.626 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.651 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.293 0.2 OUTLIER -121.76 -151.69 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.353 -179.785 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.651 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.8 Cg_endo -101.09 -37.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.33 -0.444 0 N-CA-C 109.953 -0.826 . . . . 0.0 109.953 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -26.2 63.8 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.709 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.422 ' O ' ' CB ' ' R' ' 51' ' ' LEU . 4.7 mm-40 -64.46 -51.0 65.27 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -51.73 -38.76 56.65 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 119.141 -1.023 . . . . 0.0 110.327 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 49' ' ' GLU . . . . . 0.447 ' O ' ' OG1' ' R' ' 53' ' ' THR . 1.2 tt0 -74.66 -67.84 0.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.164 -1.015 . . . . 0.0 112.101 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.505 ' HB1' HH21 ' R' ' 54' ' ' ARG . . . -56.36 -41.35 76.02 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.042 -0.663 . . . . 0.0 112.718 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 51' ' ' LEU . . . . . 0.422 ' CB ' ' O ' ' R' ' 47' ' ' GLU . 0.9 OUTLIER -53.5 -66.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.67 -44.62 6.89 Favored Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.295 -1.431 . . . . 0.0 109.941 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.546 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -49.02 -80.45 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.964 179.893 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.505 HH21 ' HB1' ' R' ' 50' ' ' ALA . 38.1 mtt-85 -37.53 -34.36 0.09 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.849 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -77.56 -32.62 18.51 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 118.197 -1.401 . . . . 0.0 110.446 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -79.8 -35.47 38.42 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.258 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 0.937 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.84 -36.37 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 117.641 -1.624 . . . . 0.0 108.941 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 0.937 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.3 t -61.76 -61.44 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 118.295 -1.362 . . . . 0.0 109.141 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.508 ' N ' HG12 ' R' ' 58' ' ' VAL . 1.3 mm-40 -45.9 -44.42 14.57 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.813 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -52.93 -52.26 58.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.106 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 65.8 mt -76.4 -1.66 28.06 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.619 -0.832 . . . . 0.0 111.53 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.489 1.478 0 C-N-CA 119.701 -0.799 . . . . 0.0 112.138 179.978 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.796 0.331 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.99 143.09 7.64 Favored Glycine 0 N--CA 1.493 2.464 0 C-N-CA 119.364 -1.398 . . . . 0.0 111.159 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.854 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.47 -42.23 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.226 -179.914 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.471 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.33 -65.98 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.594 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 50.3 m -36.15 -45.82 0.47 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 22.6 pt -72.87 -36.68 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 118.962 -1.095 . . . . 0.0 112.612 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.471 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -52.51 -72.31 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.814 -1.154 . . . . 0.0 111.145 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 84' ' ' ARG . . . . . 0.416 ' H ' ' HD2' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -54.89 -14.9 1.62 Allowed 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.486 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.18 -59.48 7.86 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.342 -1.408 . . . . 0.0 110.229 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 86' ' ' SER . . . . . 0.471 ' C ' ' H ' ' R' ' 88' ' ' SER . 100.0 p -88.0 -43.88 11.41 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.781 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.64 8.65 0.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.49 -0.884 . . . . 0.0 110.847 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 88' ' ' SER . . . . . 0.526 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.4 OUTLIER -68.92 -23.59 64.19 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.622 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 89' ' ' LEU . . . . . 0.465 ' C ' ' O ' ' R' ' 88' ' ' SER . 10.2 mt -30.87 -34.9 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.69 0.619 . . . . 0.0 112.022 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 90' ' ' LYS . . . . . 0.526 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -110.14 -64.82 1.22 Allowed 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.63 0.728 . . . . 0.0 111.413 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' R' R ' 91' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.23 -37.86 0.06 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.025 -1.443 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.428 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -56.58 159.21 7.04 Favored Pre-proline 0 N--CA 1.49 1.561 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.859 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 93' ' ' PRO . . . . . 0.428 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 3.1 Cg_exo -59.62 169.55 4.19 Favored 'Trans proline' 0 C--N 1.325 -0.672 0 C-N-CA 121.257 1.304 . . . . 0.0 111.333 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 63.9 t -108.98 -21.43 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.182 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -94.11 -1.15 54.74 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 119.363 -0.935 . . . . 0.0 111.12 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.55 -31.03 12.53 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.879 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -37.65 71.29 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.442 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -66.38 -10.32 42.21 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.311 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.71 ' CE3' HG21 ' R' ' 103' ' ' VAL . 5.9 t90 -97.87 -62.24 1.27 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.553 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.516 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -39.43 -38.09 0.53 Allowed 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.516 ' C ' ' O ' ' R' ' 100' ' ' LEU . 1.1 mm-40 -41.57 -38.61 1.38 Allowed 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 117.928 -1.509 . . . . 0.0 107.806 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -90.6 -27.2 19.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.484 -1.689 . . . . 0.0 112.868 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.71 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.6 t -87.97 -9.19 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 117.26 -1.776 . . . . 0.0 111.023 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -98.61 -52.97 3.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.018 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' R' R ' 105' ' ' LEU . . . . . 0.48 HD22 ' N ' ' R' ' 105' ' ' LEU . 4.5 mm? -70.29 -68.51 0.42 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.74 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 13.9 tptt . . . . . 0 N--CA 1.487 1.415 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.875 -179.912 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' S' S ' 15' ' ' ARG . . . . . 0.442 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 121.013 0.435 . . . . 0.0 110.157 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -7.33 0.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.384 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.442 ' H ' ' C ' ' S' ' 15' ' ' ARG . 0.0 OUTLIER -76.89 -86.24 0.05 Allowed 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.775 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -43.24 -34.77 1.24 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.279 1.038 . . . . 0.0 109.176 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -51.97 -57.55 9.13 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 113.815 -1.538 . . . . 0.0 109.075 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mt -59.37 -30.71 68.61 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.105 -1.407 . . . . 0.0 111.493 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.557 ' O ' ' N ' ' S' ' 24' ' ' ASP . 9.0 mmt85 -56.24 -65.23 0.64 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 117.902 -1.519 . . . . 0.0 109.519 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.482 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -36.62 -39.49 0.21 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.076 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 23.0 t -74.2 -36.69 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.136 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.557 ' N ' ' O ' ' S' ' 21' ' ' ARG . 54.7 t0 -58.83 -64.01 1.09 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.577 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.66 -56.03 8.13 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 118.956 -1.098 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.737 HD13 ' C ' ' S' ' 26' ' ' LEU . 2.3 tm? -38.68 -46.4 1.22 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.244 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 27' ' ' LYS . . . . . 0.428 ' NZ ' ' CE2' ' R' ' 30' ' ' TYR . 26.0 mtmm -66.16 -77.37 0.07 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.523 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -39.13 -47.76 1.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 29' ' ' ALA . . . . . 0.525 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -69.91 -27.37 64.73 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.641 -0.824 . . . . 0.0 113.132 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -41.31 98.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 118.582 -1.247 . . . . 0.0 111.089 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -50.13 -30.97 12.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.791 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.448 ' O ' ' OD1' ' S' ' 33' ' ' ASP . 87.7 m-20 -101.77 -83.5 0.46 Allowed 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.482 -0.887 . . . . 0.0 111.402 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.463 ' C ' HD22 ' S' ' 34' ' ' LEU . 0.3 OUTLIER 172.74 24.47 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.787 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 34' ' ' LEU . . . . . 0.761 HD22 ' N ' ' S' ' 34' ' ' LEU . 2.1 mm? -98.07 -13.34 21.07 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -51.15 -18.0 0.78 Allowed 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 119.249 -0.98 . . . . 0.0 111.055 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.476 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.1 mt -78.51 -65.86 0.31 Allowed Pre-proline 0 N--CA 1.482 1.14 0 C-N-CA 118.592 -1.243 . . . . 0.0 110.278 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.476 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 6.1 Cg_exo -49.22 -33.44 28.02 Favored 'Trans proline' 0 C--N 1.318 -1.079 0 N-CA-C 110.161 -0.746 . . . . 0.0 110.161 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.21 -38.59 75.3 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 119.48 -0.888 . . . . 0.0 110.05 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.5 OUTLIER -57.65 -22.55 46.36 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.079 179.655 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.58 15.69 19.2 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.696 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -115.52 -63.85 1.4 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.24 -21.82 61.33 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.704 -1.198 . . . . 0.0 112.532 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 43' ' ' LEU . . . . . 0.472 HD12 ' H ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -152.84 160.2 43.07 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.854 179.777 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.6 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER 178.93 -41.65 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 118.306 -1.357 . . . . 0.0 114.32 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.6 ' HD2' ' H ' ' S' ' 44' ' ' THR . 10.6 Cg_endo -75.88 -98.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.255 1.303 . . . . 0.0 113.064 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.59 -24.88 1.48 Allowed 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.875 -1.13 . . . . 0.0 110.351 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -59.31 -69.17 0.21 Allowed 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.778 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -29.45 4.48 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.7 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -82.56 -67.88 0.75 Allowed 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 118.759 -1.176 . . . . 0.0 112.203 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.11 -51.09 71.1 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 51' ' ' LEU . . . . . 0.481 HD12 ' O ' ' R' ' 42' ' ' MET . 3.9 tp -39.47 -58.32 1.28 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.214 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 52' ' ' GLY . . . . . 0.4 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -53.98 -44.0 72.2 Favored Glycine 0 N--CA 1.492 2.383 0 C-N-CA 119.28 -1.438 . . . . 0.0 109.912 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -47.6 -75.87 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.64 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.66 ' HE ' ' CA ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -48.74 -24.87 1.55 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.437 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -79.06 -27.61 13.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.342 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -81.79 -37.91 26.41 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.307 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 0.804 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -73.61 -35.07 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 117.326 -1.75 . . . . 0.0 107.931 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 58' ' ' VAL . . . . . 0.804 ' N ' HD13 ' S' ' 57' ' ' ILE . 11.8 t -60.56 -56.02 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 117.925 -1.51 . . . . 0.0 109.292 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.83 -27.06 49.54 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.462 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -71.79 -52.19 18.81 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.017 -1.073 . . . . 0.0 112.821 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 61' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -60.74 -24.69 65.91 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 117.738 -1.585 . . . . 0.0 110.269 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 62' ' ' LEU . . . . . 0.43 ' O ' ' C ' ' S' ' 63' ' ' ARG . 5.3 tp -85.38 25.48 1.02 Allowed 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.539 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 63' ' ' ARG . . . . . 0.43 ' C ' ' O ' ' S' ' 62' ' ' LEU . 6.6 mtp-105 . . . . . 0 N--CA 1.501 2.1 0 O-C-N 124.696 1.248 . . . . 0.0 114.315 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 29.1 tttm . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.955 0.407 . . . . 0.0 111.863 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -104.19 -103.06 0.31 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.539 0.685 . . . . 0.0 110.696 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -147.85 -40.67 0.17 Allowed 'General case' 0 C--N 1.28 -2.434 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.816 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.2 tp -130.17 18.97 5.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.484 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -73.58 -57.89 4.8 Favored Glycine 0 N--CA 1.491 2.353 0 C-N-CA 119.577 -1.297 . . . . 0.0 110.89 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.44 -67.31 0.16 Allowed 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.199 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 78' ' ' GLY . . . . . 0.469 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 152.74 161.64 10.41 Favored Glycine 0 N--CA 1.491 2.333 0 C-N-CA 119.193 -1.48 . . . . 0.0 110.945 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.873 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -65.57 -40.68 88.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 C-N-CA 120.024 -0.671 . . . . 0.0 111.055 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.418 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -67.29 -37.11 82.87 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.274 -0.971 . . . . 0.0 111.617 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 81' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' S' ' 78' ' ' GLY . 77.7 p -60.2 -56.42 21.84 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.337 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 82' ' ' ILE . . . . . 0.421 HD13 HG21 ' S' ' 82' ' ' ILE . 18.5 pt -57.25 -0.63 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.515 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.468 ' C ' ' H ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -98.49 -69.98 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.257 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -3.84 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 118.859 -1.136 . . . . 0.0 110.922 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 85' ' ' GLY . . . . . 0.468 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -95.69 -22.59 20.74 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.341 -1.409 . . . . 0.0 110.292 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 65.2 p -87.32 -12.83 45.3 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.279 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 87' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' S' ' 89' ' ' LEU . 55.9 m-20 -102.87 3.72 36.9 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -40.32 -24.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.852 -0.739 . . . . 0.0 111.22 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 89' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' S' ' 87' ' ' ASN . 7.3 mt -55.84 -49.58 72.93 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.922 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -103.92 -34.96 8.31 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.092 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.0 -71.42 0.07 Allowed 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.2 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 92' ' ' ALA . . . . . 0.434 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -70.7 159.22 85.9 Favored Pre-proline 0 N--CA 1.488 1.436 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.351 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 93' ' ' PRO . . . . . 0.434 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 5.8 Cg_exo -57.12 176.79 0.22 Allowed 'Trans proline' 0 C--N 1.323 -0.791 0 C-N-CA 121.668 1.579 . . . . 0.0 112.038 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 94' ' ' VAL . . . . . 0.478 ' O ' HG12 ' S' ' 94' ' ' VAL . 65.7 t -96.08 -9.64 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.628 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -77.12 -22.29 52.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.584 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -37.9 79.45 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.847 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 -47.9 82.3 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.747 -0.781 . . . . 0.0 111.439 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -80.2 -8.15 59.3 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.908 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.594 ' CH2' HG21 ' S' ' 103' ' ' VAL . 6.2 t90 -101.37 -65.63 0.96 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 118.925 -1.11 . . . . 0.0 112.398 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.554 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -59.15 -39.9 83.87 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -179.67 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.554 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.0 OUTLIER -40.98 -29.91 0.12 Allowed 'General case' 0 C--N 1.296 -1.748 0 C-N-CA 117.563 -1.655 . . . . 0.0 106.95 179.738 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' S' S ' 102' ' ' GLU . . . . . 0.545 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 mt-10 -91.88 -24.6 19.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 112.9 -1.955 . . . . 0.0 112.348 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.594 HG21 ' CH2' ' S' ' 99' ' ' TRP . 18.9 t -87.96 -21.19 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 116.536 -2.066 . . . . 0.0 109.833 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tp -86.94 -57.78 2.84 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.949 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.35 -75.09 0.2 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 118.728 -1.189 . . . . 0.0 110.343 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -76.63 47.39 0.49 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.381 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.305 -1.352 0 CA-C-O 116.324 -1.798 . . . . 0.0 110.921 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 15' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' R' ' 17' ' ' GLN . 23.5 ttt180 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 120.284 0.087 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -38.74 83.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' R' ' 15' ' ' ARG . 1.5 mt-30 -123.15 -91.42 0.55 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.301 -0.56 . . . . 0.0 109.795 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -57.24 -24.1 52.47 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 19' ' ' TRP . . . . . 0.4 ' N ' ' C ' ' R' ' 17' ' ' GLN . 9.4 t-105 -59.17 -46.99 86.95 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 112.559 -2.11 . . . . 0.0 106.214 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.0 tp -56.34 -47.22 79.25 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.562 -2.108 . . . . 0.0 110.411 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.0 OUTLIER -47.99 -70.0 0.11 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 119.05 -1.06 . . . . 0.0 110.416 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.5 OUTLIER -27.38 -51.14 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.329 179.675 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 23' ' ' VAL . . . . . 0.423 HG23 ' H ' ' R' ' 23' ' ' VAL . 1.2 t -68.73 -46.29 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.326 -0.949 . . . . 0.0 110.991 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.504 ' N ' ' O ' ' R' ' 21' ' ' ARG . 64.0 t0 -39.03 -45.37 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.709 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.409 ' HG ' ' H ' ' R' ' 25' ' ' LEU . 1.4 mt -75.88 -34.91 60.0 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.06 -1.056 . . . . 0.0 109.986 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 26' ' ' LEU . . . . . 0.423 ' N ' ' O ' ' R' ' 23' ' ' VAL . 1.0 OUTLIER -55.57 -31.81 62.49 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.048 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -79.93 -39.53 30.1 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 118.931 -1.108 . . . . 0.0 112.244 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -85.86 -18.18 33.53 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.898 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.423 ' HB1' ' N ' ' R' ' 35' ' ' HIS . . . -82.36 -58.84 2.76 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 118.968 -1.093 . . . . 0.0 111.766 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -45.47 -32.15 2.06 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.596 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 31' ' ' GLN . . . . . 0.43 ' O ' ' OE1' ' R' ' 31' ' ' GLN . 0.3 OUTLIER -46.79 -40.75 14.22 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.099 -1.04 . . . . 0.0 109.667 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 32' ' ' ASN . . . . . 0.4 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 63.6 t30 -106.51 -73.53 0.68 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.561 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 33' ' ' ASP . . . . . 0.4 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.5 OUTLIER 170.6 18.17 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 119.134 -1.026 . . . . 0.0 112.63 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 34' ' ' LEU . . . . . 0.502 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.9 OUTLIER -88.8 -13.44 39.41 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.05 -1.06 . . . . 0.0 109.19 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 35' ' ' HIS . . . . . 0.542 ' O ' HD13 ' R' ' 39' ' ' LEU . 46.5 p-80 -51.55 -27.52 11.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.385 -1.279 . . . . 0.0 113.024 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.456 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.9 mt -70.17 -62.52 2.21 Favored Pre-proline 0 N--CA 1.486 1.365 0 C-N-CA 117.872 -1.531 . . . . 0.0 110.815 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.1 Cg_exo -51.63 -25.21 19.34 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 C-N-CA 120.743 0.962 . . . . 0.0 110.667 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 24.5 mt -81.08 -38.83 26.68 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.096 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.542 HD13 ' O ' ' R' ' 35' ' ' HIS . 0.5 OUTLIER -59.94 -21.09 60.7 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.163 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 40' ' ' ASN . . . . . 0.546 ' O ' ' ND2' ' R' ' 40' ' ' ASN . 0.1 OUTLIER -103.69 11.68 35.68 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.374 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 39.4 tp -107.0 -69.81 0.82 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.635 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 42' ' ' MET . . . . . 0.462 ' C ' HD12 ' R' ' 43' ' ' LEU . 1.1 mtt -77.36 7.74 4.97 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 118.121 -1.432 . . . . 0.0 112.81 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 43' ' ' LEU . . . . . 0.462 HD12 ' C ' ' R' ' 42' ' ' MET . 9.0 mp -116.5 -176.2 2.91 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.513 ' HB ' ' CD ' ' R' ' 45' ' ' PRO 0.275 0.0 OUTLIER -126.2 -153.33 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 118.543 -1.263 . . . . 0.0 109.62 179.996 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.513 ' CD ' ' HB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -97.99 -38.27 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.612 0 CA-C-N 119.95 1.018 . . . . 0.0 111.351 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 46' ' ' ASP . . . . . 0.439 ' OD1' ' OE1' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -56.42 -18.96 12.84 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.092 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.439 ' OE1' ' OD1' ' R' ' 46' ' ' ASP . 3.6 mp0 -60.67 -71.33 0.14 Allowed 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.327 -0.949 . . . . 0.0 109.727 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -43.67 -44.45 6.44 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.674 -0.81 . . . . 0.0 109.867 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 49' ' ' GLU . . . . . 0.466 ' O ' ' OG1' ' R' ' 53' ' ' THR . 8.0 mm-40 -56.47 -77.32 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.06 -1.056 . . . . 0.0 111.58 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -66.73 -60.07 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.286 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 51' ' ' LEU . . . . . 0.542 HD23 ' C ' ' R' ' 51' ' ' LEU . 4.5 tt -34.02 -58.53 0.45 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.122 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.2 -48.09 59.87 Favored Glycine 0 N--CA 1.488 2.11 0 C-N-CA 119.042 -1.551 . . . . 0.0 109.44 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.506 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.3 OUTLIER -48.46 -79.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.895 -0.722 . . . . 0.0 112.453 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.618 ' CD ' ' H ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -39.88 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.826 -179.843 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 55' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' R' ' 53' ' ' THR . 1.5 t -88.43 -30.18 5.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 C-N-CA 118.488 -1.285 . . . . 0.0 111.236 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -76.58 -37.41 56.56 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.146 -1.022 . . . . 0.0 110.163 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 0.476 HG22 ' O ' ' R' ' 53' ' ' THR . 0.1 OUTLIER -76.79 -52.42 17.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 C-N-CA 118.834 -1.147 . . . . 0.0 109.651 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.5 p -51.99 -44.42 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 117.692 -1.603 . . . . 0.0 110.742 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.503 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 1.5 tm-20 -66.73 -29.56 69.57 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.625 -0.83 . . . . 0.0 111.251 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -48.81 20.88 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.985 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 97.8 mt -70.69 -22.69 62.44 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.681 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 tp . . . . . 0 C--N 1.301 -1.501 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.297 179.94 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 121.119 0.485 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' R' R ' 78' ' ' GLY . . . . . 0.478 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 171.19 157.8 13.86 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.771 -1.332 . . . . 0.0 109.771 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.76 HD13 ' N ' ' R' ' 79' ' ' ILE . 0.7 OUTLIER -73.56 28.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 C-N-CA 119.754 -0.778 . . . . 0.0 112.51 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.478 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.99 -37.4 5.61 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 81' ' ' THR . . . . . 0.487 ' O ' ' N ' ' R' ' 83' ' ' THR . 17.4 p -95.87 -56.44 2.66 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.182 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 82' ' ' ILE . . . . . 0.409 ' H ' HG23 ' R' ' 82' ' ' ILE . 1.5 pp -47.43 -13.99 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.393 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.487 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -66.25 -80.43 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.642 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 84' ' ' ARG . . . . . 0.801 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -54.18 -20.5 6.92 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.808 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.99 -46.7 91.05 Favored Glycine 0 N--CA 1.489 2.194 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.101 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -27.95 7.55 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.187 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 87' ' ' ASN . . . . . 0.607 ' C ' ' H ' ' R' ' 89' ' ' LEU . 1.9 t-20 -88.3 -56.27 3.39 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.793 -1.163 . . . . 0.0 111.446 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 88' ' ' SER . . . . . 0.597 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.8 -2.91 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.605 -1.238 . . . . 0.0 110.459 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 89' ' ' LEU . . . . . 0.749 ' O ' ' N ' ' R' ' 91' ' ' ALA . 1.2 mm? 28.79 32.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.805 1.316 . . . . 0.0 110.929 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 90' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' R' ' 88' ' ' SER . 6.9 tptt 20.19 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 114.163 -1.381 . . . . 0.0 113.927 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 91' ' ' ALA . . . . . 0.749 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -88.13 -3.09 58.93 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.749 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.715 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -70.89 171.13 8.99 Favored Pre-proline 0 N--CA 1.487 1.416 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.83 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 93' ' ' PRO . . . . . 0.715 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 6.1 Cg_exo -59.33 120.35 8.15 Favored 'Trans proline' 0 C--N 1.324 -0.758 0 C-N-CA 121.112 1.208 . . . . 0.0 111.618 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 43.1 t -60.99 -37.61 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 118.966 -1.094 . . . . 0.0 109.979 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -60.4 -10.05 4.36 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.709 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 96' ' ' LEU . . . . . 0.53 HD23 ' O ' ' R' ' 96' ' ' LEU . 3.2 tt -72.3 -55.03 7.82 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.678 -0.809 . . . . 0.0 110.074 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 97' ' ' ARG . . . . . 0.488 ' O ' ' CG ' ' R' ' 101' ' ' GLU . 0.0 OUTLIER -63.13 -12.06 24.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.088 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -80.96 -34.2 33.32 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.049 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.519 ' CH2' HG21 ' R' ' 103' ' ' VAL . 46.2 t90 -80.52 -58.84 2.93 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 121.952 0.882 . . . . 0.0 111.129 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.587 ' C ' ' N ' ' R' ' 102' ' ' GLU . 0.3 OUTLIER -70.43 -15.2 62.8 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 117.416 -1.714 . . . . 0.0 115.26 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' R' ' 97' ' ' ARG . 3.0 mm-40 -57.94 -18.71 25.1 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 102' ' ' GLU . . . . . 0.587 ' N ' ' C ' ' R' ' 100' ' ' LEU . 5.0 mt-10 -99.13 -35.63 9.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 112.378 -2.192 . . . . 0.0 114.195 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.519 HG21 ' CH2' ' R' ' 99' ' ' TRP . 5.1 t -73.55 -14.18 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 113.958 -3.097 . . . . 0.0 108.761 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 mt -88.65 -58.6 2.49 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.399 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 15.8 mt -62.5 -77.87 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.887 -1.125 . . . . 0.0 110.38 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.8 tptm . . . . . 0 C--N 1.302 -1.469 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.718 179.835 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.745 0.307 . . . . 0.0 111.446 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.49 15.72 6.55 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.174 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.473 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.5 mp0 -88.58 -90.07 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.906 -0.717 . . . . 0.0 110.461 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -43.45 -26.54 0.21 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.443 1.116 . . . . 0.0 109.198 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 19' ' ' TRP . . . . . 0.473 ' N ' ' C ' ' S' ' 17' ' ' GLN . 53.9 t-105 -57.11 -60.96 2.82 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 113.114 -1.857 . . . . 0.0 109.724 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 4.9 tp -43.49 -35.35 1.61 Allowed 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.851 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' S' ' 23' ' ' VAL . 29.7 mtt180 -64.01 -71.95 0.16 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.945 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.513 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -25.89 -40.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.461 0.476 . . . . 0.0 111.791 179.604 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.552 ' N ' ' O ' ' S' ' 21' ' ' ARG . 89.4 t -73.65 -71.65 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 C-N-CA 119.959 -0.696 . . . . 0.0 111.718 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.417 ' C ' ' O ' ' S' ' 23' ' ' VAL . 33.1 t70 -28.28 -35.83 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.589 HD12 ' CE ' ' S' ' 42' ' ' MET . 1.5 mt -87.3 -44.07 11.69 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.015 -1.074 . . . . 0.0 111.069 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -57.15 -63.13 1.32 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.156 -1.017 . . . . 0.0 111.74 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -50.55 -49.17 56.7 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -67.46 -35.61 79.53 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.737 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -27.91 69.46 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 118.896 -1.121 . . . . 0.0 111.771 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -51.19 -53.57 33.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 118.694 -1.202 . . . . 0.0 110.519 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.12 -14.82 4.35 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.404 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.485 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.3 OUTLIER -105.43 -17.16 14.52 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.544 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.485 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.7 t0 75.13 25.35 1.35 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.847 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.5 -13.97 17.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.881 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 35' ' ' HIS . . . . . 0.441 ' O ' HD13 ' S' ' 39' ' ' LEU . 12.2 p-80 -47.11 -19.8 0.14 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.926 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -80.16 -65.71 0.27 Allowed Pre-proline 0 N--CA 1.484 1.254 0 C-N-CA 117.593 -1.643 . . . . 0.0 110.43 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -50.25 -24.52 11.7 Favored 'Trans proline' 0 C--N 1.32 -0.95 0 N-CA-C 110.066 -0.782 . . . . 0.0 110.066 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 38' ' ' LEU . . . . . 0.51 ' O ' ' SD ' ' S' ' 42' ' ' MET . 73.1 mt -82.5 -39.1 22.91 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.929 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.2 OUTLIER -52.36 -38.26 58.31 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.898 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.23 13.13 0.97 Allowed 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 118.748 -1.181 . . . . 0.0 110.16 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 41' ' ' LEU . . . . . 0.417 ' H ' ' C ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER -116.2 -54.9 2.44 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.568 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 42' ' ' MET . . . . . 0.589 ' CE ' HD12 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -82.85 -8.02 59.61 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 118.13 -1.428 . . . . 0.0 112.057 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -112.78 173.47 6.36 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.62 HG22 ' HD3' ' S' ' 45' ' ' PRO 0.295 0.3 OUTLIER -129.12 -140.63 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.57 0 CA-C-O 117.37 -1.3 . . . . 0.0 109.497 179.941 . . . . . . . . 4 4 . 1 . 003 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.62 ' HD3' HG22 ' S' ' 44' ' ' THR . 12.1 Cg_endo -98.95 -44.4 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.501 0 CA-C-N 122.282 1.851 . . . . 0.0 111.102 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -23.03 5.49 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.102 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -68.5 -51.01 47.92 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.022 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -55.76 -46.96 77.76 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.459 -0.792 . . . . 0.0 112.442 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.49 -66.08 0.6 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 50' ' ' ALA . . . . . 0.486 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -60.32 -61.59 2.49 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 51' ' ' LEU . . . . . 0.633 HD12 ' C ' ' S' ' 51' ' ' LEU . 0.2 OUTLIER -45.48 -38.11 5.91 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.529 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 52' ' ' GLY . . . . . 0.41 ' N ' ' HG ' ' S' ' 51' ' ' LEU . . . -63.22 -40.66 99.33 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 108.279 -1.928 . . . . 0.0 108.279 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.531 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -54.74 -73.89 0.05 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.291 -0.954 . . . . 0.0 110.921 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.501 ' CD ' ' H ' ' S' ' 54' ' ' ARG . 1.3 mmt180 -37.43 -39.15 0.28 Allowed 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.262 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.1 t -64.11 -40.86 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 C-N-CA 117.742 -1.583 . . . . 0.0 109.246 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' S' ' 53' ' ' THR . 30.2 mtt180 -62.27 -51.59 67.11 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.691 -1.203 . . . . 0.0 109.325 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 0.494 HG22 HD11 ' S' ' 61' ' ' LEU . 2.0 mt -54.76 -64.96 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.784 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 86.2 t -43.29 -70.68 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.915 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -52.79 -31.13 36.98 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -34.38 64.25 Favored 'General case' 0 C--N 1.308 -1.225 0 C-N-CA 118.238 -1.385 . . . . 0.0 111.438 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 61' ' ' LEU . . . . . 0.494 HD11 HG22 ' S' ' 57' ' ' ILE . 15.3 mt -75.5 -39.39 58.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.292 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mt -60.04 -31.53 70.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.284 -0.967 . . . . 0.0 110.197 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 C-N-CA 119.405 -0.918 . . . . 0.0 110.629 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 111.219 0.081 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' S' S ' 73' ' ' ASN . . . . . 0.497 ' O ' ' C ' ' S' ' 74' ' ' GLU . 52.7 t30 -129.09 6.16 5.39 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.292 -0.963 . . . . 0.0 113.405 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 74' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 73' ' ' ASN . 2.5 mm-40 -42.77 -46.85 5.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.094 -1.817 . . . . 0.0 106.094 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.3 tp -143.32 24.58 1.76 Allowed 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 112.919 -1.946 . . . . 0.0 108.514 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -127.42 -99.79 1.06 Allowed Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.896 -1.621 . . . . 0.0 113.023 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 77' ' ' ALA . . . . . 0.418 ' HB2' HG21 ' S' ' 53' ' ' THR . . . -150.59 -67.66 0.19 Allowed 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.062 -1.055 . . . . 0.0 112.765 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.57 160.08 33.11 Favored Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.093 -1.527 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.865 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -61.97 -39.87 85.23 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.273 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.21 -58.48 6.89 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.329 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 81' ' ' THR . . . . . 0.457 ' H ' HG23 ' S' ' 81' ' ' THR . 73.1 p -42.2 -59.29 1.84 Allowed 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 34.1 pt -60.14 -3.16 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 119.093 -1.043 . . . . 0.0 112.925 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -107.81 -37.77 6.03 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.749 -0.78 . . . . 0.0 111.396 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.34 19.19 1.0 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.482 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.9 -38.88 2.81 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.595 -1.288 . . . . 0.0 110.424 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -51.55 5.92 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.688 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -79.37 11.18 3.1 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.321 -0.951 . . . . 0.0 110.107 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 88' ' ' SER . . . . . 0.441 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.1 OUTLIER -72.9 -31.5 64.71 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.331 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 89' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' S' ' 88' ' ' SER . 7.3 mt -34.95 -50.49 0.48 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.539 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -40.01 -66.72 0.28 Allowed 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.576 0.703 . . . . 0.0 112.358 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.27 -46.47 17.71 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.442 -1.253 . . . . 0.0 112.572 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -42.49 153.69 0.3 Allowed Pre-proline 0 N--CA 1.49 1.571 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.252 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -58.26 141.42 96.74 Favored 'Trans proline' 0 C--O 1.216 -0.6 0 C-N-CA 121.53 1.487 . . . . 0.0 112.139 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 94' ' ' VAL . . . . . 0.671 ' O ' HG12 ' S' ' 94' ' ' VAL . 63.4 t -109.71 11.13 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.087 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -99.21 -0.17 42.02 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.816 -0.753 . . . . 0.0 111.005 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 70.0 mt -101.64 -21.0 14.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.171 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.11 -24.05 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.679 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -101.57 -22.32 14.51 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.88 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.616 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 17.7 t90 -82.13 -60.45 2.22 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.999 -1.081 . . . . 0.0 112.959 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.644 ' HA ' HG23 ' S' ' 103' ' ' VAL . 0.4 OUTLIER -50.41 -36.27 32.12 Favored 'General case' 0 C--N 1.286 -2.188 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.998 -179.493 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.4 mt-10 -40.87 -32.14 0.21 Allowed 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.842 -1.543 . . . . 0.0 107.439 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 102' ' ' GLU . . . . . 0.527 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -88.56 -28.19 20.9 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.042 -1.89 . . . . 0.0 112.381 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.644 HG23 ' HA ' ' S' ' 100' ' ' LEU . 2.1 t -79.9 -35.91 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 115.233 -2.587 . . . . 0.0 108.331 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.5 -52.68 63.49 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.951 -1.1 . . . . 0.0 108.054 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 105' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' S' ' 105' ' ' LEU . 12.7 tp -56.48 -57.08 13.85 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 119.469 -0.892 . . . . 0.0 109.909 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -95.91 80.57 3.34 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.502 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.304 -1.411 0 CA-C-O 116.186 -1.864 . . . . 0.0 111.029 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.019 0.438 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -103.83 55.91 0.73 Allowed 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.556 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.6 tt0 -113.09 -82.27 0.59 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.272 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 18' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.1 OUTLIER -49.52 -21.66 1.02 Allowed 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 123.445 1.593 . . . . 0.0 106.937 179.571 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 19' ' ' TRP . . . . . 0.556 ' N ' ' C ' ' R' ' 17' ' ' GLN 0.257 43.2 t-105 -55.49 -51.66 66.25 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.607 -2.542 . . . . 0.0 109.042 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.07 -21.95 48.17 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.24 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.475 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.0 mmt85 -71.28 -72.07 0.23 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.354 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.481 ' CD2' HG23 ' R' ' 23' ' ' VAL . 0.0 OUTLIER -35.5 -32.66 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.193 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 23' ' ' VAL . . . . . 0.481 HG23 ' CD2' ' R' ' 22' ' ' PHE . 89.0 t -81.95 -58.16 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.805 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -34.94 -45.2 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.385 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' R' ' 25' ' ' LEU . 0.7 OUTLIER -82.83 -40.2 20.67 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.726 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 26' ' ' LEU . . . . . 0.412 ' CD1' HD11 ' R' ' 39' ' ' LEU . 4.8 tp -37.75 -52.63 1.28 Allowed 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.789 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -51.85 28.3 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.615 -1.234 . . . . 0.0 112.501 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -51.02 -31.4 18.13 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.855 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.476 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -83.39 -53.45 5.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.0 -1.08 . . . . 0.0 112.692 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 30' ' ' TYR . . . . . 0.411 ' O ' ' C ' ' R' ' 31' ' ' GLN . 61.5 t80 -36.51 -51.19 0.82 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 31' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' R' ' 30' ' ' TYR . 4.9 tt0 -38.45 -35.69 0.19 Allowed 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.576 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -101.77 -80.82 0.5 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.796 -0.762 . . . . 0.0 110.638 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 168.35 35.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.689 0.757 . . . . 0.0 109.106 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 34' ' ' LEU . . . . . 0.421 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 2.1 mm? -100.86 -19.3 16.0 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.434 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 35' ' ' HIS . . . . . 0.406 ' CG ' ' N ' ' R' ' 36' ' ' LEU . 6.3 p-80 -48.09 -41.2 25.61 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 114.842 -1.072 . . . . 0.0 112.754 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.1 mt -58.06 -64.07 3.18 Favored Pre-proline 0 C--N 1.302 -1.494 0 C-N-CA 117.988 -1.485 . . . . 0.0 111.146 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.9 Cg_endo -56.35 -17.26 20.46 Favored 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.955 1.103 . . . . 0.0 111.27 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.82 -56.46 3.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.099 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.446 ' C ' ' N ' ' R' ' 41' ' ' LEU . 2.6 mm? -51.71 -33.78 35.93 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 117.988 -1.485 . . . . 0.0 108.049 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -12.94 0.07 Allowed 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.058 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 41' ' ' LEU . . . . . 0.446 ' N ' ' C ' ' R' ' 39' ' ' LEU . 11.6 mt -112.0 -58.01 2.19 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 120.0 -0.68 . . . . 0.0 111.349 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 42' ' ' MET . . . . . 0.498 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -87.03 39.11 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 118.235 -1.386 . . . . 0.0 110.279 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -160.48 170.62 20.58 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.275 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.487 ' HB ' ' CD ' ' R' ' 45' ' ' PRO 0.314 0.1 OUTLIER -132.86 -153.68 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.619 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.817 -179.955 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.487 ' CD ' ' HB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -95.21 -40.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.217 -0.531 0 N-CA-C 110.01 -0.804 . . . . 0.0 110.01 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -58.93 -34.19 71.45 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.111 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.47 ' OE1' ' N ' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -63.23 -48.06 79.86 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.945 179.908 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -37.94 28.94 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.016 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -77.64 -73.27 0.31 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.972 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.42 -48.03 37.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.906 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -61.69 1.59 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.176 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.57 -44.95 68.26 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 119.69 -1.243 . . . . 0.0 111.451 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.482 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.1 OUTLIER -52.57 -83.42 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.61 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 10.1 mtt85 -42.33 -21.77 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.798 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 55' ' ' VAL . . . . . 0.643 HG22 ' HB3' ' S' ' 42' ' ' MET . 2.3 t -82.04 -40.61 17.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.027 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' R' ' 60' ' ' GLU . 0.0 OUTLIER -81.4 -30.93 33.45 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 118.594 -1.242 . . . . 0.0 112.825 -179.599 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 0.411 HG21 HD13 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -78.66 -42.51 25.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 C-N-CA 118.007 -1.477 . . . . 0.0 109.228 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 0.535 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.9 p -62.1 -49.42 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.68 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.535 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 3.9 pt-20 -66.91 -28.15 68.07 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 117.93 -1.508 . . . . 0.0 111.351 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 60' ' ' GLU . . . . . 0.402 ' HG3' HH11 ' R' ' 56' ' ' ARG . 17.2 mm-40 -72.18 -44.9 62.32 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 119.067 -1.053 . . . . 0.0 112.253 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 40.0 mt -82.61 -7.15 59.66 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.497 -1.281 . . . . 0.0 111.983 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp . . . . . 0 N--CA 1.49 1.551 0 C-N-CA 118.708 -1.197 . . . . 0.0 110.871 179.837 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 120.849 0.357 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' R' R ' 78' ' ' GLY . . . . . 0.52 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 178.09 155.82 15.14 Favored Glycine 0 N--CA 1.488 2.165 0 C-N-CA 119.527 -1.32 . . . . 0.0 110.557 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.773 HD13 ' N ' ' R' ' 79' ' ' ILE . 0.8 OUTLIER -71.48 25.63 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 C-N-CA 119.887 -0.725 . . . . 0.0 112.168 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.52 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.2 -39.69 5.17 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 81' ' ' THR . . . . . 0.465 ' O ' ' N ' ' R' ' 83' ' ' THR . 18.2 p -94.91 -61.16 1.54 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.857 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 82' ' ' ILE . . . . . 0.414 ' C ' HD12 ' R' ' 82' ' ' ILE . 1.8 pp -43.43 -22.29 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 119.319 -0.953 . . . . 0.0 110.998 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.465 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -60.24 -81.98 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.036 -179.922 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 84' ' ' ARG . . . . . 0.836 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -50.12 -26.01 4.06 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 118.738 -1.185 . . . . 0.0 110.015 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.95 -47.37 19.65 Favored Glycine 0 N--CA 1.486 1.981 0 C-N-CA 119.493 -1.337 . . . . 0.0 110.307 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.51 -56.18 2.43 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.103 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 87' ' ' ASN . . . . . 0.611 ' C ' ' H ' ' R' ' 89' ' ' LEU . 2.5 m-80 -43.41 -49.82 7.01 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.656 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 88' ' ' SER . . . . . 0.61 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.78 -1.05 0.5 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.377 -1.329 . . . . 0.0 109.954 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 89' ' ' LEU . . . . . 0.744 ' O ' ' N ' ' R' ' 91' ' ' ALA . 0.3 OUTLIER 27.59 33.37 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.172 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 90' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' R' ' 88' ' ' SER . 5.1 tptp 21.52 25.85 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 CA-C-N 114.249 -1.341 . . . . 0.0 113.404 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 91' ' ' ALA . . . . . 0.744 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -79.9 -20.65 45.33 Favored 'General case' 0 C--N 1.286 -2.171 0 C-N-CA 117.133 -1.827 . . . . 0.0 111.03 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.487 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -61.12 161.02 18.21 Favored Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.93 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 93' ' ' PRO . . . . . 0.487 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.9 Cg_endo -58.31 168.48 3.76 Favored 'Trans proline' 0 C--N 1.323 -0.8 0 C-N-CA 121.543 1.495 . . . . 0.0 111.525 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 12.5 t -91.46 -24.03 5.66 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.532 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.26 -9.23 38.56 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.515 -0.874 . . . . 0.0 110.996 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 96' ' ' LEU . . . . . 0.432 HD23 HD23 ' R' ' 100' ' ' LEU . 0.5 OUTLIER -66.33 -47.65 72.83 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.806 -0.758 . . . . 0.0 111.463 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -31.55 68.48 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.229 -0.989 . . . . 0.0 111.157 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -73.99 -19.69 60.57 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.206 -0.998 . . . . 0.0 111.298 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.66 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 1.8 t90 -96.14 -70.22 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.311 -0.955 . . . . 0.0 112.629 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.586 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.1 mm? -36.6 -52.35 0.87 Allowed 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.586 ' C ' ' O ' ' R' ' 100' ' ' LEU . 47.9 mt-10 -33.85 -42.06 0.11 Allowed 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.087 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' R' ' 100' ' ' LEU . 0.4 OUTLIER -85.17 -29.74 24.51 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 113.455 -1.702 . . . . 0.0 112.874 -179.949 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.66 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 4.7 t -80.79 -35.97 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 116.603 -2.039 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.37 -58.38 3.8 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 4.7 mt -47.51 -70.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 118.642 -1.223 . . . . 0.0 111.533 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? . . . . . 0 N--CA 1.489 1.513 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.993 -179.917 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.987 0.422 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' S' S ' 16' ' ' HIS . . . . . 0.451 ' CG ' ' O ' ' S' ' 16' ' ' HIS . 58.1 t-80 -142.68 12.69 1.9 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.926 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.449 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.3 mt-30 -88.94 -83.92 0.22 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.928 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.478 ' H ' ' HG3' ' S' ' 18' ' ' GLU . 24.5 mt-10 -43.58 -32.74 1.0 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 19' ' ' TRP . . . . . 0.449 ' N ' ' C ' ' S' ' 17' ' ' GLN . 65.2 t-105 -48.5 -56.33 8.59 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 112.881 -1.963 . . . . 0.0 109.65 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.48 -35.9 42.05 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 113.693 -1.594 . . . . 0.0 111.679 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.559 ' O ' ' C ' ' S' ' 22' ' ' PHE . 50.4 mtt-85 -63.35 -73.24 0.12 Allowed 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.566 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.637 ' CE1' HD12 ' S' ' 26' ' ' LEU . 1.5 t80 -24.92 -50.68 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.643 0.735 . . . . 0.0 111.34 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.414 ' O ' ' C ' ' S' ' 24' ' ' ASP . 24.8 t -70.56 -46.78 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.787 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' S' ' 21' ' ' ARG . 16.8 t0 -36.64 -62.95 0.44 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.919 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.426 ' H ' ' HG ' ' S' ' 25' ' ' LEU . 0.3 OUTLIER -64.0 -49.88 70.7 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 118.658 -1.217 . . . . 0.0 110.391 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.637 HD12 ' CE1' ' S' ' 22' ' ' PHE . 0.7 OUTLIER -40.1 -63.27 0.63 Allowed 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.879 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -57.04 6.39 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.404 -0.918 . . . . 0.0 112.606 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -64.36 -16.84 63.02 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.099 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 29' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' S' ' 31' ' ' GLN . . . -90.36 -47.9 7.46 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 118.933 -1.107 . . . . 0.0 112.491 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 30' ' ' TYR . . . . . 0.413 ' C ' ' O ' ' S' ' 29' ' ' ALA . 0.4 OUTLIER -40.19 -26.8 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.376 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 31' ' ' GLN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.3 tt0 -75.71 -37.93 59.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.384 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 18.1 t-20 -95.1 -8.33 36.85 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.6 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.5 t0 84.71 23.05 0.1 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 123.626 0.579 . . . . 0.0 110.794 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.88 -16.46 31.88 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.025 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 35' ' ' HIS . . . . . 0.476 ' O ' HD22 ' S' ' 39' ' ' LEU . 26.4 p-80 -54.95 -25.3 28.6 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 113.97 -1.468 . . . . 0.0 113.018 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 5.6 mt -70.75 -63.34 1.63 Allowed Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.417 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.7 Cg_endo -54.61 -36.54 89.6 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 C-N-CA 120.636 0.89 . . . . 0.0 111.57 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 38' ' ' LEU . . . . . 0.511 ' O ' ' SD ' ' S' ' 42' ' ' MET . 19.7 mt -74.8 -37.52 62.33 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.656 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.476 HD22 ' O ' ' S' ' 35' ' ' HIS . 0.1 OUTLIER -53.07 -38.31 62.4 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.384 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -76.27 7.62 4.12 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.95 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.57 -55.62 2.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.724 -0.79 . . . . 0.0 112.457 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 42' ' ' MET . . . . . 0.643 ' HB3' HG22 ' R' ' 55' ' ' VAL . 0.0 OUTLIER -78.67 6.38 8.96 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 118.496 -1.282 . . . . 0.0 111.474 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 68.6 mt -127.38 -175.62 3.5 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.68 HG22 ' HD3' ' S' ' 45' ' ' PRO 0.299 0.3 OUTLIER -129.23 -147.34 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.364 0 C-N-CA 118.681 -1.207 . . . . 0.0 109.51 -179.91 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.68 ' HD3' HG22 ' S' ' 44' ' ' THR . 8.0 Cg_endo -96.55 -42.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.218 -0.492 0 CA-C-N 120.147 1.088 . . . . 0.0 110.566 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -52.27 -29.94 25.48 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.891 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -59.92 -54.21 48.8 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.645 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.1 -39.82 60.37 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.471 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 49' ' ' GLU . . . . . 0.431 ' O ' ' OG1' ' S' ' 53' ' ' THR . 85.6 mt-10 -82.34 -68.65 0.68 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.831 -1.148 . . . . 0.0 112.49 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 50' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -49.68 -50.01 45.25 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 51' ' ' LEU . . . . . 0.662 HD12 ' C ' ' S' ' 51' ' ' LEU . 0.4 OUTLIER -60.08 -40.97 91.43 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 118.155 -1.418 . . . . 0.0 110.7 -179.947 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 52' ' ' GLY . . . . . 0.463 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -61.4 -30.96 75.65 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.518 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -65.16 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 114.748 -0.726 . . . . 0.0 110.733 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -41.35 -24.11 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 55' ' ' VAL . . . . . 0.485 ' N ' ' O ' ' S' ' 53' ' ' THR . 12.9 t -71.42 -44.28 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 117.957 -1.497 . . . . 0.0 107.627 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.3 OUTLIER -59.55 -48.65 80.81 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.997 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 mt -57.44 -63.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.968 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 79.5 t -46.5 -59.92 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 C-N-CA 118.243 -1.383 . . . . 0.0 111.467 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -61.02 -18.8 59.75 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.502 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -79.95 -39.38 30.32 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.657 -1.217 . . . . 0.0 111.002 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.15 -29.7 64.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.95 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.97 -66.59 0.36 Allowed 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 118.981 -1.088 . . . . 0.0 109.719 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.305 -1.366 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 1.1 tptm . . . . . 0 N--CA 1.497 1.877 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' S' S ' 73' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' S' ' 77' ' ' ALA . 14.4 t-20 -107.74 6.51 27.69 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.319 -0.952 . . . . 0.0 112.281 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 74' ' ' GLU . . . . . 0.482 ' C ' ' O ' ' S' ' 73' ' ' ASN . 1.4 mt-10 -44.99 -44.67 10.09 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 tp -145.0 21.4 1.59 Allowed 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.929 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -129.94 -100.02 0.9 Allowed Glycine 0 N--CA 1.499 2.841 0 C-N-CA 118.829 -1.653 . . . . 0.0 112.96 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 77' ' ' ALA . . . . . 0.52 ' O ' ' ND2' ' S' ' 73' ' ' ASN . . . -147.29 -59.34 0.27 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.202 -0.999 . . . . 0.0 112.688 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 179.24 161.06 26.09 Favored Glycine 0 N--CA 1.491 2.331 0 C-N-CA 118.666 -1.731 . . . . 0.0 111.593 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.937 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -59.73 -28.69 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 115.093 -0.554 . . . . 0.0 111.249 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.448 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.38 -55.29 16.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.508 -0.877 . . . . 0.0 113.248 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 81' ' ' THR . . . . . 0.428 ' H ' HG23 ' S' ' 81' ' ' THR . 80.9 p -46.52 -51.61 15.03 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 82' ' ' ILE . . . . . 0.409 ' H ' HG23 ' S' ' 82' ' ' ILE . 7.3 pt -70.81 11.47 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 C-N-CA 119.165 -1.014 . . . . 0.0 113.304 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -120.9 -46.48 2.34 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.062 179.89 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 84' ' ' ARG . . . . . 0.482 ' C ' ' H ' ' S' ' 86' ' ' SER . 3.0 ptm180 -63.89 -23.02 67.19 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.974 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.55 -4.9 1.54 Allowed Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.217 -1.468 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 86' ' ' SER . . . . . 0.482 ' H ' ' C ' ' S' ' 84' ' ' ARG . 1.0 OUTLIER -157.24 -12.92 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.542 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -92.91 -22.6 19.14 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.72 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 88' ' ' SER . . . . . 0.414 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.4 OUTLIER -75.85 -37.51 58.91 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.58 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 89' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' S' ' 88' ' ' SER . 26.4 mt -37.62 -43.7 0.64 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 120.229 -0.589 . . . . 0.0 111.844 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -42.66 -64.3 0.64 Allowed 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.47 15.69 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.825 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 92' ' ' ALA . . . . . 0.624 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -59.28 164.84 4.38 Favored Pre-proline 0 N--CA 1.489 1.492 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.035 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 93' ' ' PRO . . . . . 0.624 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 21.4 Cg_exo -45.55 133.39 12.99 Favored 'Trans proline' 0 C--N 1.321 -0.913 0 C-N-CA 121.871 1.714 . . . . 0.0 112.49 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 4.1 t -108.92 -5.25 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.251 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.94 -7.16 1.58 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.932 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 2.7 mt -75.8 -32.96 60.1 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.716 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -37.47 72.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.456 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -72.47 -30.47 64.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.051 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.544 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 16.7 t90 -88.2 -61.77 1.64 Allowed 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.657 ' HA ' HG23 ' S' ' 103' ' ' VAL . 0.3 OUTLIER -52.36 -32.61 39.23 Favored 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 115.435 1.642 . . . . 0.0 115.435 -179.64 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' S' ' 100' ' ' LEU . 0.4 OUTLIER -43.78 -27.95 0.38 Allowed 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 117.751 -1.58 . . . . 0.0 106.953 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' S' S ' 102' ' ' GLU . . . . . 0.526 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.8 mt-10 -94.98 -28.24 15.24 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.122 -1.853 . . . . 0.0 112.942 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.657 HG23 ' HA ' ' S' ' 100' ' ' LEU . 2.1 t -77.65 -28.65 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 114.893 -2.723 . . . . 0.0 108.322 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.66 -56.82 4.32 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.458 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 6.5 mt -60.78 -69.42 0.23 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.709 -1.196 . . . . 0.0 110.957 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' S' S ' 106' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' S' ' 107' ' ' SER . 1.7 ttmm -96.86 162.38 13.44 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.406 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' S' S ' 107' ' ' SER . . . . . 0.466 ' N ' ' CG ' ' S' ' 106' ' ' LYS . 81.8 p . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 116.243 -1.837 . . . . 0.0 110.844 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.296 0.57 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' R' R ' 16' ' ' HIS . . . . . 0.424 ' H ' ' H ' ' R' ' 17' ' ' GLN . 0.9 OUTLIER -157.1 -4.74 0.1 Allowed 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.076 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.424 ' H ' ' H ' ' R' ' 16' ' ' HIS . 1.1 mt-30 -91.42 -85.56 0.23 Allowed 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.231 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 18' ' ' GLU . . . . . 0.436 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.5 OUTLIER -45.52 -33.96 3.02 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 123.106 1.431 . . . . 0.0 107.66 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -52.71 -58.55 6.46 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 112.925 -1.943 . . . . 0.0 108.175 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.68 -28.66 65.96 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.695 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.535 ' O ' ' C ' ' R' ' 22' ' ' PHE . 10.4 mmt-85 -56.3 -68.02 0.25 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 117.885 -1.526 . . . . 0.0 110.144 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.535 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -33.3 -40.09 0.06 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.049 179.613 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' R' R ' 23' ' ' VAL . . . . . 0.428 ' N ' ' O ' ' R' ' 21' ' ' ARG . 14.9 t -72.05 -47.47 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 C-N-CA 119.469 -0.893 . . . . 0.0 110.44 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' R' ' 21' ' ' ARG . 36.0 t70 -45.5 -21.34 0.09 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.241 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 -43.37 6.36 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.994 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 tt -47.74 -38.0 14.46 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.325 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttp -76.64 -38.55 54.46 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -82.88 -2.2 54.17 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.113 -1.035 . . . . 0.0 113.63 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.478 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -115.47 -30.97 6.06 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.144 -1.022 . . . . 0.0 113.426 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -44.01 -38.95 3.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.111 -1.035 . . . . 0.0 112.164 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.76 -29.71 58.9 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.524 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.5 m-20 -87.86 -11.32 48.14 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 118.981 -1.088 . . . . 0.0 111.377 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 2.5 t70 81.19 24.69 0.27 Allowed 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.773 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 34' ' ' LEU . . . . . 0.478 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 1.7 mm? -95.7 -22.15 17.73 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.821 0.82 . . . . 0.0 109.828 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 35' ' ' HIS . . . . . 0.425 ' O ' HD13 ' R' ' 39' ' ' LEU . 37.9 p-80 -52.82 -18.26 1.79 Allowed 'General case' 0 C--N 1.295 -1.804 0 CA-C-N 114.227 -1.352 . . . . 0.0 113.068 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.474 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.5 mt -78.82 -65.69 0.31 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 118.503 -1.279 . . . . 0.0 111.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.474 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.1 Cg_endo -50.93 -28.13 23.0 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 120.541 0.828 . . . . 0.0 110.227 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 7.2 mt -82.54 -34.83 27.72 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 119.354 -0.939 . . . . 0.0 111.482 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -58.14 -26.36 62.58 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.775 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.87 15.28 8.67 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 118.825 -1.15 . . . . 0.0 109.204 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 41' ' ' LEU . . . . . 0.55 HD23 HH21 ' S' ' 54' ' ' ARG . 1.8 tp -114.2 -63.6 1.43 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.376 -0.829 . . . . 0.0 113.007 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.6 OUTLIER -62.56 7.46 0.07 Allowed 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 117.443 -1.703 . . . . 0.0 112.253 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' R' R ' 43' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' R' ' 41' ' ' LEU . 2.3 pp -150.95 -177.25 5.9 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.389 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.6 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.312 0.3 OUTLIER -119.04 -150.82 0.01 OUTLIER Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.327 -179.846 . . . . . . . . 4 4 . 1 . 005 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.6 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.6 Cg_endo -93.37 -42.69 0.03 OUTLIER 'Trans proline' 0 C--O 1.213 -0.745 0 CA-C-N 119.228 0.76 . . . . 0.0 110.614 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.35 -21.98 6.64 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.391 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.5 ' HG3' ' H ' ' R' ' 44' ' ' THR . 2.3 mt-10 -76.71 -41.89 43.48 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.018 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -62.63 -30.43 71.35 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.63 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -73.6 -62.97 1.3 Allowed 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.915 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.489 ' C ' HH21 ' R' ' 54' ' ' ARG . . . -52.73 -31.37 37.52 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.574 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.0 mt -56.36 -61.27 2.52 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.97 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.28 -53.37 9.47 Favored Glycine 0 N--CA 1.484 1.843 0 C-N-CA 119.119 -1.515 . . . . 0.0 110.009 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.48 ' O ' HG22 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -39.71 -80.1 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.559 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.489 HH21 ' C ' ' R' ' 50' ' ' ALA . 20.7 mtt180 -38.11 -53.74 1.39 Allowed 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.51 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 5.8 t -63.21 -31.18 51.77 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.75 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.95 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -78.67 -33.59 46.94 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.161 -1.416 . . . . 0.0 111.468 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 0.798 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -82.67 -34.99 12.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 117.754 -1.578 . . . . 0.0 108.264 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 0.798 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.6 t -59.61 -53.49 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.419 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -58.65 -46.84 86.26 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.012 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -48.36 -31.1 5.65 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.768 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 96.3 mt -96.92 -24.68 15.73 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.189 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.489 1.524 0 C-N-CA 119.365 -0.934 . . . . 0.0 111.484 -179.991 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.763 0.315 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -178.66 155.46 16.52 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 119.221 -1.466 . . . . 0.0 110.723 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.794 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -46.74 -47.67 7.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.466 -179.987 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.423 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -59.83 -62.15 2.09 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 118.768 -1.173 . . . . 0.0 110.637 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 43.9 m -39.23 -47.76 1.7 Allowed 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 pt -77.32 -13.11 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.48 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -87.72 -58.94 2.39 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.607 -1.237 . . . . 0.0 112.099 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.92 6.6 0.35 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.362 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 85' ' ' GLY . . . . . 0.482 ' HA3' HD11 ' R' ' 57' ' ' ILE . . . -102.51 -33.82 4.35 Favored Glycine 0 N--CA 1.492 2.378 0 C-N-CA 119.69 -1.243 . . . . 0.0 110.412 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 1.5 t -83.07 -30.59 27.9 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.477 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -93.63 8.42 40.94 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.956 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.41 -27.26 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.29 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 90.2 mt -44.11 -28.09 0.46 Allowed 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.202 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 90' ' ' LYS . . . . . 0.409 ' O ' ' C ' ' R' ' 91' ' ' ALA . 18.3 mttt -80.9 -71.45 0.47 Allowed 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.309 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -36.72 -63.18 0.43 Allowed 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.163 -1.38 . . . . 0.0 111.959 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -40.72 109.06 0.59 Allowed Pre-proline 0 N--CA 1.488 1.438 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.915 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -55.92 156.41 19.68 Favored 'Trans proline' 0 C--O 1.215 -0.629 0 C-N-CA 120.667 0.911 . . . . 0.0 111.83 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.5 -41.41 90.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.38 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -66.44 -27.93 68.2 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.803 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -39.05 83.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.545 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -27.83 63.39 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.467 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -75.31 -22.37 57.74 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.104 -1.039 . . . . 0.0 109.96 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.699 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 2.9 t90 -95.56 -66.48 0.91 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.509 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.2 mm? -41.16 -38.01 1.0 Allowed 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.509 ' C ' ' O ' ' R' ' 100' ' ' LEU . 7.3 mt-10 -41.31 -39.16 1.33 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 117.874 -1.53 . . . . 0.0 107.702 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 102' ' ' GLU . . . . . 0.403 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.1 mt-10 -90.01 -27.63 19.63 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 113.428 -1.715 . . . . 0.0 112.427 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.699 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.3 t -89.05 -7.94 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 117.361 -1.736 . . . . 0.0 110.746 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 8.6 tp -97.93 -54.03 3.21 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.507 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -69.28 -68.3 0.41 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 118.76 -1.176 . . . . 0.0 110.765 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 2.7 tttp . . . . . 0 N--CA 1.487 1.376 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.91 -179.967 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.963 0.411 . . . . 0.0 110.392 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.23 -25.17 0.06 Allowed 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.326 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.429 ' O ' ' C ' ' S' ' 18' ' ' GLU . 4.0 mt-30 -85.53 -69.57 0.65 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.693 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.429 ' C ' ' O ' ' S' ' 17' ' ' GLN . 3.3 mp0 -43.55 -41.39 4.47 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 123.133 1.444 . . . . 0.0 107.862 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.265 42.3 t-105 -52.73 -53.72 43.79 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 111.958 -2.383 . . . . 0.0 108.899 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.11 -37.54 72.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 113.8 -1.545 . . . . 0.0 110.759 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.507 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.6 mmt180 -51.0 -70.75 0.08 Allowed 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 118.283 -1.367 . . . . 0.0 109.28 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.507 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.53 -42.93 0.06 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.333 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 3.6 t -81.6 -33.15 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.119 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.498 ' N ' ' O ' ' S' ' 21' ' ' ARG . 55.6 t0 -53.42 -34.64 58.58 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 120.075 -0.65 . . . . 0.0 112.273 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.96 -44.55 7.65 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.664 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.73 HD21 HD22 ' S' ' 39' ' ' LEU . 0.1 OUTLIER -45.01 -49.5 11.27 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.298 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.95 -71.18 0.07 Allowed 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.37 -0.932 . . . . 0.0 112.743 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.19 -5.86 1.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.791 -0.764 . . . . 0.0 113.054 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.55 -46.16 7.09 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.712 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -45.71 -52.5 10.84 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.618 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -42.0 -30.72 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.849 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.43 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 56.5 m-20 -99.5 -84.72 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 119.625 -0.83 . . . . 0.0 110.658 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.553 ' H ' HD22 ' S' ' 34' ' ' LEU . 0.5 OUTLIER 170.95 23.43 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 119.253 -0.979 . . . . 0.0 112.151 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 34' ' ' LEU . . . . . 0.848 HD22 ' N ' ' S' ' 34' ' ' LEU . 1.3 mm? -94.43 -14.63 25.03 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.0 -1.08 . . . . 0.0 109.856 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 35' ' ' HIS . . . . . 0.688 ' O ' HD23 ' S' ' 39' ' ' LEU . 38.4 p-80 -48.76 -28.56 3.72 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.735 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.453 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.8 mt -72.74 -63.33 1.14 Allowed Pre-proline 0 C--N 1.303 -1.439 0 C-N-CA 118.285 -1.366 . . . . 0.0 111.419 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -52.28 -21.62 13.75 Favored 'Trans proline' 0 C--N 1.321 -0.882 0 C-N-CA 121.088 1.192 . . . . 0.0 111.376 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 23.5 mt -86.12 -44.51 12.18 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.73 HD22 HD21 ' S' ' 26' ' ' LEU . 0.9 OUTLIER -49.39 -45.55 46.25 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.12 -1.032 . . . . 0.0 109.858 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -4.0 0.89 Allowed 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.618 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 mp -103.66 -59.25 1.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.091 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 42' ' ' MET . . . . . 0.48 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -95.64 22.66 6.9 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.586 -179.805 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 43' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.1 OUTLIER -169.39 123.85 0.81 Allowed 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.586 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.75 -41.54 0.0 OUTLIER Pre-proline 0 N--CA 1.484 1.261 0 C-N-CA 117.084 -1.846 . . . . 0.0 114.855 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.586 ' HD2' ' H ' ' S' ' 44' ' ' THR . 19.1 Cg_endo -79.43 -109.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 121.12 1.213 . . . . 0.0 113.196 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 46' ' ' ASP . . . . . 0.444 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 2.3 m-20 -50.66 -12.8 0.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.488 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 47' ' ' GLU . . . . . 0.473 ' N ' ' C ' ' S' ' 45' ' ' PRO . 8.9 mm-40 -75.94 -71.82 0.36 Allowed 'General case' 0 C--N 1.297 -1.676 0 C-N-CA 119.544 -0.862 . . . . 0.0 110.582 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -49.55 -15.43 0.16 Allowed 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.894 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' C ' ' S' ' 47' ' ' GLU . 9.8 mm-40 -91.45 -69.11 0.75 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.433 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.04 -27.69 69.28 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.211 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.54 -63.59 1.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.629 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 52' ' ' GLY . . . . . 0.436 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -45.72 -48.15 13.05 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.013 -1.635 . . . . 0.0 109.013 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.509 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -45.43 -74.54 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.616 0.722 . . . . 0.0 111.86 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.55 HH21 HD23 ' R' ' 41' ' ' LEU . 0.0 OUTLIER -35.24 -58.99 0.54 Allowed 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.71 -1.132 . . . . 0.0 112.873 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 16.1 t -59.62 -25.28 31.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 C-N-CA 117.465 -1.694 . . . . 0.0 110.971 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -79.3 -38.72 34.63 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.296 -1.362 . . . . 0.0 111.443 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 0.751 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -79.08 -34.65 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 117.801 -1.56 . . . . 0.0 108.827 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 58' ' ' VAL . . . . . 0.751 ' N ' HD13 ' S' ' 57' ' ' ILE . 78.1 t -68.68 -63.11 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.183 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -50.19 -31.14 13.02 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.412 -1.315 . . . . 0.0 110.193 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 60' ' ' GLU . . . . . 0.415 ' CG ' ' O ' ' S' ' 56' ' ' ARG . 7.7 mm-40 -62.12 -62.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.551 -0.86 . . . . 0.0 112.089 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 61' ' ' LEU . . . . . 0.501 ' C ' HD12 ' S' ' 61' ' ' LEU . 4.6 pp -62.45 -8.63 6.46 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 117.738 -1.585 . . . . 0.0 109.716 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 62' ' ' LEU . . . . . 0.421 ' O ' ' C ' ' S' ' 63' ' ' ARG . 2.3 tp -79.97 33.02 0.27 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.717 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 63' ' ' ARG . . . . . 0.488 ' H ' ' C ' ' S' ' 61' ' ' LEU . 19.7 mtm180 . . . . . 0 N--CA 1.499 1.979 0 O-C-N 124.555 1.16 . . . . 0.0 113.736 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.492 0 CA-C-O 121.108 0.48 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -99.2 -103.13 0.22 Allowed 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.83 0.824 . . . . 0.0 110.839 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -140.61 -56.97 0.52 Allowed 'General case' 0 C--N 1.283 -2.3 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.139 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 tp -121.01 13.37 11.32 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.25 -55.83 27.98 Favored Glycine 0 N--CA 1.492 2.416 0 C-N-CA 119.816 -1.183 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -163.71 -68.98 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.984 -1.087 . . . . 0.0 111.225 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 78' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . 149.38 131.18 1.93 Allowed Glycine 0 N--CA 1.488 2.134 0 C-N-CA 119.372 -1.394 . . . . 0.0 110.371 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.901 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.78 -36.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.237 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.91 -44.26 73.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.583 -0.847 . . . . 0.0 112.314 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 25.3 p -62.54 -40.9 98.29 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 pt -73.35 -15.07 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 119.344 -0.943 . . . . 0.0 112.758 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.434 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -81.51 -57.21 3.57 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.492 -1.283 . . . . 0.0 111.391 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -68.68 -4.55 16.11 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.008 -1.077 . . . . 0.0 110.747 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.86 -25.55 60.0 Favored Glycine 0 N--CA 1.488 2.104 0 C-N-CA 119.321 -1.418 . . . . 0.0 110.124 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 41.8 p -105.94 -34.91 7.46 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.657 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 87' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' S' ' 89' ' ' LEU . 24.3 m120 -77.0 12.99 1.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.909 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -38.71 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.294 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 89' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' S' ' 87' ' ' ASN . 1.0 OUTLIER -42.02 -66.37 0.36 Allowed 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.646 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.49 -62.09 1.78 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.687 -1.205 . . . . 0.0 111.669 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.35 -70.85 0.09 Allowed 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.168 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.64 148.54 90.19 Favored Pre-proline 0 N--CA 1.489 1.498 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.908 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -55.0 159.54 9.38 Favored 'Trans proline' 0 C--N 1.325 -0.667 0 C-N-CA 121.066 1.177 . . . . 0.0 110.996 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -83.24 -32.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.917 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -67.46 -20.95 65.55 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.648 -0.821 . . . . 0.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 1.2 tp -62.02 -36.35 81.29 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.576 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -16.29 38.75 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.256 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -101.49 -35.47 9.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.234 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.625 ' CH2' HG21 ' S' ' 103' ' ' VAL . 19.6 t90 -66.6 -62.29 1.53 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.911 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.529 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -57.07 -32.57 66.39 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -179.711 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.529 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.9 mm-40 -42.77 -29.65 0.33 Allowed 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 117.692 -1.603 . . . . 0.0 106.746 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 102' ' ' GLU . . . . . 0.528 ' N ' ' C ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -94.99 -26.41 16.11 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.987 -1.915 . . . . 0.0 112.157 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.625 HG21 ' CH2' ' S' ' 99' ' ' TRP . 14.0 t -83.28 -14.83 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 C-N-CA 115.964 -2.294 . . . . 0.0 108.102 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 104' ' ' LEU . . . . . 0.404 ' HA ' HD12 ' S' ' 104' ' ' LEU . 19.9 tp -83.56 -53.48 5.64 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.203 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 86.4 mt -77.8 -80.03 0.11 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' S' S ' 106' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' S' ' 102' ' ' GLU . 16.2 mtpt -95.51 -160.05 0.76 Allowed 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.166 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' S' S ' 107' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' S' ' 102' ' ' GLU . 65.5 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 116.445 -1.74 . . . . 0.0 111.533 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 120.894 0.378 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' R' R ' 16' ' ' HIS . . . . . 0.464 ' CG ' ' O ' ' R' ' 16' ' ' HIS . 76.8 t60 -111.62 6.74 20.18 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.6 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' R' ' 18' ' ' GLU . 1.0 OUTLIER -91.05 -80.19 0.35 Allowed 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.358 -0.937 . . . . 0.0 111.36 -179.939 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.0 OUTLIER -44.33 -35.06 2.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 123.231 1.491 . . . . 0.0 107.824 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -52.69 -61.34 2.35 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 112.33 -2.214 . . . . 0.0 109.16 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -47.11 -44.4 21.37 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.459 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 1.0 OUTLIER -47.77 -73.1 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 118.645 -1.222 . . . . 0.0 109.639 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -25.45 -47.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.156 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 23' ' ' VAL . . . . . 0.435 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.5 t -71.14 -53.32 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 118.956 -1.097 . . . . 0.0 111.478 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 32.9 t0 -35.68 -65.19 0.26 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.647 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.11 -48.43 70.75 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.13 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.37 -46.44 62.76 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.545 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -61.6 -45.0 95.96 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 -74.73 -36.02 62.66 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.473 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -70.25 -29.26 66.02 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.622 -1.231 . . . . 0.0 113.077 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 30' ' ' TYR . . . . . 0.429 ' CD2' ' N ' ' R' ' 31' ' ' GLN . 23.7 t80 -42.01 -60.25 1.48 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.005 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 31' ' ' GLN . . . . . 0.429 ' N ' ' CD2' ' R' ' 30' ' ' TYR . 1.8 tt0 -60.43 -28.84 68.6 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.084 -1.046 . . . . 0.0 110.703 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 32' ' ' ASN . . . . . 0.436 ' OD1' ' NE1' ' S' ' 99' ' ' TRP . 0.2 OUTLIER -80.78 -15.86 55.32 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.534 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 33' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 74.15 23.98 2.02 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.949 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.82 -10.52 20.65 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 114.724 -1.125 . . . . 0.0 108.712 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -53.77 -15.57 1.33 Allowed 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.225 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -77.75 -65.4 0.36 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 117.544 -1.663 . . . . 0.0 110.662 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.8 Cg_exo -50.19 -31.76 29.99 Favored 'Trans proline' 0 C--N 1.321 -0.889 0 N-CA-C 109.686 -0.929 . . . . 0.0 109.686 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 5.6 mt -73.39 -40.41 64.35 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.443 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -60.01 -22.5 62.68 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.205 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -91.53 11.48 23.98 Favored 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.513 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.19 -64.22 1.35 Allowed 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.933 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 42' ' ' MET . . . . . 0.489 ' SD ' ' O ' ' R' ' 22' ' ' PHE . 3.4 ptp -73.71 8.96 1.62 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 117.369 -1.732 . . . . 0.0 112.246 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 65.5 mt -128.77 -174.07 3.15 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.647 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.306 0.3 OUTLIER -134.97 -145.12 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 119.093 -1.043 . . . . 0.0 109.305 179.908 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.647 ' HD3' HG22 ' R' ' 44' ' ' THR . 10.2 Cg_endo -98.62 -43.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.554 0 CA-C-N 120.614 1.255 . . . . 0.0 111.16 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.53 -27.45 38.51 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.208 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.417 ' CG ' ' H ' ' R' ' 44' ' ' THR . 5.1 mm-40 -61.56 -49.8 75.19 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.983 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.98 -34.72 66.01 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.927 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -75.56 -71.46 0.37 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.127 -1.029 . . . . 0.0 112.521 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.445 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.88 -46.49 51.7 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.304 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 tt -52.68 -45.09 66.65 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.776 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.74 -42.04 97.79 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 118.91 -1.614 . . . . 0.0 109.302 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.5 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.3 OUTLIER -49.55 -78.91 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.835 -0.682 . . . . 0.0 112.022 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.1 -37.06 0.8 Allowed 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.088 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 33.3 t -72.31 -34.24 48.55 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.593 -1.243 . . . . 0.0 110.227 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.1 OUTLIER -73.42 -38.31 65.6 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.553 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 0.994 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -77.19 -39.86 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 117.577 -1.649 . . . . 0.0 109.631 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 0.994 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.2 t -63.21 -68.76 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 117.438 -1.705 . . . . 0.0 109.325 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.522 ' N ' HG12 ' R' ' 58' ' ' VAL . 16.7 tt0 -43.16 -36.27 1.65 Allowed 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.956 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -65.67 -54.32 29.07 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 118.971 -1.091 . . . . 0.0 112.109 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 34.7 mt -78.88 -6.31 55.8 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.439 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 5.1 tp . . . . . 0 N--CA 1.491 1.617 0 C-N-CA 119.621 -0.831 . . . . 0.0 110.981 -179.948 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.912 0.387 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.16 131.99 2.08 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 119.43 -1.367 . . . . 0.0 110.295 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.827 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -45.34 -44.54 3.62 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.258 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.41 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -64.9 -62.95 1.25 Allowed 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 118.797 -1.161 . . . . 0.0 109.678 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 23.0 m -33.85 -49.23 0.32 Allowed 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.938 -1.028 . . . . 0.0 113.092 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 82' ' ' ILE . . . . . 0.438 HD13 HG21 ' R' ' 82' ' ' ILE . 30.3 pt -73.73 -34.85 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 119.006 -1.078 . . . . 0.0 113.014 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.529 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.1 OUTLIER -55.55 -67.42 0.28 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.715 -1.194 . . . . 0.0 110.83 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -6.62 1.0 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.889 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.5 -48.42 36.7 Favored Glycine 0 N--CA 1.489 2.184 0 C-N-CA 119.414 -1.375 . . . . 0.0 110.3 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.68 -7.53 54.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.718 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 87' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.2 OUTLIER -109.89 12.91 23.69 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.99 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -41.36 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.767 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 89' ' ' LEU . . . . . 0.468 ' N ' ' O ' ' R' ' 87' ' ' ASN . 4.2 mt -50.85 -33.82 25.42 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.737 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.39 -19.26 18.59 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.264 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.46 -62.81 1.42 Allowed 'General case' 0 C--N 1.291 -1.942 0 C-N-CA 118.976 -1.09 . . . . 0.0 112.31 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.612 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -99.95 164.98 15.42 Favored Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.305 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 93' ' ' PRO . . . . . 0.612 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 4.0 Cg_exo -58.83 171.87 1.86 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 C-N-CA 121.465 1.443 . . . . 0.0 111.611 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 94' ' ' VAL . . . . . 0.521 HG12 ' O ' ' R' ' 94' ' ' VAL . 75.3 t -82.11 -8.91 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 119.386 -0.926 . . . . 0.0 110.787 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -65.37 -30.36 71.18 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.598 -0.841 . . . . 0.0 111.049 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 96' ' ' LEU . . . . . 0.483 ' HG ' HD23 ' R' ' 100' ' ' LEU . 0.7 OUTLIER -60.71 -44.09 97.02 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.718 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.53 -44.89 26.16 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.17 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -73.03 -24.22 60.7 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.348 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.587 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 3.6 t90 -92.04 -66.19 0.95 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.158 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.483 HD23 ' HG ' ' R' ' 96' ' ' LEU . 2.1 mm? -43.17 -28.07 0.27 Allowed 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 118.729 -1.188 . . . . 0.0 112.865 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.456 ' C ' ' O ' ' R' ' 100' ' ' LEU . 3.5 mt-10 -46.98 -38.81 11.31 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 117.491 -1.684 . . . . 0.0 106.823 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -90.67 -30.9 16.85 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.908 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.587 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.5 t -85.88 -12.37 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 C-N-CA 117.331 -1.747 . . . . 0.0 111.224 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 104' ' ' LEU . . . . . 0.413 ' HA ' HD12 ' R' ' 104' ' ' LEU . 18.8 tp -96.98 -55.3 2.91 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.625 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 105' ' ' LEU . . . . . 0.493 HD22 ' N ' ' R' ' 105' ' ' LEU . 4.0 mm? -72.49 -74.55 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.923 -1.111 . . . . 0.0 111.32 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 11.0 ttpt . . . . . 0 N--CA 1.486 1.35 0 C-N-CA 119.513 -0.875 . . . . 0.0 110.955 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 121.308 0.575 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 16' ' ' HIS . . . . . 0.401 ' H ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER -171.34 -4.07 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' S' ' 18' ' ' GLU . 63.8 tt0 -82.01 -86.01 0.1 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.051 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' S' ' 17' ' ' GLN . 1.0 OUTLIER -40.43 -34.83 0.37 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 122.648 1.213 . . . . 0.0 109.156 179.789 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -51.26 -60.91 2.61 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.041 -1.891 . . . . 0.0 110.457 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.32 -31.97 35.75 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.645 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.506 ' O ' ' C ' ' S' ' 22' ' ' PHE . 11.7 mmm-85 -59.68 -71.56 0.12 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.506 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.1 t80 -32.74 -50.47 0.26 Allowed 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 119.341 -0.944 . . . . 0.0 111.096 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.31 -44.81 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.427 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.419 ' O ' ' C ' ' S' ' 25' ' ' LEU . 25.7 t0 -48.14 -75.88 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.651 -0.82 . . . . 0.0 111.609 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.419 ' C ' ' O ' ' S' ' 24' ' ' ASP . 1.2 mt -39.91 -44.78 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.756 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.557 HD21 ' CD1' ' S' ' 39' ' ' LEU . 0.2 OUTLIER -54.41 -57.39 11.49 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.01 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.75 -49.86 0.8 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -85.59 -32.62 21.99 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 118.922 -1.111 . . . . 0.0 113.355 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 29' ' ' ALA . . . . . 0.463 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -66.75 -39.85 88.08 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.072 -1.051 . . . . 0.0 112.541 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -58.21 -38.32 76.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.93 -1.108 . . . . 0.0 112.028 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.0 -21.79 4.89 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 118.712 -1.195 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.46 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 35.3 m120 -111.57 -76.27 0.6 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.829 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.0 OUTLIER 172.06 1.28 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 118.644 -1.222 . . . . 0.0 113.02 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 34' ' ' LEU . . . . . 0.978 HD22 ' H ' ' S' ' 34' ' ' LEU . 0.9 OUTLIER -75.01 -18.51 60.35 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.609 -0.836 . . . . 0.0 111.558 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -51.12 -22.68 2.63 Favored 'General case' 0 C--N 1.293 -1.866 0 C-N-CA 119.494 -0.882 . . . . 0.0 112.746 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.467 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.4 mt -73.35 -64.03 0.89 Allowed Pre-proline 0 N--CA 1.486 1.338 0 C-N-CA 118.327 -1.349 . . . . 0.0 110.234 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.467 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -53.45 -32.73 64.09 Favored 'Trans proline' 0 C--N 1.322 -0.864 0 C-N-CA 120.769 0.979 . . . . 0.0 110.455 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 38' ' ' LEU . . . . . 0.421 HD21 HD21 ' R' ' 96' ' ' LEU . 21.8 mt -74.12 -39.7 63.17 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.19 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.557 ' CD1' HD21 ' S' ' 26' ' ' LEU . 0.2 OUTLIER -52.97 -44.2 66.98 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.332 179.802 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 40' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.1 OUTLIER -66.94 -0.92 3.44 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.536 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 tp -105.32 -67.36 0.92 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.623 -0.831 . . . . 0.0 112.964 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 42' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 2.0 mmm -91.04 47.6 1.42 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 118.761 -1.175 . . . . 0.0 111.624 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 43' ' ' LEU . . . . . 0.848 ' O ' HD23 ' S' ' 43' ' ' LEU . 0.3 OUTLIER 160.72 125.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.641 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -179.33 -41.86 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.376 0 C-N-CA 116.507 -2.077 . . . . 0.0 115.794 -179.694 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.641 ' HD2' ' H ' ' S' ' 44' ' ' THR . 5.5 Cg_endo -65.71 -110.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 120.713 0.942 . . . . 0.0 113.343 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 46' ' ' ASP . . . . . 0.483 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 0.2 OUTLIER -54.91 -12.14 0.76 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 119.029 -1.068 . . . . 0.0 110.361 -179.735 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 47' ' ' GLU . . . . . 0.428 ' N ' ' C ' ' S' ' 45' ' ' PRO . 6.4 mm-40 -68.17 -64.39 0.87 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.607 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -57.82 -33.45 68.62 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.255 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -70.41 -63.12 1.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.21 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.09 -37.52 83.01 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.336 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 mt -46.74 -57.57 4.72 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 118.64 -1.224 . . . . 0.0 109.293 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 52' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' S' ' 53' ' ' THR . . . -52.2 -64.96 3.57 Favored Glycine 0 N--CA 1.484 1.852 0 N-CA-C 108.486 -1.846 . . . . 0.0 108.486 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.574 ' O ' HG22 ' S' ' 57' ' ' ILE . 0.2 OUTLIER -34.85 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.641 0.734 . . . . 0.0 112.78 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.4 ' CD ' ' HA ' ' R' ' 42' ' ' MET . 8.1 ttp85 -51.57 -46.11 63.31 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.376 -1.284 . . . . 0.0 113.393 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 95.1 t -68.95 -19.08 23.61 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 C-N-CA 117.473 -1.691 . . . . 0.0 109.918 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.411 ' CD ' ' C ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -85.62 -37.06 19.93 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.542 -1.263 . . . . 0.0 110.804 -179.958 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 0.738 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -74.54 -38.38 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 117.429 -1.708 . . . . 0.0 107.902 179.942 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 58' ' ' VAL . . . . . 0.738 ' N ' HD13 ' S' ' 57' ' ' ILE . 0.9 OUTLIER -60.43 -50.95 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 117.156 -1.817 . . . . 0.0 107.399 179.452 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 59' ' ' GLU . . . . . 0.446 ' N ' HG12 ' S' ' 58' ' ' VAL . 3.4 tt0 -51.7 -31.88 27.82 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.092 179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -68.99 -57.58 5.28 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 118.98 -1.088 . . . . 0.0 112.178 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 61' ' ' LEU . . . . . 0.646 ' C ' HD12 ' S' ' 61' ' ' LEU . 3.6 pp -61.43 -7.47 3.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.912 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 62' ' ' LEU . . . . . 0.604 ' N ' HD12 ' S' ' 61' ' ' LEU . 7.0 tp -76.13 28.88 0.12 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 119.494 -0.882 . . . . 0.0 110.586 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 63' ' ' ARG . . . . . 0.514 ' H ' ' C ' ' S' ' 61' ' ' LEU . 3.9 mtm180 . . . . . 0 N--CA 1.5 2.075 0 O-C-N 124.361 1.038 . . . . 0.0 113.625 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.5 tttm . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.012 0.434 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -81.2 -102.93 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.76 0.79 . . . . 0.0 110.7 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -141.87 -65.63 0.42 Allowed 'General case' 0 C--N 1.279 -2.482 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.505 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 mp -82.42 5.96 18.76 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.684 -0.807 . . . . 0.0 109.162 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 76' ' ' GLY . . . . . 0.504 ' O ' ' HB2' ' S' ' 77' ' ' ALA . . . -68.87 -56.13 9.85 Favored Glycine 0 N--CA 1.488 2.106 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.196 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 77' ' ' ALA . . . . . 0.504 ' HB2' ' O ' ' S' ' 76' ' ' GLY . . . 175.54 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.004 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 175.79 167.89 35.36 Favored Glycine 0 N--CA 1.493 2.443 0 C-N-CA 119.363 -1.399 . . . . 0.0 110.823 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.808 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -62.77 -43.52 98.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.234 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -58.25 -53.83 53.82 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.234 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 81' ' ' THR . . . . . 0.406 HG21 ' HB1' ' S' ' 77' ' ' ALA . 0.5 OUTLIER -43.14 -60.49 1.64 Allowed 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.786 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 82' ' ' ILE . . . . . 0.417 HG21 HD13 ' S' ' 82' ' ' ILE . 15.8 pt -68.46 10.47 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -106.7 -45.42 4.22 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.982 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 84' ' ' ARG . . . . . 0.46 ' NH1' ' HB1' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -74.4 -32.79 62.82 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.785 -1.166 . . . . 0.0 111.489 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.27 -45.59 90.41 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 119.242 -1.456 . . . . 0.0 110.23 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.45 -29.48 69.62 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.169 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 87' ' ' ASN . . . . . 0.523 ' O ' ' N ' ' S' ' 89' ' ' LEU . 1.2 m-20 -100.8 15.91 26.83 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.6 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 88' ' ' SER . . . . . 0.406 ' C ' ' O ' ' S' ' 87' ' ' ASN . 0.5 OUTLIER -37.85 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 120.249 -0.581 . . . . 0.0 112.004 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 89' ' ' LEU . . . . . 0.523 ' N ' ' O ' ' S' ' 87' ' ' ASN . 11.8 mt -57.38 -54.65 44.42 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.392 -0.923 . . . . 0.0 111.298 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -94.83 -35.27 12.14 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.689 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.01 -49.12 72.31 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.602 -1.181 . . . . 0.0 112.498 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 92' ' ' ALA . . . . . 0.77 ' HB3' HH22 ' S' ' 97' ' ' ARG . . . -86.53 163.74 40.54 Favored Pre-proline 0 N--CA 1.489 1.516 0 C-N-CA 119.164 -1.014 . . . . 0.0 111.598 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 93' ' ' PRO . . . . . 0.596 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 3.0 Cg_exo -53.67 175.96 0.1 Allowed 'Trans proline' 0 C--N 1.324 -0.732 0 C-N-CA 121.546 1.497 . . . . 0.0 111.429 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -108.55 -33.67 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.291 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.65 3.29 29.5 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.186 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -31.25 24.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.798 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 97' ' ' ARG . . . . . 0.77 HH22 ' HB3' ' S' ' 92' ' ' ALA . 0.0 OUTLIER -63.8 -23.05 67.21 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.014 -1.074 . . . . 0.0 110.259 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -78.07 -14.34 59.53 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.033 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.747 ' CH2' HG21 ' S' ' 103' ' ' VAL . 21.4 t90 -107.36 -59.09 1.87 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.019 0.914 . . . . 0.0 111.513 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.524 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.7 OUTLIER -58.61 -34.04 70.69 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.517 ' C ' ' O ' ' S' ' 100' ' ' LEU . 5.0 mt-10 -43.3 -32.2 0.76 Allowed 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 117.29 -1.764 . . . . 0.0 106.571 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 102' ' ' GLU . . . . . 0.524 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.7 mt-10 -89.97 -23.78 21.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 112.637 -2.074 . . . . 0.0 112.437 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.747 HG21 ' CH2' ' S' ' 99' ' ' TRP . 21.9 t -88.17 -22.73 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 C-N-CA 116.255 -2.178 . . . . 0.0 109.975 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 104' ' ' LEU . . . . . 0.563 HD21 HD11 ' S' ' 62' ' ' LEU . 21.6 tp -81.29 -55.23 4.86 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.032 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mt -57.87 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 118.325 -1.35 . . . . 0.0 110.274 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' S' S ' 106' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' S' ' 102' ' ' GLU . 0.4 OUTLIER -112.07 -177.83 3.27 Favored 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.512 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 116.417 -1.754 . . . . 0.0 110.838 179.955 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 . . . . . 0 N--CA 1.483 1.222 0 CA-C-O 120.821 0.343 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -71.13 63.29 0.33 Allowed 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.057 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.51 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.2 mt-30 -115.12 -76.86 0.57 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -55.4 -17.93 5.88 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 123.55 1.643 . . . . 0.0 106.666 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 19' ' ' TRP . . . . . 0.51 ' N ' ' C ' ' R' ' 17' ' ' GLN . 63.0 t-105 -57.22 -61.67 2.3 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 111.421 -2.627 . . . . 0.0 109.666 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tp -50.04 -38.4 37.71 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.558 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.553 ' O ' ' N ' ' R' ' 24' ' ' ASP . 11.7 mtt-85 -54.28 -69.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.273 -1.371 . . . . 0.0 110.121 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.526 ' CG ' HD22 ' S' ' 51' ' ' LEU . 0.1 OUTLIER -35.39 -43.1 0.23 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 119.046 -1.061 . . . . 0.0 110.705 179.616 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 85.2 t -68.58 -38.44 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.437 -0.905 . . . . 0.0 110.093 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' R' ' 21' ' ' ARG . 27.6 t70 -48.55 -75.57 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.096 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.419 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.2 OUTLIER -44.6 -45.21 9.39 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.857 179.877 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 26' ' ' LEU . . . . . 0.418 HD12 ' CE1' ' R' ' 22' ' ' PHE . 1.4 tt -42.39 -58.17 2.32 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.472 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 27' ' ' LYS . . . . . 0.536 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.5 OUTLIER -69.49 -61.66 1.7 Allowed 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.763 -0.775 . . . . 0.0 112.319 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -46.11 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.536 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -114.16 -29.19 7.04 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 119.302 -0.959 . . . . 0.0 113.127 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -48.54 -41.6 30.85 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 118.875 -1.13 . . . . 0.0 111.31 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.29 -22.54 66.3 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.113 -1.035 . . . . 0.0 111.495 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 32' ' ' ASN . . . . . 0.529 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 22.1 t-20 -102.16 -10.98 19.15 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.83 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 33' ' ' ASP . . . . . 0.529 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 81.66 13.2 0.63 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 121.643 0.735 . . . . 0.0 110.195 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -86.91 -15.76 37.99 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.267 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -52.25 -30.45 27.69 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 113.881 -1.508 . . . . 0.0 113.439 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.465 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 3.3 mt -66.64 -63.46 2.96 Favored Pre-proline 0 C--N 1.304 -1.401 0 C-N-CA 117.92 -1.512 . . . . 0.0 110.557 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.465 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.5 Cg_exo -52.75 -27.79 35.44 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 C-N-CA 120.536 0.824 . . . . 0.0 110.556 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 38' ' ' LEU . . . . . 0.447 HD11 ' CZ3' ' S' ' 99' ' ' TRP . 15.1 mt -84.49 -36.43 22.26 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.778 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.466 ' C ' ' H ' ' R' ' 41' ' ' LEU . 0.0 OUTLIER -51.47 -57.45 9.0 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.761 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.13 2.51 0.55 Allowed 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.049 -1.06 . . . . 0.0 111.113 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 41' ' ' LEU . . . . . 0.466 ' H ' ' C ' ' R' ' 39' ' ' LEU . 3.7 tp -93.32 -64.11 1.13 Allowed 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.509 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 42' ' ' MET . . . . . 0.463 ' O ' HD23 ' S' ' 51' ' ' LEU . 0.0 OUTLIER -79.53 12.57 2.43 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 117.431 -1.708 . . . . 0.0 109.406 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 43' ' ' LEU . . . . . 0.519 HD21 ' CE1' ' R' ' 22' ' ' PHE . 19.6 mt -132.34 169.96 15.76 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.608 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.29 0.2 OUTLIER -132.24 -135.52 0.0 OUTLIER Pre-proline 0 CA--C 1.57 1.735 0 CA-C-O 116.957 -1.497 . . . . 0.0 109.725 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.608 ' HD3' HG22 ' R' ' 44' ' ' THR . 18.8 Cg_endo -100.45 -49.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.483 0.874 0 CA-C-N 123.127 2.152 . . . . 0.0 112.051 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.43 -22.05 4.32 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.549 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.31 -52.8 11.19 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.89 -13.14 21.97 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.318 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -88.42 -65.09 1.05 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.144 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.588 ' HB1' HH11 ' R' ' 54' ' ' ARG . . . -61.63 -44.18 97.47 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.077 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.45 -60.63 2.39 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.665 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -44.76 42.1 Favored Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.297 -1.43 . . . . 0.0 109.973 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.496 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.2 OUTLIER -48.21 -79.93 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.092 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.588 HH11 ' HB1' ' R' ' 50' ' ' ALA . 0.1 OUTLIER -39.91 -37.77 0.61 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.199 -179.818 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 55' ' ' VAL . . . . . 0.595 HG22 ' HB3' ' S' ' 42' ' ' MET . 93.5 t -72.64 -35.27 50.06 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.726 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.9 OUTLIER -77.21 -39.45 48.64 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.151 -1.02 . . . . 0.0 111.821 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 0.794 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -73.38 -36.14 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 117.713 -1.595 . . . . 0.0 108.383 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 0.794 ' N ' HD13 ' R' ' 57' ' ' ILE . 3.1 t -56.28 -65.24 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 C-N-CA 118.07 -1.452 . . . . 0.0 109.39 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.507 ' N ' HG12 ' R' ' 58' ' ' VAL . 63.3 mt-10 -47.61 -44.55 26.76 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.88 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -46.15 -44.36 15.78 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.874 -0.731 . . . . 0.0 111.758 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 9.8 mt -99.15 -0.1 42.31 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.291 -0.964 . . . . 0.0 111.668 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.493 1.696 0 C-N-CA 119.194 -1.002 . . . . 0.0 111.448 179.981 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 120.922 0.391 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -161.73 155.27 26.46 Favored Glycine 0 N--CA 1.493 2.446 0 C-N-CA 119.48 -1.343 . . . . 0.0 110.279 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.749 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -54.77 -49.5 68.36 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.785 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.444 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -61.14 -56.51 20.02 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.036 -1.066 . . . . 0.0 111.217 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 4.0 m -38.87 -54.42 1.63 Allowed 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 9.4 pt -64.72 -20.65 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.514 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -75.32 -73.28 0.26 Allowed 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 118.389 -1.324 . . . . 0.0 111.677 -179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -6.24 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.545 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 85' ' ' GLY . . . . . 0.514 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -69.25 -46.03 58.97 Favored Glycine 0 N--CA 1.49 2.287 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.741 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 86' ' ' SER . . . . . 0.493 ' C ' ' H ' ' R' ' 88' ' ' SER . 33.8 t -102.77 -42.14 5.97 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.438 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -67.5 9.42 0.25 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.606 -0.837 . . . . 0.0 111.234 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 88' ' ' SER . . . . . 0.527 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.4 OUTLIER -74.22 -22.91 59.15 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.031 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 89' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' R' ' 88' ' ' SER . 3.8 mt -37.29 -25.31 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.996 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 90' ' ' LYS . . . . . 0.527 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -108.71 -56.66 2.24 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.318 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.84 -6.21 2.57 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.663 -1.153 . . . . 0.0 112.585 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 138.68 97.48 Favored Pre-proline 0 N--CA 1.489 1.505 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.567 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -63.01 128.28 22.56 Favored 'Trans proline' 0 C--O 1.214 -0.705 0 C-N-CA 121.016 1.144 . . . . 0.0 111.582 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 94' ' ' VAL . . . . . 0.581 HG12 ' O ' ' R' ' 94' ' ' VAL . 82.7 t -67.68 -5.5 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.487 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -91.93 7.62 41.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.723 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.1 tp -104.35 -41.93 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.163 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.7 -47.2 67.41 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.286 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -60.04 -17.37 38.57 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.674 -0.81 . . . . 0.0 112.567 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.676 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 3.9 t90 -113.66 -65.26 1.2 Allowed 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.489 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.494 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.3 mm? -39.89 -38.56 0.7 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.494 ' C ' ' O ' ' R' ' 100' ' ' LEU . 11.2 mt-10 -43.79 -33.94 1.43 Allowed 'General case' 0 C--N 1.291 -1.966 0 C-N-CA 117.738 -1.585 . . . . 0.0 107.825 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 102' ' ' GLU . . . . . 0.441 ' N ' ' C ' ' R' ' 100' ' ' LEU . 6.4 mt-10 -91.75 -31.85 15.62 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.939 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.676 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 3.2 t -82.44 -10.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 117.288 -1.765 . . . . 0.0 110.287 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 104' ' ' LEU . . . . . 0.422 ' HA ' HD12 ' R' ' 104' ' ' LEU . 34.0 tp -92.95 -50.44 5.55 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.631 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.5 -66.44 0.38 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 119.16 -1.016 . . . . 0.0 110.252 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm . . . . . 0 N--CA 1.487 1.419 0 C-N-CA 119.681 -0.807 . . . . 0.0 111.179 179.925 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' S' S ' 15' ' ' ARG . . . . . 0.49 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.764 0.316 . . . . 0.0 110.847 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -66.11 7.73 0.27 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.757 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.495 ' O ' ' N ' ' S' ' 20' ' ' LEU . 2.2 mp0 -92.65 -85.51 0.26 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.76 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.6 mt-10 -42.93 -29.93 0.37 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 122.966 1.365 . . . . 0.0 108.276 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 19' ' ' TRP . . . . . 0.466 ' N ' ' C ' ' S' ' 17' ' ' GLN . 22.8 t-105 -56.45 -54.43 45.73 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 112.729 -2.032 . . . . 0.0 107.927 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 20' ' ' LEU . . . . . 0.495 ' N ' ' O ' ' S' ' 17' ' ' GLN . 0.5 OUTLIER -57.64 -36.55 72.0 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 113.573 -1.648 . . . . 0.0 111.455 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -54.82 -74.41 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 118.595 -1.242 . . . . 0.0 110.027 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.547 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.7 OUTLIER -27.13 -48.26 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 119.234 -0.986 . . . . 0.0 111.472 179.626 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' S' ' 21' ' ' ARG . 62.2 t -66.82 -49.75 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.439 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' S' ' 21' ' ' ARG . 15.6 t70 -41.07 -56.25 2.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.583 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.56 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.2 OUTLIER -60.61 -45.32 94.45 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.272 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' S' ' 26' ' ' LEU . 0.2 OUTLIER -48.31 -43.71 33.27 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.389 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.05 -41.04 33.73 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.84 -9.86 18.67 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 119.305 -0.958 . . . . 0.0 113.329 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -46.69 15.02 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.774 -1.171 . . . . 0.0 112.096 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 30' ' ' TYR . . . . . 0.408 ' C ' ' N ' ' S' ' 32' ' ' ASN . 17.7 t80 -49.93 -46.34 51.98 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.687 -0.805 . . . . 0.0 112.015 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -47.4 -19.68 0.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.138 -1.025 . . . . 0.0 111.212 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.494 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 79.4 m-20 -110.67 -68.58 0.92 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.213 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.494 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.1 OUTLIER 160.17 -13.42 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.53 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 34' ' ' LEU . . . . . 0.435 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 1.4 mm? -54.94 -17.81 4.19 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.941 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 35' ' ' HIS . . . . . 0.434 ' ND1' ' O ' ' S' ' 33' ' ' ASP . 19.4 p-80 -50.17 -21.12 1.19 Allowed 'General case' 0 C--N 1.292 -1.904 0 C-N-CA 119.486 -0.886 . . . . 0.0 112.338 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.459 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -77.94 -64.1 0.42 Allowed Pre-proline 0 N--CA 1.484 1.239 0 C-N-CA 118.481 -1.288 . . . . 0.0 111.173 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -51.4 -42.31 55.52 Favored 'Trans proline' 0 C--N 1.319 -0.993 0 C-N-CA 120.526 0.817 . . . . 0.0 110.495 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.98 -54.6 44.82 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.589 -0.844 . . . . 0.0 110.416 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.4 OUTLIER -46.22 -53.21 11.0 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.816 179.864 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -52.36 -10.67 0.15 Allowed 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -107.14 -60.37 1.69 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.726 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 42' ' ' MET . . . . . 0.595 ' HB3' HG22 ' R' ' 55' ' ' VAL . 0.0 OUTLIER -89.62 28.51 1.29 Allowed 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.462 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 43' ' ' LEU . . . . . 0.715 ' C ' HD23 ' S' ' 43' ' ' LEU . 5.3 tt -178.13 127.95 0.13 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.506 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -178.98 -42.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.484 0 C-N-CA 116.514 -2.074 . . . . 0.0 116.276 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.506 ' HD2' ' H ' ' S' ' 44' ' ' THR . 19.1 Cg_endo -78.72 -107.17 0.01 OUTLIER 'Trans proline' 0 CA--C 1.553 1.464 0 C-N-CA 121.251 1.301 . . . . 0.0 114.12 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -47.52 -16.85 0.07 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.118 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 47' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' S' ' 49' ' ' GLU . 22.0 mm-40 -69.42 -76.9 0.09 Allowed 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.149 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 48' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' S' ' 47' ' ' GLU . 11.0 ttp85 -38.32 -27.13 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.245 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 49' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' S' ' 47' ' ' GLU . 3.3 tt0 -77.47 -62.32 1.7 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 118.239 -1.385 . . . . 0.0 110.821 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 50' ' ' ALA . . . . . 0.463 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -59.47 -35.64 74.47 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.774 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 51' ' ' LEU . . . . . 0.526 HD22 ' CG ' ' R' ' 22' ' ' PHE . 95.2 mt -55.41 -72.48 0.07 Allowed 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.419 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.78 -40.32 5.23 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.456 -1.354 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.473 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -50.79 -80.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.616 -0.833 . . . . 0.0 112.496 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.628 HH21 HG11 ' S' ' 58' ' ' VAL . 0.0 OUTLIER -39.42 -35.34 0.27 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.401 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.3 t -74.66 -31.0 25.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 C-N-CA 118.452 -1.299 . . . . 0.0 111.013 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.473 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.5 -36.89 32.67 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.818 -1.153 . . . . 0.0 111.421 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 0.852 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -72.91 -40.11 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 118.078 -1.449 . . . . 0.0 108.604 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 58' ' ' VAL . . . . . 0.852 ' N ' HD13 ' S' ' 57' ' ' ILE . 19.3 t -59.46 -59.25 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 C-N-CA 117.463 -1.695 . . . . 0.0 108.837 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.1 -23.52 5.48 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.544 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.04 -58.09 5.07 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.631 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 61' ' ' LEU . . . . . 0.582 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -64.85 -9.96 24.75 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 118.564 -1.254 . . . . 0.0 110.737 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 62' ' ' LEU . . . . . 0.457 ' O ' ' C ' ' S' ' 63' ' ' ARG . 12.6 tp -72.65 28.62 0.06 Allowed 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 119.552 -0.859 . . . . 0.0 109.814 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 63' ' ' ARG . . . . . 0.582 ' H ' ' C ' ' S' ' 61' ' ' LEU . 47.7 mtt-85 . . . . . 0 N--CA 1.5 2.04 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 tttm . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 120.768 0.318 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -92.01 -103.4 0.11 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.305 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -140.95 -56.65 0.5 Allowed 'General case' 0 C--N 1.279 -2.491 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.884 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.11 5.21 40.29 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.4 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.92 -58.61 12.86 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 119.551 -1.309 . . . . 0.0 110.907 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.85 -82.02 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.126 -1.03 . . . . 0.0 111.003 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 157.23 132.3 1.44 Allowed Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.249 -1.453 . . . . 0.0 110.664 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.801 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -42.26 -45.6 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.127 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.45 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -62.83 -57.33 11.25 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.167 -1.013 . . . . 0.0 111.622 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 81' ' ' THR . . . . . 0.531 ' CG2' HG21 ' S' ' 57' ' ' ILE . 23.6 m -47.24 -47.42 24.7 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.764 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 82' ' ' ILE . . . . . 0.415 HG21 HD13 ' S' ' 82' ' ' ILE . 22.1 pt -75.14 -0.61 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.662 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -90.6 -60.84 1.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 118.583 -1.247 . . . . 0.0 111.699 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -13.27 34.64 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.251 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.53 -48.57 83.95 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.373 -1.394 . . . . 0.0 110.699 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -88.46 -25.26 22.71 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.161 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -94.54 8.75 41.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.757 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.07 -28.13 16.38 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.753 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 89' ' ' LEU . . . . . 0.532 ' H ' HD12 ' S' ' 89' ' ' LEU . 9.4 mp -42.42 -64.3 0.63 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.864 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 90' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' S' ' 91' ' ' ALA . 0.0 OUTLIER -95.77 -51.44 4.49 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.778 -179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 91' ' ' ALA . . . . . 0.44 ' C ' ' O ' ' S' ' 90' ' ' LYS . . . -34.26 -51.87 0.46 Allowed 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.889 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 92' ' ' ALA . . . . . 0.567 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -82.83 162.71 54.31 Favored Pre-proline 0 C--N 1.303 -1.432 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.464 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 93' ' ' PRO . . . . . 0.567 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 4.4 Cg_exo -56.39 144.67 82.28 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 121.475 1.45 . . . . 0.0 111.222 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 94' ' ' VAL . . . . . 0.421 ' C ' ' H ' ' S' ' 96' ' ' LEU . 6.0 t -85.15 -6.82 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 119.286 -0.965 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.22 4.48 1.64 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.655 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 96' ' ' LEU . . . . . 0.421 ' H ' ' C ' ' S' ' 94' ' ' VAL . 8.0 mp -97.02 -19.16 18.94 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.498 -0.881 . . . . 0.0 111.011 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 97' ' ' ARG . . . . . 0.438 ' N ' ' CD ' ' S' ' 97' ' ' ARG . 3.5 mpt_? -64.2 -42.75 96.51 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.438 -0.905 . . . . 0.0 111.003 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -86.51 -1.78 57.9 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.705 ' CH2' HG21 ' S' ' 103' ' ' VAL . 10.7 t90 -115.63 -66.14 1.12 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.573 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.6 OUTLIER -52.67 -38.06 59.83 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.514 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.3 mm-40 -41.95 -26.95 0.1 Allowed 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 117.573 -1.651 . . . . 0.0 107.285 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 102' ' ' GLU . . . . . 0.573 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -95.57 -25.61 16.1 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 113.462 -1.699 . . . . 0.0 112.127 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.705 HG21 ' CH2' ' S' ' 99' ' ' TRP . 8.2 t -84.22 -20.32 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 116.148 -2.221 . . . . 0.0 108.119 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 104' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' S' ' 104' ' ' LEU . 19.3 tp -81.43 -57.4 3.49 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.857 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 1.1 mt -49.06 -61.89 1.83 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 118.672 -1.211 . . . . 0.0 109.446 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -74.24 170.21 16.02 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.683 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' S' S ' 107' ' ' SER . . . . . 0.413 ' O ' ' OG ' ' S' ' 107' ' ' SER . 29.5 t . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 116.247 -1.835 . . . . 0.0 110.703 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 15' ' ' ARG . . . . . 0.51 ' C ' ' H ' ' R' ' 17' ' ' GLN . 4.5 mmt85 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 121.377 0.608 . . . . 0.0 112.326 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 16' ' ' HIS . . . . . 0.714 ' NE2' HD21 ' S' ' 36' ' ' LEU . 10.1 t-80 -69.17 24.81 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.151 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.537 ' O ' ' N ' ' R' ' 19' ' ' TRP . 4.3 mt-30 -85.59 -98.47 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.488 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 18' ' ' GLU . . . . . 0.496 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.7 mt-10 -32.0 -37.08 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-O 123.259 1.504 . . . . 0.0 108.989 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 19' ' ' TRP . . . . . 0.633 ' CD1' ' CD2' ' R' ' 16' ' ' HIS . 57.3 t-105 -50.09 -57.96 6.54 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 112.553 -2.112 . . . . 0.0 109.604 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 20' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' R' ' 17' ' ' GLN . 7.9 tp -54.64 -46.01 73.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.014 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -45.39 -68.4 0.2 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.456 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.448 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.1 OUTLIER -36.8 -38.81 0.19 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.82 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 97.3 t -73.5 -50.06 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.741 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -41.5 -64.65 0.53 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.877 -0.729 . . . . 0.0 111.24 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.453 ' HG ' ' H ' ' R' ' 25' ' ' LEU . 0.8 OUTLIER -54.4 -48.42 71.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.9 -0.72 . . . . 0.0 110.979 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 26' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' R' ' 25' ' ' LEU . 1.1 tt -35.31 -62.42 0.39 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.535 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 27' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.6 OUTLIER -57.5 -68.03 0.27 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.059 -1.056 . . . . 0.0 112.02 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -44.57 -17.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.514 ' HB1' ' N ' ' R' ' 35' ' ' HIS . . . -95.93 -31.27 13.18 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.521 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 30' ' ' TYR . . . . . 0.508 ' CE1' ' NZ ' ' S' ' 27' ' ' LYS . 15.1 t80 -55.86 -40.33 72.74 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.716 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -71.1 -21.97 62.15 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.805 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 32' ' ' ASN . . . . . 0.527 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 26.5 m120 -100.07 -16.1 17.99 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 33' ' ' ASP . . . . . 0.527 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 5.3 t70 83.73 23.56 0.13 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 123.671 0.607 . . . . 0.0 110.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -98.58 -14.79 19.76 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.769 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 35' ' ' HIS . . . . . 0.514 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 1.9 p-80 -48.11 -35.12 10.84 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.294 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.458 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 6.0 mt -64.82 -63.07 3.99 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 118.024 -1.47 . . . . 0.0 111.697 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -48.63 -35.03 28.59 Favored 'Trans proline' 0 C--N 1.315 -1.219 0 C-N-CA 120.917 1.078 . . . . 0.0 111.894 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 38' ' ' LEU . . . . . 0.405 HD11 ' CZ3' ' S' ' 99' ' ' TRP . 72.8 mt -76.81 -40.65 47.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.637 -0.825 . . . . 0.0 110.246 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.465 HD13 ' O ' ' R' ' 35' ' ' HIS . 0.3 OUTLIER -56.81 -22.17 34.32 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.681 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -89.44 6.64 39.86 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.176 -1.009 . . . . 0.0 111.117 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 41' ' ' LEU . . . . . 0.477 ' C ' ' H ' ' R' ' 43' ' ' LEU . 67.3 mt -114.54 -60.88 1.83 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.227 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 42' ' ' MET . . . . . 0.403 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -71.12 16.24 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.348 -1.341 . . . . 0.0 111.535 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 43' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' R' ' 41' ' ' LEU . 4.8 mp -141.67 159.18 42.76 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.131 -0.627 . . . . 0.0 109.374 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.699 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.288 0.3 OUTLIER -107.67 -148.94 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.623 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.453 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.699 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.4 Cg_endo -98.12 -39.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.474 0.357 0 CA-C-N 119.945 1.016 . . . . 0.0 110.524 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.379 -0.928 . . . . 0.0 110.165 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.9 -41.77 95.33 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.91 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.03 -34.8 73.73 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.57 -0.852 . . . . 0.0 111.245 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.14 -64.42 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.74 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.433 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -53.95 -39.71 66.18 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.181 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -48.61 -67.6 0.26 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.612 -0.835 . . . . 0.0 110.862 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 52' ' ' GLY . . . . . 0.408 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -45.32 -52.82 8.35 Favored Glycine 0 N--CA 1.486 2.002 0 C-N-CA 119.283 -1.437 . . . . 0.0 110.644 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' R' ' 50' ' ' ALA . 0.2 OUTLIER -37.7 -78.58 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.276 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 9.6 mtt85 -40.94 -51.89 3.16 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.294 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 59.1 t -64.36 -26.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 C-N-CA 118.344 -1.343 . . . . 0.0 111.34 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.411 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -81.23 -39.28 25.62 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.826 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 0.92 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -74.33 -34.78 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 117.718 -1.593 . . . . 0.0 108.465 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 0.92 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.3 t -61.43 -65.27 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 118.004 -1.478 . . . . 0.0 109.414 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.482 ' N ' HG12 ' R' ' 58' ' ' VAL . 5.3 mm-40 -41.28 -50.73 3.67 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.882 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.64 -47.32 82.56 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.823 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 80.9 mt -83.09 6.09 20.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.538 -0.865 . . . . 0.0 112.241 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 tp . . . . . 0 N--CA 1.492 1.675 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.365 179.998 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.736 0.303 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.45 138.36 2.69 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.491 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.879 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.28 -38.99 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.221 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.93 -61.62 1.95 Allowed 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.891 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 48.9 m -38.75 -38.87 0.45 Allowed 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 13.4 pt -82.27 -22.64 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.45 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 83' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.85 -55.19 21.0 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 118.693 -1.203 . . . . 0.0 111.663 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 84' ' ' ARG . . . . . 0.421 ' H ' ' HD2' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -72.91 -9.71 58.99 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.171 -1.012 . . . . 0.0 111.484 -179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.01 -32.79 52.01 Favored Glycine 0 N--CA 1.49 2.274 0 C-N-CA 119.089 -1.529 . . . . 0.0 110.775 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 86' ' ' SER . . . . . 0.483 ' C ' ' H ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -84.88 -55.82 3.89 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.213 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 87' ' ' ASN . . . . . 0.402 ' O ' ' C ' ' R' ' 88' ' ' SER . 25.1 m-80 -69.06 11.61 0.2 Allowed 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.324 -0.951 . . . . 0.0 111.264 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 88' ' ' SER . . . . . 0.483 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.3 OUTLIER -42.61 -31.27 0.43 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 1.5 mt -50.22 -45.1 53.54 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.875 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 90' ' ' LYS . . . . . 0.533 ' O ' ' N ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -107.47 -54.57 2.46 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.772 -0.771 . . . . 0.0 111.112 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.68 -27.78 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.237 -1.347 . . . . 0.0 112.643 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.533 ' N ' ' O ' ' R' ' 90' ' ' LYS . . . -88.0 156.12 52.26 Favored Pre-proline 0 N--CA 1.49 1.535 0 C-N-CA 118.674 -1.21 . . . . 0.0 110.698 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -51.84 129.58 30.86 Favored 'Trans proline' 0 C--N 1.325 -0.7 0 C-N-CA 121.445 1.43 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 94' ' ' VAL . . . . . 0.416 ' H ' HG23 ' R' ' 94' ' ' VAL . 4.7 t -62.14 -12.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.992 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -91.45 4.62 52.06 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.514 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -90.24 -49.86 6.31 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.1 -38.8 3.84 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.798 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -58.7 -41.18 85.68 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.516 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.668 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.3 t90 -84.85 -63.16 1.38 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.281 -0.967 . . . . 0.0 112.323 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.6 mm? -41.06 -38.2 0.98 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 118.952 -1.099 . . . . 0.0 113.96 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.474 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.6 mm-40 -44.99 -29.65 0.87 Allowed 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 117.851 -1.54 . . . . 0.0 107.856 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 102' ' ' GLU . . . . . 0.465 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.6 mt-10 -94.58 -30.94 14.11 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 113.304 -1.771 . . . . 0.0 111.818 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.668 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.6 t -89.67 -6.64 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 117.466 -1.694 . . . . 0.0 110.503 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 13.7 tp -104.02 -49.35 3.64 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.25 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.67 -68.5 0.64 Allowed 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.755 -0.778 . . . . 0.0 112.255 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 45.1 tttp . . . . . 0 N--CA 1.492 1.643 0 C-N-CA 119.955 -0.698 . . . . 0.0 111.821 -179.875 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' S' S ' 15' ' ' ARG . . . . . 0.492 ' C ' ' H ' ' S' ' 17' ' ' GLN . 6.1 mtp180 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 120.492 0.187 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 16' ' ' HIS . . . . . 0.548 ' CG ' ' O ' ' S' ' 16' ' ' HIS . 43.6 t-80 -69.15 13.55 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.451 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.492 ' H ' ' C ' ' S' ' 15' ' ' ARG . 1.5 tp60 -91.26 -97.19 0.12 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.416 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.403 ' C ' ' O ' ' S' ' 17' ' ' GLN . 0.6 OUTLIER -44.36 -27.99 0.49 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.537 1.161 . . . . 0.0 108.638 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 19' ' ' TRP . . . . . 0.451 ' N ' ' C ' ' S' ' 17' ' ' GLN . 11.2 t-105 -48.87 -63.92 0.95 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.782 -1.554 . . . . 0.0 108.444 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -44.51 -39.07 4.56 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.266 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.525 ' O ' ' N ' ' S' ' 24' ' ' ASP . 5.8 mmp_? -51.63 -71.12 0.07 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.181 -1.408 . . . . 0.0 109.344 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.522 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -28.92 -44.7 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.797 -0.761 . . . . 0.0 111.202 179.656 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.424 ' N ' ' O ' ' S' ' 21' ' ' ARG . 99.1 t -70.32 -48.78 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.709 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.525 ' N ' ' O ' ' S' ' 21' ' ' ARG . 63.5 t0 -42.94 -72.83 0.05 Allowed 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.636 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.415 ' HG ' ' H ' ' S' ' 25' ' ' LEU . 0.2 OUTLIER -43.26 -45.97 6.03 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.711 -0.796 . . . . 0.0 109.952 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -40.82 -59.71 1.35 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.941 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 27' ' ' LYS . . . . . 0.508 ' NZ ' ' CE1' ' R' ' 30' ' ' TYR . 0.1 OUTLIER -50.36 -70.35 0.09 Allowed 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.682 -0.807 . . . . 0.0 112.461 -179.84 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -49.16 -24.72 1.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.73 -56.03 3.46 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 118.898 -1.121 . . . . 0.0 112.262 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -47.86 -33.41 7.42 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 119.657 -0.817 . . . . 0.0 111.157 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.37 -28.9 21.37 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 118.881 -1.128 . . . . 0.0 110.229 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.492 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 7.4 m120 -111.45 -65.44 1.17 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.492 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.0 OUTLIER 164.24 -11.54 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.751 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 34' ' ' LEU . . . . . 0.514 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 3.7 mm? -59.11 -16.7 20.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.177 -0.609 . . . . 0.0 111.821 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 35' ' ' HIS . . . . . 0.444 ' ND1' ' O ' ' S' ' 33' ' ' ASP . 11.4 p-80 -48.43 -18.15 0.21 Allowed 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 119.356 -0.938 . . . . 0.0 112.134 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.714 HD21 ' NE2' ' R' ' 16' ' ' HIS . 6.2 mt -80.92 -65.63 0.26 Allowed Pre-proline 0 C--N 1.308 -1.219 0 C-N-CA 117.995 -1.482 . . . . 0.0 110.931 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.2 Cg_exo -50.31 -28.79 21.51 Favored 'Trans proline' 0 C--N 1.319 -0.987 0 C-N-CA 120.624 0.882 . . . . 0.0 110.975 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.36 -41.54 39.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.326 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.493 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.3 OUTLIER -52.29 -43.34 64.42 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.376 -0.93 . . . . 0.0 109.756 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -71.39 13.12 0.26 Allowed 'General case' 0 C--N 1.297 -1.684 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.83 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 41' ' ' LEU . . . . . 0.493 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.1 tp -113.71 -54.38 2.61 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 120.044 -0.662 . . . . 0.0 112.344 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.22 7.12 17.16 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 118.665 -1.214 . . . . 0.0 112.725 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 2.1 pp -177.03 153.35 0.98 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.305 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.577 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.7 OUTLIER -179.05 -42.38 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.175 0 C-N-CA 117.783 -1.567 . . . . 0.0 114.762 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.577 ' HD2' ' H ' ' S' ' 44' ' ' THR . 14.4 Cg_endo -77.15 -105.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 121.037 1.158 . . . . 0.0 112.88 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 46' ' ' ASP . . . . . 0.4 ' OD1' ' O ' ' S' ' 46' ' ' ASP . 34.8 t0 -55.25 -6.18 0.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.693 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 47' ' ' GLU . . . . . 0.502 ' H ' ' C ' ' S' ' 45' ' ' PRO . 8.4 mm-40 -82.92 -59.45 2.49 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 119.723 -0.791 . . . . 0.0 109.972 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 48' ' ' ARG . . . . . 0.621 ' NH1' ' CE3' ' R' ' 19' ' ' TRP . 19.4 tpt180 -54.83 -24.88 24.97 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.918 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 49' ' ' GLU . . . . . 0.422 ' O ' ' OG1' ' S' ' 53' ' ' THR . 31.8 mt-10 -82.24 -71.13 0.5 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.745 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.53 -51.13 68.07 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.048 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.26 -61.84 0.84 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.899 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.38 -40.99 78.83 Favored Glycine 0 N--CA 1.489 2.177 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.596 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.551 ' O ' HG22 ' S' ' 57' ' ' ILE . 0.2 OUTLIER -48.9 -77.27 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.221 179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.78 ' HE ' ' N ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -44.15 -29.49 0.63 Allowed 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.805 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 96.8 t -81.52 -28.57 10.32 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.527 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.65 -36.03 33.07 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.843 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 0.784 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -74.6 -38.94 46.55 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 58' ' ' VAL . . . . . 0.784 ' N ' HD13 ' S' ' 57' ' ' ILE . 3.1 t -55.81 -68.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 118.635 -1.226 . . . . 0.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 59' ' ' GLU . . . . . 0.553 ' N ' HG12 ' S' ' 58' ' ' VAL . 11.8 tt0 -48.11 -33.24 7.92 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.886 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -67.78 -48.41 66.4 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.078 -1.049 . . . . 0.0 112.18 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 61' ' ' LEU . . . . . 0.755 HD12 ' O ' ' S' ' 61' ' ' LEU . 0.5 OUTLIER -61.58 -18.92 61.39 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 118.131 -1.428 . . . . 0.0 108.698 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 62' ' ' LEU . . . . . 0.435 ' O ' ' C ' ' S' ' 63' ' ' ARG . 1.7 tp -77.92 26.06 0.2 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.858 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 63' ' ' ARG . . . . . 0.504 ' H ' ' C ' ' S' ' 61' ' ' LEU . 61.5 mtt180 . . . . . 0 N--CA 1.501 2.095 0 O-C-N 124.398 1.061 . . . . 0.0 113.832 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 tttm . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.85 0.357 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -84.59 -101.71 0.05 Allowed 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.782 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -141.12 -26.25 0.72 Allowed 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.834 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 tp -126.68 7.85 6.88 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.027 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -54.39 -71.11 0.76 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 119.577 -1.296 . . . . 0.0 110.897 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.74 -86.14 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.305 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.69 128.02 1.65 Allowed Glycine 0 N--CA 1.49 2.288 0 C-N-CA 118.913 -1.613 . . . . 0.0 111.367 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.84 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -38.71 -41.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.307 0 CA-C-N 115.393 -0.403 . . . . 0.0 111.099 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.447 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.62 -42.72 86.36 Favored 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 118.807 -1.157 . . . . 0.0 110.835 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 19.1 m -53.17 -49.58 66.36 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 24.8 pt -72.8 11.13 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.447 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -105.96 -63.55 1.24 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.881 -1.128 . . . . 0.0 111.965 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 84' ' ' ARG . . . . . 0.448 ' H ' ' HD2' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -58.29 -21.57 49.38 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 118.459 -1.297 . . . . 0.0 110.876 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.39 -29.96 72.93 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.345 -1.407 . . . . 0.0 110.714 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -27.32 13.48 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.266 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -101.79 10.29 40.07 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.578 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 88' ' ' SER . . . . . 0.423 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.3 OUTLIER -46.48 -21.99 0.23 Allowed 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.265 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 89' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' S' ' 88' ' ' SER . 75.8 mt -37.69 -72.05 0.07 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 90' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' S' ' 92' ' ' ALA . 0.0 OUTLIER -58.93 -55.68 32.0 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.803 -1.159 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.84 -24.17 0.02 OUTLIER 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.87 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 92' ' ' ALA . . . . . 0.518 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -120.37 162.34 34.52 Favored Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.618 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 93' ' ' PRO . . . . . 0.518 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 1.2 Cg_endo -61.6 -178.33 0.28 Allowed 'Trans proline' 0 C--N 1.319 -0.98 0 C-N-CA 121.236 1.291 . . . . 0.0 111.394 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 24.5 t -100.5 -16.48 7.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.116 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -70.41 -6.07 33.0 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.588 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.3 -24.91 62.23 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.993 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 13.7 mtt85 -78.22 -14.39 59.47 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.58 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -104.77 -10.48 17.39 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.979 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.794 ' CH2' HG21 ' S' ' 103' ' ' VAL . 22.7 t90 -107.02 -58.14 1.98 Allowed 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 122.201 1.0 . . . . 0.0 112.459 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.575 HD21 HD13 ' S' ' 104' ' ' LEU . 0.6 OUTLIER -53.64 -37.56 63.22 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -179.585 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.53 ' C ' ' O ' ' S' ' 100' ' ' LEU . 8.1 mt-10 -43.81 -32.14 0.99 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 116.939 -1.904 . . . . 0.0 106.215 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 102' ' ' GLU . . . . . 0.534 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 tt0 -83.79 -27.48 28.79 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 112.683 -2.053 . . . . 0.0 112.054 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.794 HG21 ' CH2' ' S' ' 99' ' ' TRP . 45.0 t -85.74 -32.12 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 C-N-CA 116.01 -2.276 . . . . 0.0 111.304 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 104' ' ' LEU . . . . . 0.575 HD13 HD21 ' S' ' 100' ' ' LEU . 2.1 mp -97.14 -55.83 2.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.417 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 15.5 mt -75.79 -81.27 0.08 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 118.703 -1.199 . . . . 0.0 113.416 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' S' S ' 106' ' ' LYS . . . . . 0.42 ' O ' ' O ' ' S' ' 102' ' ' GLU . 7.2 tttm -86.61 108.25 18.52 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 119.024 -1.07 . . . . 0.0 112.124 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 116.328 -1.796 . . . . 0.0 110.832 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.273 0.559 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -163.58 -13.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.459 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.424 ' C ' ' N ' ' R' ' 19' ' ' TRP . 4.6 tt0 -88.78 -79.25 0.32 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.626 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 18' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.2 mp0 -41.9 -34.57 0.69 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 123.339 1.542 . . . . 0.0 108.3 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CZ3' ' CD ' ' S' ' 48' ' ' ARG . 21.9 t-105 -57.19 -55.66 31.86 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 112.381 -2.19 . . . . 0.0 110.038 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 20' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' R' ' 17' ' ' GLN . 6.6 tp -56.55 -27.62 58.12 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.788 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' R' ' 24' ' ' ASP . 0.0 OUTLIER -65.33 -62.71 1.37 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.558 -1.257 . . . . 0.0 109.578 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.499 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.2 OUTLIER -33.85 -43.93 0.15 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.305 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 19.7 t -73.27 -35.57 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 119.549 -0.861 . . . . 0.0 110.2 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.592 ' N ' ' O ' ' R' ' 21' ' ' ARG . 34.7 t0 -59.56 -69.79 0.19 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.645 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.24 -41.29 5.75 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.246 -0.981 . . . . 0.0 109.689 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mt -48.86 -62.39 1.55 Allowed 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.225 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -59.94 -38.21 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.528 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -61.52 -35.33 77.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.502 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.605 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -94.31 -39.73 10.34 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.355 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -47.74 -29.48 3.13 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.474 -0.89 . . . . 0.0 112.035 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -52.32 -30.92 30.67 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.375 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -109.11 -79.68 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.234 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 p30 173.51 31.07 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.097 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 34' ' ' LEU . . . . . 0.605 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 1.3 mm? -94.64 -21.95 18.47 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.862 0.839 . . . . 0.0 110.202 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 35' ' ' HIS . . . . . 0.475 ' O ' HD22 ' R' ' 39' ' ' LEU . 13.8 p-80 -49.61 -23.49 1.71 Allowed 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 114.296 -1.32 . . . . 0.0 113.962 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.3 mt -74.08 -66.02 0.54 Allowed Pre-proline 0 N--CA 1.487 1.412 0 C-N-CA 118.164 -1.414 . . . . 0.0 111.316 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 1.4 Cg_endo -52.74 -29.54 42.62 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 120.619 0.879 . . . . 0.0 110.301 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 38' ' ' LEU . . . . . 0.446 HD11 HD21 ' S' ' 96' ' ' LEU . 9.0 mp -82.04 -29.27 32.02 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.845 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.475 HD22 ' O ' ' R' ' 35' ' ' HIS . 0.0 OUTLIER -59.34 -30.66 68.53 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.78 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 40' ' ' ASN . . . . . 0.453 ' CG ' HH12 ' R' ' 48' ' ' ARG . 0.8 OUTLIER -77.06 11.46 1.8 Allowed 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 118.716 -1.194 . . . . 0.0 109.199 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 41' ' ' LEU . . . . . 0.458 ' H ' ' C ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -111.28 -69.0 0.89 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.335 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 42' ' ' MET . . . . . 0.413 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -90.35 41.47 1.05 Allowed 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 118.437 -1.305 . . . . 0.0 108.878 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 43' ' ' LEU . . . . . 0.421 ' O ' ' O ' ' R' ' 39' ' ' LEU . 4.5 tt 173.89 135.02 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.511 -1.662 . . . . 0.0 106.511 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.5 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -171.25 -38.31 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.892 0 C-N-CA 114.799 -2.76 . . . . 0.0 117.47 -179.437 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.5 ' CD ' ' H ' ' R' ' 44' ' ' THR . 71.7 Cg_endo -98.69 -105.31 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 121.564 1.509 . . . . 0.0 114.869 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -45.1 -28.84 0.78 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.058 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.765 ' OE1' HD11 ' S' ' 43' ' ' LEU . 7.7 mm-40 -57.66 -67.18 0.36 Allowed 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 118.348 -1.341 . . . . 0.0 109.409 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 48' ' ' ARG . . . . . 0.453 HH12 ' CG ' ' R' ' 40' ' ' ASN . 1.9 tpp180 -42.92 -24.68 0.07 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.063 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 49' ' ' GLU . . . . . 0.468 ' N ' ' O ' ' R' ' 47' ' ' GLU . 11.9 mt-10 -96.03 -69.41 0.76 Allowed 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.125 -1.03 . . . . 0.0 113.509 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.832 ' HB1' ' HE ' ' R' ' 54' ' ' ARG . . . -58.8 -27.27 64.89 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 51' ' ' LEU . . . . . 1.027 HD23 ' N ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -71.71 -37.92 70.59 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.039 -1.464 . . . . 0.0 112.306 -179.671 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 52' ' ' GLY . . . . . 1.027 ' N ' HD23 ' R' ' 51' ' ' LEU . . . -71.21 -36.25 63.79 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 108.556 -1.817 . . . . 0.0 108.556 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.533 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -64.25 -79.65 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.341 -0.929 . . . . 0.0 109.997 179.922 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.832 ' HE ' ' HB1' ' R' ' 50' ' ' ALA . 17.1 mtt-85 -32.44 -55.59 0.34 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.213 -1.358 . . . . 0.0 112.977 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 2.1 p -62.89 -30.31 49.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 117.439 -1.704 . . . . 0.0 111.486 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.639 ' NH1' ' HE ' ' S' ' 21' ' ' ARG . 11.1 mmt180 -76.69 -45.29 30.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.297 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -65.61 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 C-N-CA 118.044 -1.462 . . . . 0.0 110.292 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 0.717 HG13 ' N ' ' R' ' 59' ' ' GLU . 9.4 p -45.71 -58.12 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 C-N-CA 117.963 -1.495 . . . . 0.0 111.203 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.717 ' N ' HG13 ' R' ' 58' ' ' VAL . 78.6 mt-10 -54.64 -28.19 45.18 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.723 -1.191 . . . . 0.0 112.706 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -79.38 -51.73 9.02 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.937 -1.105 . . . . 0.0 112.98 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 13.3 mt -67.88 -9.82 48.02 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.655 -1.218 . . . . 0.0 111.532 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.304 -1.399 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 77' ' ' ALA . . . . . 0.422 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 121.175 0.512 . . . . 0.0 110.186 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 78' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' R' ' 77' ' ' ALA . . . -34.65 135.33 0.35 Allowed Glycine 0 N--CA 1.495 2.584 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.974 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.878 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -35.6 -35.98 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.057 -0.571 . . . . 0.0 111.103 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.504 ' HB1' ' NH2' ' R' ' 84' ' ' ARG . . . -58.17 -65.83 0.58 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.826 -1.149 . . . . 0.0 110.366 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 53.2 m -40.42 -42.25 1.56 Allowed 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 82' ' ' ILE . . . . . 0.45 HD13 HG21 ' R' ' 82' ' ' ILE . 2.0 pt -85.71 -6.69 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -78.81 -43.18 25.92 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 118.209 -1.397 . . . . 0.0 111.807 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 84' ' ' ARG . . . . . 0.504 ' NH2' ' HB1' ' R' ' 80' ' ' ALA . 1.8 ptp180 -67.22 -23.53 65.74 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.653 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.44 3.75 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.229 -1.462 . . . . 0.0 110.194 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 68.0 m -89.4 -32.33 17.32 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.576 -0.85 . . . . 0.0 111.278 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 87' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' R' ' 89' ' ' LEU . 5.2 m-20 -86.27 10.66 14.1 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.291 -0.963 . . . . 0.0 110.88 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -40.68 -21.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.698 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 89' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' R' ' 87' ' ' ASN . 72.1 mt -58.19 -67.23 0.37 Allowed 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.94 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 90' ' ' LYS . . . . . 0.406 ' HG3' ' H ' ' R' ' 90' ' ' LYS . 0.0 OUTLIER -91.8 -27.09 18.21 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.136 -1.026 . . . . 0.0 113.466 -179.812 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -50.84 72.08 Favored 'General case' 0 C--N 1.284 -2.271 0 C-N-CA 118.72 -1.192 . . . . 0.0 112.827 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.57 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -91.66 162.46 31.3 Favored Pre-proline 0 N--CA 1.489 1.521 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 93' ' ' PRO . . . . . 0.57 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.8 Cg_exo -51.53 142.13 40.19 Favored 'Trans proline' 0 C--N 1.323 -0.781 0 C-N-CA 121.628 1.552 . . . . 0.0 112.038 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 23.6 t -92.61 -15.63 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.541 -0.864 . . . . 0.0 111.122 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -70.9 -3.8 21.1 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.04 -1.064 . . . . 0.0 110.284 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 96' ' ' LEU . . . . . 0.57 HD11 HD22 ' S' ' 38' ' ' LEU . 1.6 tp -67.6 -44.11 78.9 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.043 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.81 -19.15 0.89 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.382 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -70.59 -34.25 71.97 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.037 -1.065 . . . . 0.0 110.704 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.65 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 15.7 t90 -100.38 -57.46 2.11 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.524 HD13 ' HB ' ' R' ' 103' ' ' VAL . 2.0 mm? -41.54 -34.97 0.63 Allowed 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.556 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' R' ' 100' ' ' LEU . 0.5 OUTLIER -44.48 -31.0 0.96 Allowed 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 117.851 -1.54 . . . . 0.0 108.449 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' C ' ' R' ' 100' ' ' LEU . 1.8 mt-10 -95.53 -29.5 14.33 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 114.081 -1.418 . . . . 0.0 111.803 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.65 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 4.2 t -81.16 -20.92 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 116.792 -1.963 . . . . 0.0 110.678 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.45 -55.35 3.44 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.158 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tp -50.78 -41.91 57.44 Favored 'General case' 0 C--N 1.308 -1.197 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.291 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 tttt . . . . . 0 N--CA 1.494 1.755 0 C-N-CA 119.688 -0.805 . . . . 0.0 111.297 -179.992 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 120.897 0.38 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -129.26 -11.79 4.59 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.321 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.525 ' N ' ' OE1' ' S' ' 17' ' ' GLN . 4.7 mp0 -89.83 -76.94 0.41 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.627 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.5 mt-10 -42.13 -30.99 0.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 122.721 1.248 . . . . 0.0 108.328 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 19' ' ' TRP . . . . . 0.472 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.254 56.0 t-105 -49.76 -56.04 11.75 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.809 179.76 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 5.3 tp -52.43 -40.21 61.93 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 113.841 -1.527 . . . . 0.0 112.045 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.639 ' HE ' ' NH1' ' R' ' 56' ' ' ARG . 4.3 mtt-85 -59.21 -72.64 0.1 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.14 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.552 ' CD2' HD12 ' R' ' 51' ' ' LEU . 0.0 OUTLIER -32.1 -44.47 0.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.17 179.62 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.464 ' O ' ' N ' ' S' ' 26' ' ' LEU . 71.0 t -63.28 -61.9 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.481 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.414 ' C ' ' O ' ' S' ' 23' ' ' VAL . 41.9 t0 -32.55 -55.37 0.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.137 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.479 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.7 OUTLIER -60.78 -42.23 97.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.802 -1.159 . . . . 0.0 110.351 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.464 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -54.2 -56.38 18.86 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 119.668 -0.813 . . . . 0.0 112.06 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -58.46 -56.86 16.7 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.9 -49.87 75.72 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.269 -0.973 . . . . 0.0 112.385 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 29' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -52.99 -37.93 61.81 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 118.714 -1.194 . . . . 0.0 111.383 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -52.1 -43.42 63.92 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 118.456 -1.297 . . . . 0.0 109.807 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -37.72 74.63 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -89.68 -12.13 40.41 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.366 179.882 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' S' ' 29' ' ' ALA . 3.1 t70 78.57 3.91 2.59 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.3 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.95 -0.06 33.55 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.714 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 35' ' ' HIS . . . . . 0.464 ' N ' ' ND1' ' S' ' 35' ' ' HIS . 0.8 OUTLIER -56.91 -15.77 5.52 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.666 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.454 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 9.0 mt -76.68 -63.88 0.52 Allowed Pre-proline 0 C--N 1.304 -1.373 0 C-N-CA 118.37 -1.332 . . . . 0.0 110.299 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.7 Cg_endo -52.32 -37.71 71.71 Favored 'Trans proline' 0 C--N 1.319 -0.991 0 N-CA-C 109.716 -0.917 . . . . 0.0 109.716 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 38' ' ' LEU . . . . . 0.57 HD22 HD11 ' R' ' 96' ' ' LEU . 3.8 mm? -66.65 -41.76 87.71 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.405 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.514 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -59.08 -14.37 9.7 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 40' ' ' ASN . . . . . 0.411 ' HA ' ' HG1' ' S' ' 44' ' ' THR . 0.6 OUTLIER -91.21 -11.51 38.07 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 114.886 -1.052 . . . . 0.0 112.423 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -101.61 -65.82 0.96 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 119.563 -0.855 . . . . 0.0 112.668 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.16 37.54 0.73 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.38 -1.328 . . . . 0.0 110.29 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 43' ' ' LEU . . . . . 0.765 HD11 ' OE1' ' R' ' 47' ' ' GLU . 1.9 tp 172.5 132.51 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 CA-C-N 114.614 -1.175 . . . . 0.0 107.995 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.437 ' CB ' ' O ' ' S' ' 43' ' ' LEU . 0.7 OUTLIER -176.47 -48.13 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.335 0 C-N-CA 114.927 -2.709 . . . . 0.0 117.569 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.2 -101.81 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.223 0 N-CA-C 115.284 1.225 . . . . 0.0 115.284 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -52.79 -23.36 6.73 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.837 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 47' ' ' GLU . . . . . 0.554 ' N ' ' CD ' ' S' ' 47' ' ' GLU . 0.0 OUTLIER -62.78 -55.23 28.34 Favored 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.815 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 48' ' ' ARG . . . . . 0.441 ' CD ' ' CZ3' ' R' ' 19' ' ' TRP . 14.7 mmm-85 -52.47 -39.78 61.55 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.505 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -71.75 0.23 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.422 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.31 -25.53 1.61 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.557 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.14 -63.95 1.05 Allowed 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 119.383 -0.927 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.26 -40.91 11.04 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.632 -1.747 . . . . 0.0 109.153 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.444 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -54.38 -82.2 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.831 -0.748 . . . . 0.0 112.943 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 54' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -43.46 -40.79 3.99 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.668 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.61 -34.07 67.34 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.267 0 C-N-CA 117.73 -1.588 . . . . 0.0 110.588 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.6 OUTLIER -82.98 -36.03 25.41 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 118.023 -1.471 . . . . 0.0 112.578 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 0.702 ' C ' HD12 ' S' ' 57' ' ' ILE . 0.3 OUTLIER -64.67 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 115.861 -2.336 . . . . 0.0 106.597 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 38.5 t -62.63 -67.76 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 118.512 -1.275 . . . . 0.0 109.218 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 59' ' ' GLU . . . . . 0.452 ' O ' ' OE1' ' S' ' 59' ' ' GLU . 0.0 OUTLIER -45.34 -41.89 9.39 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.287 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 60' ' ' GLU . . . . . 0.425 ' O ' ' N ' ' S' ' 63' ' ' ARG . 16.6 mm-40 -58.75 -45.52 89.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.931 -1.108 . . . . 0.0 111.074 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 16.2 mt -51.31 -47.63 62.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 118.273 -1.371 . . . . 0.0 108.83 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.52 -23.56 58.46 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.653 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 63' ' ' ARG . . . . . 0.425 ' N ' ' O ' ' S' ' 60' ' ' GLU . 4.3 tpt180 . . . . . 0 N--CA 1.486 1.329 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.941 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 73' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' S' ' 75' ' ' LEU . 29.2 t30 -93.97 18.29 10.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 122.231 1.015 . . . . 0.0 108.866 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 43.04 8.47 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 112.382 -2.19 . . . . 0.0 113.449 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 75' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' S' ' 73' ' ' ASN . 8.8 mt -128.99 -46.29 1.25 Allowed 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.284 -0.967 . . . . 0.0 111.465 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -66.62 -31.41 78.49 Favored Glycine 0 N--CA 1.492 2.43 0 C-N-CA 119.7 -1.238 . . . . 0.0 112.451 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 77' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' S' ' 78' ' ' GLY . . . -176.74 99.75 0.05 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 118.64 -1.224 . . . . 0.0 111.033 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 78' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -36.35 142.05 0.18 Allowed Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.427 -0.892 . . . . 0.0 111.791 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.76 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -36.75 -30.77 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -45.98 -66.9 0.33 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.74 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 1.5 m -40.11 -69.53 0.13 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 82' ' ' ILE . . . . . 0.578 ' HA ' HD13 ' S' ' 57' ' ' ILE . 19.4 pt -52.62 -14.23 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -179.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.537 ' O ' ' N ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -94.28 -60.39 1.74 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.367 -1.333 . . . . 0.0 112.792 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -50.16 -5.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.014 -1.074 . . . . 0.0 111.55 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 85' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' S' ' 83' ' ' THR . . . -48.6 -58.05 7.83 Favored Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.584 -1.293 . . . . 0.0 110.845 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 86' ' ' SER . . . . . 0.424 ' O ' ' OG ' ' S' ' 86' ' ' SER . 17.3 p -174.25 46.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.063 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -98.56 -27.17 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.267 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 88' ' ' SER . . . . . 0.463 ' C ' ' H ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -129.79 -38.35 1.49 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.877 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.0 -2.42 1.22 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.306 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 90' ' ' LYS . . . . . 0.463 ' H ' ' C ' ' S' ' 88' ' ' SER . 0.8 OUTLIER -68.89 -40.68 79.05 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.017 -0.992 . . . . 0.0 113.026 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.69 -22.66 24.53 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 92' ' ' ALA . . . . . 0.755 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . -52.02 -56.39 22.16 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 117.836 -1.546 . . . . 0.0 112.084 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 93' ' ' PRO . . . . . 0.755 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 31.4 Cg_endo -83.05 126.41 4.37 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 120.802 1.001 . . . . 0.0 110.03 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 94' ' ' VAL . . . . . 0.534 ' C ' ' H ' ' S' ' 96' ' ' LEU . 15.4 t -86.44 -37.3 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 118.594 -1.242 . . . . 0.0 111.829 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -3.14 0.27 Allowed 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.901 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 96' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' S' ' 94' ' ' VAL . 0.2 OUTLIER -85.83 -29.84 23.44 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.486 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -8.43 25.25 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -103.79 -6.12 21.76 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.336 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -113.22 -64.43 1.31 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 1.048 HD22 ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -9.2 -84.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 120.865 3.654 . . . . 0.0 120.865 -179.581 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 1.048 ' H ' HD22 ' S' ' 100' ' ' LEU . 3.5 mm-40 -92.71 -37.52 12.33 Favored 'General case' 0 C--N 1.278 -2.507 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.462 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 102' ' ' GLU . . . . . 0.419 ' C ' ' O ' ' S' ' 101' ' ' GLU . 2.0 tt0 -53.57 -19.06 3.39 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.591 ' N ' ' C ' ' S' ' 101' ' ' GLU . 95.2 t -108.15 -67.13 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.161 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 9.7 mt -43.93 -55.52 4.54 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 117.936 -1.506 . . . . 0.0 111.331 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 105' ' ' LEU . . . . . 0.408 ' HA ' HD12 ' S' ' 105' ' ' LEU . 12.9 tp -56.85 -71.05 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.836 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 mmtt -48.45 -38.12 19.0 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.97 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 116.398 -1.763 . . . . 0.0 110.851 179.929 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 60.0 mtt85 . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.954 0.407 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -147.25 -6.04 0.49 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.572 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' R' ' 20' ' ' LEU . 1.5 mt-30 -97.61 -79.59 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.648 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 18' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' R' ' 18' ' ' GLU . 1.9 mp0 -47.21 -28.69 1.98 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 19' ' ' TRP . . . . . 0.48 ' N ' ' C ' ' R' ' 17' ' ' GLN . 10.9 t-105 -62.56 -53.23 57.78 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.308 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 20' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' R' ' 17' ' ' GLN . 0.8 OUTLIER -56.77 -38.06 71.94 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.249 179.708 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.518 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mtt180 -52.59 -70.07 0.1 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 118.352 -1.339 . . . . 0.0 108.625 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.518 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -28.55 -47.65 0.05 Allowed 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.552 0.532 . . . . 0.0 110.698 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 22.6 t -68.94 -49.18 65.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.675 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' R' ' 21' ' ' ARG . 21.6 t70 -46.45 -76.45 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.83 -0.748 . . . . 0.0 110.94 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.618 HD12 ' SD ' ' R' ' 42' ' ' MET . 0.4 OUTLIER -41.49 -41.53 2.11 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.828 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.35 -59.25 4.17 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.052 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -71.5 -38.21 71.17 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.693 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -15.22 23.01 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.997 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.73 -43.35 5.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.463 -0.895 . . . . 0.0 112.013 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -43.35 -27.76 0.28 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.207 -0.997 . . . . 0.0 110.906 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -51.54 -42.96 62.16 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.524 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 32' ' ' ASN . . . . . 0.41 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 9.7 m-80 -102.18 -72.14 0.7 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.494 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 33' ' ' ASP . . . . . 0.718 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.5 OUTLIER 169.77 18.12 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.39 -0.924 . . . . 0.0 112.425 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 34' ' ' LEU . . . . . 1.023 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.1 OUTLIER -92.29 -7.97 46.48 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.126 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -51.72 -13.21 0.24 Allowed 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 119.385 -0.926 . . . . 0.0 111.981 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.5 mt -81.41 -65.55 0.25 Allowed Pre-proline 0 N--CA 1.482 1.131 0 C-N-CA 118.141 -1.424 . . . . 0.0 110.1 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -49.51 -27.62 14.62 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 N-CA-C 109.968 -0.82 . . . . 0.0 109.968 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 38' ' ' LEU . . . . . 0.538 HD21 ' CZ3' ' S' ' 99' ' ' TRP . 8.0 mp -76.41 -41.87 46.21 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.796 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' R' ' 39' ' ' LEU . 1.3 tp -50.17 -47.68 54.33 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.464 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -70.78 3.13 3.44 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.056 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 mt -110.76 -62.08 1.59 Allowed 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.764 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 42' ' ' MET . . . . . 0.618 ' SD ' HD12 ' R' ' 25' ' ' LEU . 0.1 OUTLIER -82.57 29.79 0.43 Allowed 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.08 -179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 43' ' ' LEU . . . . . 0.465 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.8 OUTLIER 163.39 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.537 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.638 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.6 OUTLIER -176.82 -41.22 0.0 OUTLIER Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 117.937 -1.505 . . . . 0.0 114.026 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.638 ' HD2' ' H ' ' R' ' 44' ' ' THR . 14.6 Cg_endo -78.85 -102.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.826 1.017 . . . . 0.0 112.337 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.05 -14.21 2.46 Favored 'General case' 0 C--N 1.308 -1.224 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.172 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.624 ' O ' HD13 ' R' ' 51' ' ' LEU . 0.7 OUTLIER -77.64 -55.65 5.17 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.127 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -49.06 -37.83 22.32 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.253 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 49' ' ' GLU . . . . . 0.401 ' O ' ' OG1' ' R' ' 53' ' ' THR . 6.5 mt-10 -65.52 -67.74 0.42 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.614 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.45 -34.06 15.79 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.036 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 51' ' ' LEU . . . . . 0.624 HD13 ' O ' ' R' ' 47' ' ' GLU . 4.2 mp -53.71 -77.65 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.46 -0.896 . . . . 0.0 111.54 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.16 -51.25 11.66 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.784 -1.198 . . . . 0.0 111.548 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' R' ' 50' ' ' ALA . 0.1 OUTLIER -42.08 -81.23 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 121.754 0.788 . . . . 0.0 111.458 -179.955 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.449 ' CD ' ' C ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -34.36 -52.1 0.47 Allowed 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.036 -1.438 . . . . 0.0 112.823 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.7 t -60.62 -32.91 52.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 C-N-CA 119.191 -1.004 . . . . 0.0 112.519 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.35 -33.09 32.64 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.899 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 0.743 ' O ' HD12 ' R' ' 57' ' ' ILE . 0.0 OUTLIER -78.06 -47.59 24.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 C-N-CA 118.67 -1.212 . . . . 0.0 107.763 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 58' ' ' VAL . . . . . . . . . . . . . 42.9 t -53.77 -63.26 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 119.077 -1.049 . . . . 0.0 110.325 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.13 -38.31 57.09 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 119.581 -0.847 . . . . 0.0 111.875 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -63.24 -30.57 71.68 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.481 -0.887 . . . . 0.0 112.979 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 61' ' ' LEU . . . . . 0.65 HD12 ' C ' ' R' ' 61' ' ' LEU . 0.4 OUTLIER -85.14 -27.55 26.14 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.413 -1.315 . . . . 0.0 111.451 -179.841 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.407 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.184 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 77' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . . . . . . 0 N--CA 1.484 1.272 0 CA-C-O 120.861 0.362 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 78' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . -34.71 129.33 0.59 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.439 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.913 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -35.91 -29.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-N 115.391 -0.404 . . . . 0.0 111.289 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -52.83 -1.17 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.328 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 81' ' ' THR . . . . . 0.52 ' H ' ' C ' ' R' ' 79' ' ' ILE . 2.2 t -101.11 -36.68 8.88 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.665 -0.814 . . . . 0.0 112.583 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 82' ' ' ILE . . . . . 0.424 HD13 HG21 ' R' ' 82' ' ' ILE . 12.7 pt -79.99 3.77 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.711 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.527 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.2 OUTLIER -77.25 -51.5 10.8 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.051 -1.06 . . . . 0.0 110.148 179.865 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 84' ' ' ARG . . . . . 0.401 ' N ' ' OG1' ' R' ' 83' ' ' THR . 3.6 ptm180 -81.33 -12.09 59.13 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.477 -0.889 . . . . 0.0 110.685 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.28 -42.66 4.23 Favored Glycine 0 N--CA 1.488 2.158 0 C-N-CA 119.46 -1.352 . . . . 0.0 110.161 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 10.1 t -54.59 -50.81 67.15 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.468 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 87' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.1 OUTLIER -93.18 -78.72 0.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.42 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 88' ' ' SER . . . . . 0.479 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.2 OUTLIER 73.57 -40.57 0.47 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.409 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' R' R ' 89' ' ' LEU . . . . . 0.462 ' H ' ' C ' ' R' ' 87' ' ' ASN . 8.4 mt -49.64 -21.23 0.96 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.141 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 90' ' ' LYS . . . . . 0.404 ' N ' ' C ' ' R' ' 88' ' ' SER . 4.5 mmtp -45.09 -62.56 1.19 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.894 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.36 -26.99 65.86 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.037 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' R' ' 89' ' ' LEU . . . 41.57 65.54 4.55 Favored Pre-proline 0 C--N 1.302 -1.459 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.324 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 93' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' R' ' 95' ' ' GLU . 11.9 Cg_endo -78.67 100.24 1.34 Allowed 'Trans proline' 0 C--N 1.314 -1.259 0 C-N-CA 121.591 1.528 . . . . 0.0 110.33 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 94' ' ' VAL . . . . . 0.423 ' H ' HG23 ' R' ' 94' ' ' VAL . 2.9 t -67.17 10.69 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.63 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 95' ' ' GLU . . . . . 0.484 ' H ' ' C ' ' R' ' 93' ' ' PRO . 6.6 mt-10 -89.08 -37.64 14.95 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.749 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.12 -56.11 11.37 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.563 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -50.06 -18.0 0.49 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.425 -0.91 . . . . 0.0 111.086 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -93.12 -26.61 17.37 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.574 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.68 ' CE3' HG21 ' R' ' 103' ' ' VAL . 4.9 t90 -110.62 -62.43 1.53 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.643 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.472 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.98 -30.3 0.26 Allowed 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.46 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' R' ' 100' ' ' LEU . 18.9 pt-20 -47.08 -36.65 8.43 Favored 'General case' 0 C--N 1.293 -1.861 0 C-N-CA 117.468 -1.693 . . . . 0.0 106.978 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 102' ' ' GLU . . . . . 0.472 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 4.5 mt-10 -92.04 -28.7 17.01 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.385 -1.734 . . . . 0.0 112.533 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.68 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.2 t -89.74 -7.21 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 C-N-CA 117.423 -1.711 . . . . 0.0 110.417 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 104' ' ' LEU . . . . . 0.43 ' HA ' HD12 ' R' ' 104' ' ' LEU . 21.1 tp -99.19 -53.18 3.31 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.907 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 105' ' ' LEU . . . . . 0.47 HD22 ' N ' ' R' ' 105' ' ' LEU . 4.0 mm? -71.22 -66.16 0.65 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.874 -1.13 . . . . 0.0 110.207 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 24.6 tttt . . . . . 0 N--CA 1.487 1.392 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.538 179.961 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' S' S ' 15' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 16' ' ' HIS . 14.5 ttm-85 . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 120.856 0.36 . . . . 0.0 111.255 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 16' ' ' HIS . . . . . 0.419 ' C ' ' O ' ' S' ' 15' ' ' ARG . 1.1 t60 33.75 66.57 0.24 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.654 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 17' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -117.56 -85.09 0.64 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.042 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' S' ' 21' ' ' ARG . 47.4 mt-10 -75.13 -21.4 58.87 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 122.852 1.311 . . . . 0.0 107.639 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.281 32.0 t-105 -42.19 -43.94 3.55 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 112.803 -1.999 . . . . 0.0 108.294 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.43 -44.98 92.81 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 112.213 -2.267 . . . . 0.0 109.6 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' S' ' 23' ' ' VAL . 3.1 mmm180 -49.96 -69.11 0.12 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 118.393 -1.323 . . . . 0.0 109.925 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.488 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.48 -36.2 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.82 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.496 ' N ' ' O ' ' S' ' 21' ' ' ARG . 31.3 t -78.99 -64.99 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.852 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.412 ' C ' ' O ' ' S' ' 23' ' ' VAL . 25.2 t0 -34.29 -48.08 0.32 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.665 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.408 ' N ' HD23 ' S' ' 25' ' ' LEU . 3.3 mt -74.69 -49.11 22.48 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.951 -1.1 . . . . 0.0 110.237 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.428 HD12 HD11 ' S' ' 39' ' ' LEU . 4.2 tt -44.83 -28.59 0.66 Allowed 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.248 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -90.11 -68.94 0.75 Allowed 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.913 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -41.38 -29.03 0.13 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.75 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 29' ' ' ALA . . . . . 0.464 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -86.11 -31.98 21.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.675 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -43.73 -44.86 6.84 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 119.085 -1.046 . . . . 0.0 110.566 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -32.48 63.11 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.464 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.426 ' OD1' ' NE1' ' R' ' 99' ' ' TRP . 0.8 OUTLIER -79.05 -10.33 59.8 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.937 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.4 m-20 72.95 9.92 5.39 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.383 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -0.62 57.78 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 118.933 -1.107 . . . . 0.0 109.977 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 35' ' ' HIS . . . . . 0.459 ' O ' HD13 ' S' ' 39' ' ' LEU . 3.8 p-80 -57.23 -23.96 51.48 Favored 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.755 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.463 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.6 mt -70.44 -63.51 1.67 Allowed Pre-proline 0 C--N 1.306 -1.297 0 C-N-CA 118.534 -1.266 . . . . 0.0 110.608 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -51.3 -31.29 36.85 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 120.951 1.101 . . . . 0.0 110.63 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 38' ' ' LEU . . . . . 0.435 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.4 mp -78.44 -36.89 44.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.432 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.459 HD13 ' O ' ' S' ' 35' ' ' HIS . 0.3 OUTLIER -62.25 -20.92 64.74 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.241 179.842 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -2.94 49.68 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.224 -0.991 . . . . 0.0 109.591 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 41' ' ' LEU . . . . . 0.509 ' C ' ' H ' ' S' ' 43' ' ' LEU . 7.4 mp -106.78 -70.94 0.77 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.854 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 42' ' ' MET . . . . . 0.435 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.0 OUTLIER -78.87 43.68 0.51 Allowed 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.832 -1.147 . . . . 0.0 108.843 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 43' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' S' ' 41' ' ' LEU . 0.1 OUTLIER 177.38 124.01 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 105.334 -2.098 . . . . 0.0 105.334 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.581 ' HB ' ' CD ' ' S' ' 45' ' ' PRO 0.316 13.7 m -121.29 -96.15 0.0 OUTLIER Pre-proline 0 CA--C 1.587 2.368 0 CA-C-O 115.731 -2.08 . . . . 0.0 113.485 -179.426 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.581 ' CD ' ' HB ' ' S' ' 44' ' ' THR . 57.3 Cg_endo -107.3 -64.78 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.485 0 CA-C-N 125.235 2.905 . . . . 0.0 111.766 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 46' ' ' ASP . . . . . 0.511 ' H ' ' CG ' ' S' ' 45' ' ' PRO . 0.1 OUTLIER -50.7 -27.66 7.49 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.037 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 47' ' ' GLU . . . . . 0.662 ' O ' HD13 ' S' ' 51' ' ' LEU . 21.0 mp0 -66.79 -45.83 77.21 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.41 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -71.19 -37.32 72.13 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.202 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.12 -68.94 0.22 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.573 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -46.6 -38.62 9.83 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.266 -0.973 . . . . 0.0 110.518 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 51' ' ' LEU . . . . . 0.662 HD13 ' O ' ' S' ' 47' ' ' GLU . 1.7 mp -53.54 -51.56 62.49 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.433 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -46.27 93.82 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 118.842 -1.647 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -44.89 -79.82 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.544 0.688 . . . . 0.0 111.113 179.893 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.678 ' HE ' ' N ' ' S' ' 55' ' ' VAL . 0.1 OUTLIER -44.8 -47.18 10.94 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 115.133 -0.939 . . . . 0.0 112.182 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 55' ' ' VAL . . . . . 0.678 ' N ' ' HE ' ' S' ' 54' ' ' ARG . 54.7 t -56.5 -28.87 27.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 C-N-CA 117.76 -1.576 . . . . 0.0 109.281 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' S' ' 53' ' ' THR . 36.1 mtp85 -84.51 -36.48 22.18 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.805 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 1.018 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -70.57 -32.28 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 C-N-CA 116.032 -2.267 . . . . 0.0 106.695 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 58' ' ' VAL . . . . . 1.018 ' N ' HD13 ' S' ' 57' ' ' ILE . 7.1 t -59.95 -63.36 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 118.982 -1.087 . . . . 0.0 108.521 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 59' ' ' GLU . . . . . 0.471 ' OE2' ' CZ ' ' R' ' 21' ' ' ARG . 23.1 mt-10 -49.07 -29.56 5.26 Favored 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.294 -0.963 . . . . 0.0 110.215 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -34.68 44.36 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.472 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 61' ' ' LEU . . . . . 0.516 ' C ' ' H ' ' S' ' 63' ' ' ARG . 17.3 mt -57.4 -33.31 67.72 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.221 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 49.3 tp -60.95 -7.92 2.8 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 119.289 -0.964 . . . . 0.0 108.468 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 63' ' ' ARG . . . . . 0.516 ' H ' ' C ' ' S' ' 61' ' ' LEU . 4.0 ptt180 . . . . . 0 N--CA 1.507 2.413 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 72' ' ' LYS . . . . . 0.463 ' O ' ' CG ' ' S' ' 72' ' ' LYS . 6.7 ptmm? . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.856 0.36 . . . . 0.0 111.033 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 73' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' S' ' 74' ' ' GLU . 38.0 t-20 -125.62 -99.71 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.896 0.855 . . . . 0.0 110.885 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 74' ' ' GLU . . . . . 0.455 ' N ' ' OD1' ' S' ' 73' ' ' ASN . 0.0 OUTLIER -140.04 -23.35 0.84 Allowed 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.008 -1.451 . . . . 0.0 110.98 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 tp -111.12 -14.51 13.87 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.317 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -53.91 -80.73 0.07 OUTLIER Glycine 0 N--CA 1.49 2.269 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.47 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -178.35 -91.31 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.386 -0.925 . . . . 0.0 111.003 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 78' ' ' GLY . . . . . 0.481 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -167.94 136.11 3.95 Favored Glycine 0 N--CA 1.491 2.316 0 C-N-CA 119.196 -1.478 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.903 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.43 -28.35 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.434 -0.383 . . . . 0.0 111.289 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -67.46 -65.82 0.64 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.701 -0.8 . . . . 0.0 112.588 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 81' ' ' THR . . . . . 0.487 HG22 HG23 ' S' ' 82' ' ' ILE . 0.6 OUTLIER -48.13 -27.56 2.42 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 82' ' ' ILE . . . . . 0.487 HG23 HG22 ' S' ' 81' ' ' THR . 15.7 pt -92.48 -21.61 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 C-N-CA 118.701 -1.199 . . . . 0.0 112.706 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.418 ' O ' ' OD1' ' S' ' 87' ' ' ASN . 0.0 OUTLIER -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.479 -1.288 . . . . 0.0 110.584 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 84' ' ' ARG . . . . . 0.772 ' H ' ' HE ' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -76.34 -28.46 56.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.64 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.66 -4.5 4.15 Favored Glycine 0 N--CA 1.485 1.922 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 86' ' ' SER . . . . . 0.469 ' H ' ' C ' ' S' ' 84' ' ' ARG . 0.4 OUTLIER -138.38 -63.33 0.55 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.759 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 87' ' ' ASN . . . . . 0.521 ' O ' ' N ' ' S' ' 89' ' ' LEU . 32.5 m120 -48.04 -16.66 0.09 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.345 -0.942 . . . . 0.0 110.756 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 88' ' ' SER . . . . . 0.543 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -41.07 -21.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.991 -0.684 . . . . 0.0 111.372 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 89' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' S' ' 87' ' ' ASN . 5.4 mt -39.56 -21.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.713 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 90' ' ' LYS . . . . . 0.543 ' N ' ' O ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -75.36 -61.76 1.79 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.812 -1.155 . . . . 0.0 110.51 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -46.69 -62.1 1.53 Allowed 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.689 -1.142 . . . . 0.0 110.752 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 46.03 68.18 3.63 Favored Pre-proline 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.266 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 93' ' ' PRO . . . . . 0.4 ' HB2' HD12 ' S' ' 96' ' ' LEU . 1.9 Cg_endo -66.01 107.16 1.08 Allowed 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 121.532 1.488 . . . . 0.0 111.267 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 94' ' ' VAL . . . . . 0.4 ' C ' ' N ' ' S' ' 96' ' ' LEU . 57.4 t -77.45 -35.76 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -54.84 -10.22 0.44 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.904 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 96' ' ' LEU . . . . . 0.498 ' HB3' HD23 ' S' ' 100' ' ' LEU . 79.3 mt -103.46 -21.9 13.72 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.205 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.06 -29.04 27.76 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.254 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -94.74 -16.68 22.85 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.674 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 10.6 t90 -91.41 -58.87 2.3 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.827 -0.749 . . . . 0.0 111.143 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.536 HD12 HD13 ' S' ' 104' ' ' LEU . 1.8 mm? -38.41 -34.07 0.12 Allowed 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.467 ' C ' ' O ' ' S' ' 100' ' ' LEU . 31.2 mt-10 -45.43 -38.66 6.26 Favored 'General case' 0 C--N 1.297 -1.713 0 C-N-CA 117.661 -1.616 . . . . 0.0 107.177 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -86.29 -29.43 23.06 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.506 -1.679 . . . . 0.0 112.579 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.674 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 4.0 t -83.31 -18.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 116.787 -1.965 . . . . 0.0 111.862 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 104' ' ' LEU . . . . . 0.536 HD13 HD12 ' S' ' 100' ' ' LEU . 1.4 tp -101.09 -61.67 1.34 Allowed 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.314 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 34.9 mt -57.58 -74.57 0.05 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.111 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 40.5 tttt -42.0 -50.66 4.59 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.904 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 43.6 t . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 116.375 -1.774 . . . . 0.0 110.704 179.968 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 121.125 0.488 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' R' R ' 16' ' ' HIS . . . . . 0.411 ' H ' ' H ' ' R' ' 17' ' ' GLN . 0.4 OUTLIER -159.08 -15.89 0.06 Allowed 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.565 179.973 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.411 ' H ' ' H ' ' R' ' 16' ' ' HIS . 9.7 tt0 -86.23 -85.7 0.15 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.879 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 18' ' ' GLU . . . . . 0.407 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.4 OUTLIER -45.27 -34.32 2.82 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.628 1.204 . . . . 0.0 108.122 179.762 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CH2' ' CD ' ' S' ' 47' ' ' GLU . 22.7 t-105 -55.04 -55.13 34.36 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.151 -1.84 . . . . 0.0 108.59 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 20' ' ' LEU . . . . . 0.733 HD13 ' C ' ' R' ' 20' ' ' LEU . 2.4 tm? -57.25 -38.68 74.21 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.432 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.512 ' O ' ' C ' ' R' ' 22' ' ' PHE . 17.7 mmt180 -50.42 -73.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.416 -1.314 . . . . 0.0 110.553 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.512 ' C ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t80 -31.02 -41.91 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.087 -1.045 . . . . 0.0 111.842 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' R' ' 21' ' ' ARG . 10.9 t -69.76 -57.91 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.403 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.477 ' OD2' HD23 ' R' ' 25' ' ' LEU . 1.4 t70 -39.71 -60.21 1.02 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.633 -0.827 . . . . 0.0 111.522 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.687 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -52.72 -53.01 53.68 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.234 -1.386 . . . . 0.0 109.585 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 26' ' ' LEU . . . . . 0.436 ' C ' HD23 ' R' ' 26' ' ' LEU . 1.2 tt -39.83 -64.43 0.49 Allowed 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.351 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 27' ' ' LYS . . . . . 0.575 ' NZ ' ' CD1' ' S' ' 30' ' ' TYR . 0.4 OUTLIER -53.44 -76.11 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.868 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -34.85 -49.33 0.43 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.436 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -63.48 -55.35 24.78 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.409 -0.916 . . . . 0.0 113.078 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 30' ' ' TYR . . . . . 0.465 ' CE2' HG11 ' S' ' 23' ' ' VAL . 4.9 t80 -40.7 -37.62 0.77 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.774 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -47.37 -43.8 23.55 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.792 -1.163 . . . . 0.0 109.951 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -95.62 -78.25 0.46 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.9 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 169.81 24.71 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.965 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 34' ' ' LEU . . . . . 0.574 ' N ' ' CD2' ' R' ' 34' ' ' LEU . 1.0 OUTLIER -95.85 -9.66 30.92 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.074 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 35' ' ' HIS . . . . . 0.491 ' O ' HD22 ' R' ' 39' ' ' LEU . 11.1 p-80 -54.02 -30.85 49.27 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.476 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.476 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 9.0 mt -68.28 -58.69 7.08 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 117.878 -1.529 . . . . 0.0 110.318 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.6 Cg_exo -55.18 -43.28 60.54 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 120.563 0.842 . . . . 0.0 110.685 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 38' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' R' ' 38' ' ' LEU . 0.6 OUTLIER -61.49 -43.45 98.84 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.651 0.739 . . . . 0.0 110.387 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.527 HD23 ' HZ2' ' S' ' 19' ' ' TRP . 0.1 OUTLIER -52.3 -48.43 65.37 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.141 179.787 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.57 -5.85 0.25 Allowed 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.656 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 7.9 mp -102.58 -60.18 1.58 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.726 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.14 50.98 1.19 Allowed 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 118.715 -1.194 . . . . 0.0 109.399 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 43' ' ' LEU . . . . . 0.422 ' C ' HD23 ' R' ' 43' ' ' LEU . 0.2 OUTLIER 173.22 144.89 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.561 -1.199 . . . . 0.0 108.057 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -169.21 -43.42 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 115.396 -2.522 . . . . 0.0 117.051 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 45' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -104.2 -98.19 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 115.338 1.246 . . . . 0.0 115.338 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.84 -26.19 2.28 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.833 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.787 ' O ' HD13 ' R' ' 51' ' ' LEU . 6.6 mm-40 -51.8 -66.18 0.43 Allowed 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.858 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mmm-85 -58.19 -38.45 76.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.79 -0.764 . . . . 0.0 112.009 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -71.6 -67.18 0.54 Allowed 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.928 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.606 ' HB1' ' NH1' ' R' ' 54' ' ' ARG . . . -47.9 -30.28 4.03 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.994 -0.683 . . . . 0.0 112.731 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 51' ' ' LEU . . . . . 0.787 HD13 ' O ' ' R' ' 47' ' ' GLU . 4.6 mp -63.88 -67.43 0.43 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 119.237 -0.985 . . . . 0.0 111.65 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.74 -29.55 4.3 Favored Glycine 0 N--CA 1.487 2.089 0 C-N-CA 118.982 -1.58 . . . . 0.0 110.233 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.462 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -65.1 -81.69 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.803 -179.986 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.606 ' NH1' ' HB1' ' R' ' 50' ' ' ALA . 10.7 ptp180 -43.31 -43.9 5.21 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.733 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.2 t -62.8 -30.43 49.42 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 C-N-CA 118.341 -1.344 . . . . 0.0 110.296 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' R' ' 53' ' ' THR . 21.1 mtp85 -79.53 -39.62 31.52 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.08 -1.048 . . . . 0.0 111.357 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 1.03 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.47 -32.77 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 117.008 -1.877 . . . . 0.0 108.289 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 1.03 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.7 t -59.23 -61.21 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 118.75 -1.18 . . . . 0.0 108.484 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.437 ' N ' HG12 ' R' ' 58' ' ' VAL . 28.5 mt-10 -52.12 -30.93 28.61 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.962 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.18 -33.08 75.15 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.416 -0.913 . . . . 0.0 111.471 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 61' ' ' LEU . . . . . 0.654 HD12 ' C ' ' R' ' 61' ' ' LEU . 0.4 OUTLIER -75.1 -28.93 60.47 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.731 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mt . . . . . 0 N--CA 1.486 1.33 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.677 179.842 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.698 0.285 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' R' R ' 78' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 172.73 158.54 17.27 Favored Glycine 0 N--CA 1.492 2.407 0 C-N-CA 118.994 -1.574 . . . . 0.0 111.069 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.907 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -36.59 -27.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 CA-C-N 115.345 -0.428 . . . . 0.0 111.753 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.518 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -65.35 -78.39 0.05 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.401 -0.92 . . . . 0.0 112.683 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 81' ' ' THR . . . . . 0.444 HG22 HG23 ' R' ' 82' ' ' ILE . 0.5 OUTLIER -37.47 -31.31 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -179.724 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 82' ' ' ILE . . . . . 0.489 HD11 ' HA ' ' R' ' 79' ' ' ILE . 22.1 pt -87.06 -28.91 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 C-N-CA 118.418 -1.313 . . . . 0.0 112.85 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.464 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -54.63 -63.69 1.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 118.343 -1.343 . . . . 0.0 110.605 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 84' ' ' ARG . . . . . 0.77 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -62.58 -24.86 67.77 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 119.323 -0.951 . . . . 0.0 110.312 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.05 4.3 3.43 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.331 -1.414 . . . . 0.0 109.76 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 86' ' ' SER . . . . . 0.486 ' H ' ' C ' ' R' ' 84' ' ' ARG . 33.9 t -138.77 -43.54 0.48 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.618 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -92.96 10.33 31.75 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -42.21 -40.15 2.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.297 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.13 -74.85 0.06 Allowed 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.664 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 90' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' R' ' 91' ' ' ALA . 10.9 tptm -41.1 -50.07 3.43 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.525 0.678 . . . . 0.0 111.761 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 91' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.64 -62.32 0.36 Allowed 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 113.911 -1.495 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.688 ' HB3' ' HD3' ' R' ' 93' ' ' PRO . . . -174.34 -54.21 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 118.514 -1.274 . . . . 0.0 113.241 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 93' ' ' PRO . . . . . 0.688 ' HD3' ' HB3' ' R' ' 92' ' ' ALA . 5.4 Cg_exo -57.25 89.38 0.05 OUTLIER 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 120.196 0.597 . . . . 0.0 111.0 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 94' ' ' VAL . . . . . 0.595 HG23 ' O ' ' R' ' 92' ' ' ALA . 61.8 t -110.65 -45.59 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.442 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -67.73 -18.1 64.78 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.291 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.15 -43.45 61.24 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.943 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -35.57 59.62 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.296 -0.961 . . . . 0.0 110.707 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -52.47 -23.18 5.71 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.503 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.655 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.8 t90 -106.29 -62.19 1.42 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.179 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.471 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -40.74 -30.85 0.13 Allowed 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.104 -1.038 . . . . 0.0 113.704 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.503 ' O ' HD22 ' R' ' 105' ' ' LEU . 11.0 pt-20 -46.46 -36.32 6.5 Favored 'General case' 0 C--N 1.297 -1.712 0 C-N-CA 117.529 -1.669 . . . . 0.0 107.121 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 102' ' ' GLU . . . . . 0.476 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 3.6 mt-10 -91.37 -28.45 17.69 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-N 113.235 -1.802 . . . . 0.0 112.282 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.655 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.1 t -93.15 -1.34 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 117.601 -1.64 . . . . 0.0 110.67 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 104' ' ' LEU . . . . . 0.467 ' N ' ' O ' ' R' ' 100' ' ' LEU . 26.4 tp -105.6 -51.55 2.98 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.757 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' R' R ' 105' ' ' LEU . . . . . 0.85 HD23 ' N ' ' R' ' 106' ' ' LYS . 0.1 OUTLIER -72.79 -10.15 59.47 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 119.285 -0.966 . . . . 0.0 111.18 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' R' R ' 106' ' ' LYS . . . . . 0.85 ' N ' HD23 ' R' ' 105' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.519 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.015 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 121.129 0.49 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.82 -20.21 0.41 Allowed 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.043 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.453 ' C ' ' N ' ' S' ' 19' ' ' TRP . 0.9 OUTLIER -92.51 -82.99 0.31 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.389 179.808 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -45.4 -29.32 1.05 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.822 1.296 . . . . 0.0 108.194 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 19' ' ' TRP . . . . . 0.527 ' HZ2' HD23 ' R' ' 39' ' ' LEU . 24.4 t-105 -58.62 -59.87 4.72 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 112.862 -1.972 . . . . 0.0 109.911 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 20' ' ' LEU . . . . . 0.848 HD12 ' O ' ' S' ' 20' ' ' LEU . 0.3 OUTLIER -58.99 -19.03 39.7 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.968 -1.469 . . . . 0.0 111.081 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' S' ' 22' ' ' PHE . 12.1 mmt180 -67.82 -65.14 0.73 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.003 -1.479 . . . . 0.0 108.974 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.438 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.6 t80 -39.5 -41.69 1.03 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.303 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.465 HG11 ' CE2' ' R' ' 30' ' ' TYR . 85.5 t -71.09 -48.36 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.794 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 24' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -40.28 -64.44 0.51 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.492 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.52 HD23 ' N ' ' S' ' 25' ' ' LEU . 1.9 mt -53.02 -53.4 50.64 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 118.73 -1.188 . . . . 0.0 109.184 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.68 -1.08 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.297 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 27' ' ' LYS . . . . . 0.468 ' H ' ' C ' ' S' ' 25' ' ' LEU . 25.0 tttm -88.05 -68.48 0.76 Allowed 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.389 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.88 -3.2 50.46 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.363 -0.935 . . . . 0.0 112.139 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 29' ' ' ALA . . . . . 0.466 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -74.32 -53.27 10.01 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.919 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 30' ' ' TYR . . . . . 0.575 ' CD1' ' NZ ' ' R' ' 27' ' ' LYS . 14.6 t80 -41.65 -42.14 2.42 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.25 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -45.58 -42.3 10.96 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.57 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.414 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 0.0 OUTLIER -97.37 -77.65 0.49 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.177 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' S' ' 32' ' ' ASN . 0.5 OUTLIER 169.66 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 34' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 0.8 OUTLIER -92.82 -15.35 26.61 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.062 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -51.15 -20.75 1.63 Allowed 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.186 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.466 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.0 mt -80.21 -65.03 0.29 Allowed Pre-proline 0 C--N 1.306 -1.302 0 C-N-CA 118.335 -1.346 . . . . 0.0 110.647 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.526 ' O ' ' ND2' ' S' ' 40' ' ' ASN . 2.6 Cg_endo -51.88 -21.32 11.64 Favored 'Trans proline' 0 C--N 1.32 -0.938 0 N-CA-C 109.775 -0.894 . . . . 0.0 109.775 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 49.1 mt -79.87 -38.7 32.13 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.609 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.3 OUTLIER -59.7 -24.75 64.23 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.758 179.696 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 40' ' ' ASN . . . . . 0.526 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.0 OUTLIER -97.06 10.37 39.49 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.744 179.747 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tp -108.47 -67.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -99.33 36.79 1.67 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 119.019 -1.073 . . . . 0.0 112.143 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 43' ' ' LEU . . . . . 0.612 HD21 ' HG3' ' S' ' 47' ' ' GLU . 24.1 tp 172.74 146.04 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.52 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.7 OUTLIER 177.98 -46.94 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 117.169 -1.812 . . . . 0.0 114.921 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.52 ' HD2' ' H ' ' S' ' 44' ' ' THR . 6.0 Cg_endo -68.42 -83.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 120.361 0.707 . . . . 0.0 111.584 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 46' ' ' ASP . . . . . 0.701 ' O ' ' HB3' ' S' ' 50' ' ' ALA . 3.0 p-10 -49.73 -14.42 0.13 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 119.005 -1.078 . . . . 0.0 109.715 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 47' ' ' GLU . . . . . 0.612 ' HG3' HD21 ' S' ' 43' ' ' LEU . 10.5 tt0 -71.77 -74.94 0.14 Allowed 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.281 -0.967 . . . . 0.0 111.284 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.77 -25.03 0.15 Allowed 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 119.592 -0.843 . . . . 0.0 110.945 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' O ' ' S' ' 47' ' ' GLU . 4.2 mm-40 -100.51 -65.03 0.99 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.978 -1.089 . . . . 0.0 112.786 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 50' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' S' ' 46' ' ' ASP . . . -61.82 -42.19 98.71 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.075 -1.05 . . . . 0.0 112.985 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 51' ' ' LEU . . . . . 0.487 HD12 HH21 ' S' ' 54' ' ' ARG . 1.8 tp -54.45 -49.73 69.36 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.761 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.82 -35.76 83.9 Favored Glycine 0 N--CA 1.492 2.373 0 C-N-CA 118.797 -1.668 . . . . 0.0 109.744 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.467 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -64.83 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 115.006 -0.597 . . . . 0.0 112.563 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.501 ' O ' HG23 ' S' ' 58' ' ' VAL . 4.5 ptt180 -42.41 -29.4 0.27 Allowed 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.834 -0.746 . . . . 0.0 112.393 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 55' ' ' VAL . . . . . 0.407 HG23 ' O ' ' S' ' 51' ' ' LEU . 71.7 t -76.47 -31.78 20.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 117.817 -1.553 . . . . 0.0 109.407 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' S' ' 53' ' ' THR . 10.8 mtp180 -63.6 -46.7 84.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 118.894 -1.123 . . . . 0.0 109.825 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 0.42 ' N ' HD13 ' S' ' 57' ' ' ILE . 0.0 OUTLIER -71.68 -57.33 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 C-N-CA 118.024 -1.47 . . . . 0.0 110.219 179.918 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 58' ' ' VAL . . . . . 0.501 HG23 ' O ' ' S' ' 54' ' ' ARG . 84.8 t -47.26 -64.58 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 C-N-CA 118.288 -1.365 . . . . 0.0 111.459 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.63 -28.72 22.6 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.48 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -80.94 -47.24 13.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 118.474 -1.29 . . . . 0.0 112.789 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 61' ' ' LEU . . . . . 0.454 HD22 ' O ' ' S' ' 85' ' ' GLY . 2.1 pp -70.09 -5.23 25.42 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 117.859 -1.536 . . . . 0.0 110.613 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 62' ' ' LEU . . . . . 0.423 ' HA ' HD22 ' S' ' 62' ' ' LEU . 0.2 OUTLIER -71.06 -61.97 1.57 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.429 179.748 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 . . . . . 0 N--CA 1.493 1.714 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.508 179.891 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 73' ' ' ASN . . . . . 0.484 ' CG ' ' N ' ' S' ' 74' ' ' GLU . 17.6 t30 -97.25 -95.7 0.21 Allowed 'General case' 0 C--N 1.297 -1.701 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.551 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 74' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' S' ' 73' ' ' ASN . 18.2 mt-10 -163.31 -43.1 0.03 OUTLIER 'General case' 0 C--N 1.278 -2.538 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.36 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 75' ' ' LEU . . . . . 0.458 HD13 ' HA ' ' S' ' 75' ' ' LEU . 0.1 OUTLIER -114.72 -30.74 6.38 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.56 -1.655 . . . . 0.0 111.181 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -36.79 -73.59 0.12 Allowed Glycine 0 N--CA 1.497 2.745 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.208 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 77' ' ' ALA . . . . . 0.542 ' O ' ' O ' ' S' ' 78' ' ' GLY . . . -166.69 64.8 0.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.075 -1.05 . . . . 0.0 111.429 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 78' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' S' ' 77' ' ' ALA . . . 29.96 -162.89 0.0 OUTLIER Glycine 0 N--CA 1.5 2.928 0 CA-C-N 114.933 -1.031 . . . . 0.0 112.628 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.709 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.2 OUTLIER -110.63 -18.92 7.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-N 114.679 -0.761 . . . . 0.0 111.96 179.873 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.28 86.27 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.338 -1.345 . . . . 0.0 111.135 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 47.1 m -46.68 -61.94 1.61 Allowed 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 8.0 pt -64.75 -2.58 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.27 -41.62 8.57 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.398 -1.321 . . . . 0.0 113.511 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -62.95 -12.98 29.2 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 85' ' ' GLY . . . . . 0.454 ' O ' HD22 ' S' ' 61' ' ' LEU . . . -99.75 25.52 27.94 Favored Glycine 0 N--CA 1.5 2.921 0 C-N-CA 119.148 -1.501 . . . . 0.0 111.023 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -119.44 -31.34 4.64 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.432 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 87' ' ' ASN . . . . . 0.433 ' ND2' ' N ' ' S' ' 87' ' ' ASN . 0.0 OUTLIER -100.08 -21.01 15.75 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.689 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.35 -23.59 0.97 Allowed 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.683 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 34.9 mt -63.65 -39.01 93.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.361 -0.935 . . . . 0.0 112.113 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.76 -28.32 17.46 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 118.666 -1.214 . . . . 0.0 111.282 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -43.47 -57.77 2.93 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 114.972 -1.013 . . . . 0.0 112.888 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 92' ' ' ALA . . . . . 0.672 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . -158.8 -58.79 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.766 0 C-N-CA 118.556 -1.258 . . . . 0.0 114.014 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 93' ' ' PRO . . . . . 0.672 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 6.5 Cg_exo -45.98 89.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.325 -0.684 0 C-N-CA 120.607 0.871 . . . . 0.0 112.224 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 94' ' ' VAL . . . . . 0.519 ' N ' ' O ' ' S' ' 92' ' ' ALA . 2.4 t -111.2 -28.83 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.479 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.19 -25.31 68.28 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.91 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 96' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' S' ' 97' ' ' ARG . 8.7 mp -45.91 -48.78 16.12 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.746 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 97' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' S' ' 96' ' ' LEU . 0.3 OUTLIER -42.64 -47.14 5.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.57 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -61.28 -46.11 91.71 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.915 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.654 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 9.6 t90 -74.42 -62.04 1.66 Allowed 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.925 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.473 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -34.64 -39.67 0.09 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' S' ' 100' ' ' LEU . 2.0 mm-40 -42.27 -42.87 3.23 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.048 -1.461 . . . . 0.0 107.135 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -82.86 -27.06 31.03 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.894 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.654 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 8.0 t -83.4 -39.14 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 C-N-CA 116.66 -2.016 . . . . 0.0 112.962 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.55 -50.17 7.03 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 118.743 -1.183 . . . . 0.0 111.35 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 105' ' ' LEU . . . . . 0.58 HD22 ' H ' ' S' ' 105' ' ' LEU . 1.0 OUTLIER -87.15 11.74 13.25 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.913 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' S' S ' 106' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' S' ' 105' ' ' LEU . 21.2 tttm -32.3 -41.87 0.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.598 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.873 -179.977 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.825 0.345 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 9.75 10.39 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.125 -1.03 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.425 ' C ' ' N ' ' R' ' 19' ' ' TRP . 6.2 tt0 -85.7 -84.36 0.16 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.66 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 18' ' ' GLU . . . . . 0.4 ' H ' ' HB3' ' R' ' 17' ' ' GLN . 0.8 OUTLIER -44.63 -30.84 0.99 Allowed 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 122.897 1.332 . . . . 0.0 109.008 179.791 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 19' ' ' TRP . . . . . 0.425 ' N ' ' C ' ' R' ' 17' ' ' GLN . 54.3 t-105 -55.12 -56.75 16.33 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.804 -1.998 . . . . 0.0 109.059 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.3 tp -51.85 -38.16 54.87 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.898 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' R' ' 22' ' ' PHE . 21.9 mtp180 -56.82 -64.34 0.91 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.781 -1.168 . . . . 0.0 111.195 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.474 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -35.82 -48.12 0.54 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 118.813 -1.155 . . . . 0.0 111.435 179.71 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 23' ' ' VAL . . . . . 0.471 ' O ' ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -76.61 -68.44 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.975 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 9.0 t70 -39.84 -28.49 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.112 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.471 ' N ' ' O ' ' R' ' 23' ' ' VAL . 10.2 tp -77.73 -56.77 4.24 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.347 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 tt -41.09 -59.43 1.49 Allowed 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 27' ' ' LYS . . . . . 0.426 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.1 OUTLIER -54.45 -60.9 2.72 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.287 -0.965 . . . . 0.0 111.088 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -43.21 -24.29 0.08 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.401 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -97.9 -31.89 11.96 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.197 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -50.73 -38.08 45.45 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 118.794 -1.163 . . . . 0.0 110.105 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -27.37 69.09 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.082 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 32' ' ' ASN . . . . . 0.437 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.4 m120 -101.61 -10.15 20.32 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.087 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 33' ' ' ASP . . . . . 0.437 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.5 m-20 75.71 17.32 2.35 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.413 0.625 . . . . 0.0 110.291 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -85.27 -15.33 43.81 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.621 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 35' ' ' HIS . . . . . 0.416 ' O ' HD13 ' R' ' 39' ' ' LEU . 9.5 p-80 -52.24 -13.94 0.39 Allowed 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.797 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 8.2 mt -79.27 -66.01 0.28 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 117.504 -1.679 . . . . 0.0 110.147 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.2 Cg_endo -53.98 -26.97 42.92 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 N-CA-C 109.501 -1.0 . . . . 0.0 109.501 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 1.5 tp -77.48 -35.53 53.6 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.947 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.424 ' HA ' HD12 ' R' ' 39' ' ' LEU . 0.3 OUTLIER -55.68 -33.74 64.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.602 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -74.64 5.18 5.12 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.256 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mt -113.23 -58.08 2.2 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 119.817 -0.753 . . . . 0.0 112.812 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.91 36.29 0.72 Allowed 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 118.381 -1.328 . . . . 0.0 112.876 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 165.24 140.64 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 114.719 -1.128 . . . . 0.0 108.591 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.649 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -33.35 0.0 OUTLIER Pre-proline 0 N--CA 1.496 1.838 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.649 ' CD ' ' H ' ' R' ' 44' ' ' THR . 34.9 Cg_endo -88.99 -103.16 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.146 0 C-N-CA 121.054 1.169 . . . . 0.0 112.16 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 46' ' ' ASP . . . . . 0.709 ' O ' ' HB3' ' R' ' 50' ' ' ALA . 0.6 OUTLIER -52.21 -13.56 0.34 Allowed 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.411 -179.883 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.475 ' N ' ' C ' ' R' ' 45' ' ' PRO . 7.1 mm-40 -69.79 -61.67 1.69 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.079 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -21.92 13.14 Favored 'General case' 0 C--N 1.299 -1.604 0 C-N-CA 118.94 -1.104 . . . . 0.0 110.39 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -108.08 -71.68 0.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.595 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' R' ' 46' ' ' ASP . . . -48.86 -36.99 18.25 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 51' ' ' LEU . . . . . 0.443 ' HG ' ' N ' ' R' ' 52' ' ' GLY . 0.2 OUTLIER -69.57 -38.67 77.48 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.932 -179.892 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 52' ' ' GLY . . . . . 0.443 ' N ' ' HG ' ' R' ' 51' ' ' LEU . . . -65.99 -28.14 73.42 Favored Glycine 0 N--CA 1.485 1.901 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.552 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -63.61 -79.45 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.54 -0.83 . . . . 0.0 110.594 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.45 ' HA ' HG23 ' R' ' 57' ' ' ILE . 1.2 ptp180 -36.02 -50.5 0.69 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 123.796 0.685 . . . . 0.0 111.286 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.69 -36.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 118.04 -1.464 . . . . 0.0 110.314 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' R' ' 53' ' ' THR . 2.8 mtm180 -75.37 -40.44 58.04 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.533 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 1.045 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -70.34 -38.99 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 116.869 -1.933 . . . . 0.0 109.532 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 1.045 ' N ' HD13 ' R' ' 57' ' ' ILE . 54.3 t -59.82 -59.28 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 117.73 -1.588 . . . . 0.0 109.33 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.59 -24.73 5.78 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.781 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.77 -50.73 16.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.942 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.89 -31.6 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.368 -0.933 . . . . 0.0 112.562 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tp . . . . . 0 N--CA 1.494 1.754 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.327 -179.946 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' R' R ' 78' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 87.56 97.34 0.9 Allowed Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.047 -1.549 . . . . 0.0 109.927 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.574 HD12 ' OG1' ' R' ' 83' ' ' THR . 0.1 OUTLIER -20.71 -44.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.969 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.499 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -50.01 -12.83 0.09 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.285 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 81' ' ' THR . . . . . 0.426 ' N ' ' O ' ' R' ' 79' ' ' ILE . 17.0 m -88.95 -51.13 5.78 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 82' ' ' ILE . . . . . 0.424 ' H ' HG23 ' R' ' 82' ' ' ILE . 0.8 OUTLIER -80.5 6.83 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.574 ' OG1' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -105.34 -13.55 15.62 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.649 -1.22 . . . . 0.0 112.737 -179.92 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.73 -33.52 11.68 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.408 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.35 -29.34 2.51 Favored Glycine 0 N--CA 1.484 1.89 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.729 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.41 -50.69 4.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 118.629 -1.229 . . . . 0.0 112.219 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 87' ' ' ASN . . . . . 0.539 ' N ' ' OD1' ' R' ' 87' ' ' ASN . 0.7 OUTLIER -68.14 5.83 0.87 Allowed 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.651 -0.82 . . . . 0.0 112.489 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 42.5 m -116.45 -46.9 2.76 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.401 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.2 tt -46.65 -36.4 6.98 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.199 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -66.14 -70.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 122.062 0.935 . . . . 0.0 112.393 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 91' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 92' ' ' ALA . . . -58.86 -82.52 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 113.813 -1.54 . . . . 0.0 112.781 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 91' ' ' ALA . . . 58.1 150.27 0.07 OUTLIER Pre-proline 0 N--CA 1.492 1.634 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.037 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -54.3 152.88 23.99 Favored 'Trans proline' 0 C--O 1.214 -0.701 0 C-N-CA 121.079 1.186 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 33.5 t -74.51 -61.49 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 C-N-CA 119.36 -0.936 . . . . 0.0 112.992 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.46 -16.98 41.85 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.466 -0.893 . . . . 0.0 112.997 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 96' ' ' LEU . . . . . 0.525 HD13 ' C ' ' R' ' 96' ' ' LEU . 3.1 tm? -79.6 -35.72 39.15 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 118.775 -1.17 . . . . 0.0 111.308 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.85 -24.97 55.8 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 118.892 -1.123 . . . . 0.0 109.918 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -65.69 -19.3 65.85 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.053 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.652 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 21.0 t90 -97.16 -55.02 2.98 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.99 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.581 HD13 ' HB ' ' R' ' 103' ' ' VAL . 2.0 mm? -39.59 -28.84 0.05 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.02 -1.072 . . . . 0.0 113.542 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' R' ' 100' ' ' LEU . 10.2 mm-40 -47.1 -39.02 12.41 Favored 'General case' 0 C--N 1.292 -1.93 0 C-N-CA 117.717 -1.593 . . . . 0.0 107.519 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -89.47 -28.55 19.61 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 113.936 -1.483 . . . . 0.0 112.415 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.652 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 10.4 t -78.82 -34.0 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.16 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.0 -48.86 16.78 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.315 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 105' ' ' LEU . . . . . 0.739 HD13 ' C ' ' R' ' 105' ' ' LEU . 2.4 tm? -58.05 -44.04 87.22 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.837 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt . . . . . 0 N--CA 1.488 1.434 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.3 -179.979 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 121.602 0.715 . . . . 0.0 110.684 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -117.46 12.6 14.23 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.447 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.478 ' C ' ' N ' ' S' ' 19' ' ' TRP . 1.2 mt-30 -89.62 -81.41 0.28 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.115 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 3.1 mp0 -42.12 -30.61 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 122.942 1.353 . . . . 0.0 108.158 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 19' ' ' TRP . . . . . 0.478 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.26 72.2 t-105 -56.44 -56.09 25.5 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.269 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 20' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' S' ' 17' ' ' GLN . 5.9 tp -58.87 -27.34 65.08 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.845 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.457 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.9 mtt85 -66.49 -74.42 0.11 Allowed 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.48 -1.288 . . . . 0.0 109.65 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.457 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -36.34 -42.45 0.32 Allowed 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.172 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.416 ' O ' ' C ' ' S' ' 24' ' ' ASP . 3.0 t -69.79 -56.03 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.7 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' S' ' 23' ' ' VAL . 22.6 t0 -35.94 -73.31 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.725 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.527 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.1 OUTLIER -49.97 -46.16 52.15 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.584 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.709 HD11 ' CD1' ' S' ' 39' ' ' LEU . 2.1 tp -45.18 -30.5 1.19 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.057 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.25 -71.77 0.34 Allowed 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.464 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -50.62 -27.04 6.11 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 29' ' ' ALA . . . . . 0.506 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -78.59 -50.1 12.1 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.94 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 30' ' ' TYR . . . . . 0.443 ' CD1' ' C ' ' S' ' 30' ' ' TYR . 11.2 t80 -44.55 -38.24 4.07 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.247 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -46.38 -37.23 7.29 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.711 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.65 -79.34 0.54 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.788 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 172.73 35.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.953 0.882 . . . . 0.0 109.322 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 34' ' ' LEU . . . . . 0.527 HD23 ' CD2' ' R' ' 99' ' ' TRP . 0.3 OUTLIER -100.95 -19.37 15.9 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.767 -179.942 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -57.08 -17.98 12.58 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.544 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.2 mt -76.84 -63.33 0.54 Allowed Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 118.263 -1.375 . . . . 0.0 110.304 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 5.4 Cg_exo -50.98 -32.0 36.66 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 N-CA-C 109.863 -0.861 . . . . 0.0 109.863 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 mt -67.85 -43.54 79.25 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.709 ' CD1' HD11 ' S' ' 26' ' ' LEU . 0.3 OUTLIER -54.78 -34.06 62.17 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.101 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -83.89 10.69 9.1 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.81 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.38 -63.58 1.39 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.929 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mtt -91.39 33.58 0.99 Allowed 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.709 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 43' ' ' LEU . . . . . 0.458 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.6 OUTLIER 164.91 142.23 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 O-C-N 123.439 0.462 . . . . 0.0 110.021 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.603 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.25 -42.41 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.313 0 C-N-CA 117.196 -1.802 . . . . 0.0 115.238 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.603 ' HD2' ' H ' ' S' ' 44' ' ' THR . 16.0 Cg_endo -76.64 -110.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 121.12 1.213 . . . . 0.0 113.403 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 46' ' ' ASP . . . . . 0.426 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 1.0 OUTLIER -51.28 -16.95 0.6 Allowed 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.49 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 47' ' ' GLU . . . . . 0.401 ' N ' ' C ' ' S' ' 45' ' ' PRO . 5.9 mm-40 -65.76 -66.99 0.48 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.016 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -51.82 -42.2 62.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.113 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.08 -68.9 0.31 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.051 -1.06 . . . . 0.0 112.208 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.44 -22.57 21.01 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.191 -1.004 . . . . 0.0 111.257 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 51' ' ' LEU . . . . . 0.436 HD11 ' CG ' ' R' ' 22' ' ' PHE . 5.7 tt -67.68 -53.27 29.08 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.87 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.69 -52.1 52.67 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.684 -1.766 . . . . 0.0 108.684 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.551 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.1 OUTLIER -39.83 -74.46 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.982 0.896 . . . . 0.0 111.071 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.569 ' HE ' ' CG2' ' S' ' 55' ' ' VAL . 0.0 OUTLIER -41.76 -39.03 1.61 Allowed 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 113.868 -1.514 . . . . 0.0 112.638 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 55' ' ' VAL . . . . . 0.569 ' CG2' ' HE ' ' S' ' 54' ' ' ARG . 13.4 t -73.6 -27.68 23.63 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 C-N-CA 117.874 -1.53 . . . . 0.0 108.209 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.1 OUTLIER -80.97 -35.28 32.33 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.91 -1.041 . . . . 0.0 112.306 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 1.009 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -73.08 -35.98 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 116.662 -2.015 . . . . 0.0 106.997 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 58' ' ' VAL . . . . . 1.009 ' N ' HD13 ' S' ' 57' ' ' ILE . 9.9 t -62.25 -63.32 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 C-N-CA 118.68 -1.208 . . . . 0.0 109.536 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -50.57 -32.01 17.41 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.926 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -73.76 -54.17 8.65 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.859 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 15.6 mt -46.68 -26.5 0.93 Allowed 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.934 -1.106 . . . . 0.0 109.903 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.16 -35.62 64.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.841 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 . . . . . 0 N--CA 1.491 1.584 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.167 179.921 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 tttm . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 121.044 0.449 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' S' S ' 73' ' ' ASN . . . . . 0.533 ' O ' ' N ' ' S' ' 75' ' ' LEU . 1.0 OUTLIER -110.16 21.73 16.4 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.885 0.85 . . . . 0.0 110.088 -179.947 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 58.69 -66.64 0.03 OUTLIER 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 112.901 -1.954 . . . . 0.0 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 75' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' S' ' 73' ' ' ASN . 4.0 mt -75.1 -15.5 60.6 Favored 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.957 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -74.46 -28.54 63.42 Favored Glycine 0 N--CA 1.491 2.317 0 C-N-CA 119.635 -1.269 . . . . 0.0 110.868 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -159.85 -77.65 0.06 Allowed 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.727 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 78' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' S' ' 81' ' ' THR . . . 140.85 109.76 0.8 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.618 -1.793 . . . . 0.0 108.618 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.727 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.0 OUTLIER -29.46 -45.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -179.777 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.42 ' N ' HG13 ' S' ' 79' ' ' ILE . . . -59.54 -46.84 87.7 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.982 -1.087 . . . . 0.0 111.077 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 81' ' ' THR . . . . . 0.471 ' N ' ' O ' ' S' ' 78' ' ' GLY . 61.0 m -53.57 -45.01 69.78 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 pt -84.74 10.15 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 118.71 -1.196 . . . . 0.0 113.986 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -108.06 -52.71 2.73 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.324 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -63.17 0.38 0.63 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.466 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 85' ' ' GLY . . . . . 0.478 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -70.86 -9.82 66.74 Favored Glycine 0 N--CA 1.487 2.038 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.212 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 86' ' ' SER . . . . . 0.443 ' C ' ' H ' ' S' ' 88' ' ' SER . 9.4 p -126.72 -42.92 1.74 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.028 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 87' ' ' ASN . . . . . 0.436 ' N ' ' OG ' ' S' ' 86' ' ' SER . 0.9 OUTLIER -57.95 -7.19 0.7 Allowed 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.026 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 88' ' ' SER . . . . . 0.443 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -66.29 -31.16 71.8 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.946 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 4.5 mt -45.68 -28.27 0.97 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.018 -1.073 . . . . 0.0 109.758 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 90' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' S' ' 92' ' ' ALA . 60.6 mttt -92.25 -75.73 0.48 Allowed 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.122 0.963 . . . . 0.0 110.385 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -40.21 -27.08 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.921 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 92' ' ' ALA . . . . . 0.444 ' N ' ' O ' ' S' ' 90' ' ' LYS . . . -91.1 149.71 40.41 Favored Pre-proline 0 N--CA 1.489 1.488 0 C-N-CA 118.972 -1.091 . . . . 0.0 111.707 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -54.8 160.68 7.18 Favored 'Trans proline' 0 C--O 1.215 -0.673 0 C-N-CA 121.403 1.402 . . . . 0.0 111.699 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 83.6 t -88.42 -26.57 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 118.774 -1.171 . . . . 0.0 109.63 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -58.87 -8.82 1.5 Allowed 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.732 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 mt -66.1 -51.66 55.95 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.817 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.21 -50.38 3.59 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.041 -0.663 . . . . 0.0 111.911 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -55.98 -30.12 61.31 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.837 -0.745 . . . . 0.0 112.791 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.4 ' CH2' HG11 ' S' ' 103' ' ' VAL . 7.8 t90 -86.07 -54.13 4.66 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.808 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.617 HD13 HG23 ' S' ' 103' ' ' VAL . 2.1 mm? -40.14 -41.49 1.28 Allowed 'General case' 0 C--N 1.293 -1.871 0 C-N-CA 118.802 -1.159 . . . . 0.0 113.663 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' S' ' 100' ' ' LEU . 4.5 mt-10 -46.11 -30.33 1.86 Allowed 'General case' 0 C--N 1.289 -2.064 0 C-N-CA 118.26 -1.376 . . . . 0.0 108.229 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 102' ' ' GLU . . . . . 0.412 ' N ' ' C ' ' S' ' 100' ' ' LEU . 3.9 mm-40 -87.79 -39.25 15.05 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.319 -1.31 . . . . 0.0 114.026 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.617 HG23 HD13 ' S' ' 100' ' ' LEU . 0.2 OUTLIER -82.77 -18.8 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 C-N-CA 114.826 -2.749 . . . . 0.0 111.192 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 104' ' ' LEU . . . . . 0.455 HD23 HD12 ' S' ' 100' ' ' LEU . 0.0 OUTLIER -87.28 -50.92 6.26 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.732 179.866 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.77 -53.26 58.81 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.46 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -56.31 -59.94 4.23 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.976 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 116.431 -1.747 . . . . 0.0 110.344 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.667 0.27 . . . . 0.0 110.479 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -158.87 27.11 0.22 Allowed 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.604 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -110.44 -79.15 0.58 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -61.41 -30.69 70.72 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 9.6 t-105 -62.02 -55.0 33.73 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.146 -1.843 . . . . 0.0 107.417 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 20' ' ' LEU . . . . . 0.728 HD13 ' C ' ' R' ' 20' ' ' LEU . 1.9 tm? -56.05 -39.67 72.38 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 112.681 -2.054 . . . . 0.0 109.544 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.479 ' O ' ' C ' ' R' ' 22' ' ' PHE . 4.6 mtt-85 -50.47 -69.68 0.11 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 117.858 -1.537 . . . . 0.0 109.044 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.546 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -32.77 -47.05 0.16 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 119.811 -0.755 . . . . 0.0 111.009 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 23' ' ' VAL . . . . . 0.518 HG21 HD21 ' S' ' 39' ' ' LEU . 77.2 t -66.84 -59.23 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.378 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.534 ' OD2' HD23 ' R' ' 25' ' ' LEU . 1.5 t0 -37.66 -63.47 0.46 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.713 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -65.14 -41.94 94.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.253 -1.379 . . . . 0.0 112.205 -179.838 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 26' ' ' LEU . . . . . 0.709 HD13 ' C ' ' R' ' 26' ' ' LEU . 2.8 tm? -47.41 -54.65 10.75 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.145 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 27' ' ' LYS . . . . . 0.468 ' N ' HD13 ' R' ' 26' ' ' LEU . 0.0 OUTLIER -78.66 -24.35 45.23 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.046 -1.062 . . . . 0.0 112.203 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.71 -14.09 59.0 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.891 -1.124 . . . . 0.0 110.891 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.543 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -98.49 -45.85 5.97 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.462 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -42.69 -27.4 0.17 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.467 -0.893 . . . . 0.0 110.855 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -56.4 -43.58 79.44 Favored 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.037 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -96.4 -79.66 0.44 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.62 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 172.56 27.74 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.693 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 34' ' ' LEU . . . . . 0.564 ' N ' ' CD2' ' R' ' 34' ' ' LEU . 0.8 OUTLIER -95.03 -14.27 24.46 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.816 -179.889 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 35' ' ' HIS . . . . . 0.427 ' O ' HD13 ' R' ' 39' ' ' LEU . 16.7 p-80 -52.14 -24.84 7.63 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.12 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.438 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -74.33 -62.75 0.95 Allowed Pre-proline 0 C--N 1.301 -1.517 0 C-N-CA 117.965 -1.494 . . . . 0.0 110.538 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.0 Cg_endo -54.31 -22.12 25.42 Favored 'Trans proline' 0 C--N 1.32 -0.949 0 C-N-CA 120.544 0.829 . . . . 0.0 110.469 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.41 -30.13 23.83 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.889 -0.724 . . . . 0.0 110.257 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.487 ' O ' ' CD1' ' R' ' 43' ' ' LEU . 0.1 OUTLIER -64.41 -29.36 70.42 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.166 -1.013 . . . . 0.0 108.393 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 40' ' ' ASN . . . . . 0.438 ' OD1' ' O ' ' R' ' 40' ' ' ASN . 0.0 OUTLIER -82.23 6.49 16.54 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.495 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 41' ' ' LEU . . . . . 0.465 HD23 HH12 ' S' ' 84' ' ' ARG . 1.9 mt -106.91 -55.48 2.32 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 119.975 -0.69 . . . . 0.0 112.509 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -96.65 34.2 1.71 Allowed 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.074 -1.051 . . . . 0.0 112.762 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 43' ' ' LEU . . . . . 0.487 ' CD1' ' O ' ' R' ' 39' ' ' LEU . 0.7 OUTLIER 169.21 150.41 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 179.893 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.425 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -166.12 -40.94 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 116.152 -2.219 . . . . 0.0 115.898 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.425 ' CD ' ' H ' ' R' ' 44' ' ' THR . 56.9 Cg_endo -105.99 -98.96 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.121 1.214 . . . . 0.0 113.954 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -50.18 -24.35 2.76 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.08 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.703 ' O ' HD13 ' R' ' 51' ' ' LEU . 1.0 OUTLIER -61.33 -48.71 80.1 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 118.78 -1.168 . . . . 0.0 110.087 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ttp180 -66.11 -38.0 87.14 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.977 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -62.59 -70.73 0.19 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.906 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.27 -31.73 1.67 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.223 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 51' ' ' LEU . . . . . 0.703 HD13 ' O ' ' R' ' 47' ' ' GLU . 1.1 mp -58.72 -69.68 0.18 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.565 -0.854 . . . . 0.0 110.591 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.34 -52.59 6.08 Favored Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.697 -1.239 . . . . 0.0 110.104 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.487 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -43.29 -76.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.022 0.915 . . . . 0.0 111.521 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.486 ' HG3' ' N ' ' R' ' 55' ' ' VAL . 0.0 OUTLIER -37.72 -49.0 1.12 Allowed 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.518 -1.674 . . . . 0.0 114.176 -179.878 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 55' ' ' VAL . . . . . 0.486 ' N ' ' HG3' ' R' ' 54' ' ' ARG . 64.0 t -66.28 -23.12 31.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 C-N-CA 117.561 -1.655 . . . . 0.0 109.489 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' R' ' 53' ' ' THR . 3.0 ptt180 -81.64 -39.57 24.21 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.602 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 0.674 HD12 ' C ' ' R' ' 57' ' ' ILE . 0.4 OUTLIER -71.46 -37.75 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 117.545 -1.662 . . . . 0.0 107.185 179.784 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 0.4 HG12 ' N ' ' R' ' 59' ' ' GLU . 25.6 t -63.15 -69.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 119.111 -1.035 . . . . 0.0 109.905 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.4 ' N ' HG12 ' R' ' 58' ' ' VAL . 9.2 tt0 -48.43 -21.25 0.51 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.389 -0.924 . . . . 0.0 111.363 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -76.29 -53.47 8.17 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.186 -1.006 . . . . 0.0 112.814 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pp -62.43 -24.69 67.56 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 118.228 -1.389 . . . . 0.0 111.204 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mt . . . . . 0 C--N 1.305 -1.351 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.763 179.888 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.006 0.432 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 146.44 9.03 Favored Glycine 0 N--CA 1.488 2.156 0 C-N-CA 119.525 -1.322 . . . . 0.0 110.751 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.87 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -39.84 -36.64 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.642 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.531 ' O ' ' NE ' ' R' ' 84' ' ' ARG . . . -52.75 -37.11 58.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.672 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 81' ' ' THR . . . . . 0.541 ' CG2' ' N ' ' R' ' 82' ' ' ILE . 3.9 t -68.81 -50.9 46.31 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.388 -0.925 . . . . 0.0 113.129 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 82' ' ' ILE . . . . . 0.541 ' N ' ' CG2' ' R' ' 81' ' ' THR . 12.2 pt -73.09 10.69 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.334 -1.346 . . . . 0.0 112.447 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -93.52 -68.25 0.81 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.801 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 84' ' ' ARG . . . . . 0.779 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.51 -23.57 10.78 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.63 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.72 -50.17 55.02 Favored Glycine 0 N--CA 1.49 2.283 0 C-N-CA 119.422 -1.37 . . . . 0.0 110.331 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 56.1 m -93.65 -26.27 17.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -86.07 3.66 41.48 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.435 -0.906 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -26.04 59.73 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.703 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.77 -30.34 61.11 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.146 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.24 -51.69 3.07 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.306 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.18 0.11 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.537 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.579 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -96.74 163.99 19.06 Favored Pre-proline 0 N--CA 1.489 1.518 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.583 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 93' ' ' PRO . . . . . 0.579 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 13.8 Cg_exo -49.37 152.55 5.66 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 C-N-CA 121.438 1.425 . . . . 0.0 111.507 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.54 10.52 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 119.933 -0.707 . . . . 0.0 111.409 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.62 -11.69 58.74 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.188 -1.005 . . . . 0.0 111.619 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 pp -97.37 -32.9 11.63 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.359 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.39 -29.17 3.74 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.212 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -82.77 -42.03 18.45 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.788 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.632 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 10.0 t90 -62.23 -60.01 4.2 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.602 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.28 -26.5 0.06 Allowed 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.127 -1.029 . . . . 0.0 113.244 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.452 ' C ' ' O ' ' R' ' 100' ' ' LEU . 2.1 mm-40 -48.62 -38.9 22.19 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 117.412 -1.715 . . . . 0.0 106.563 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -88.65 -28.78 20.4 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 113.26 -1.791 . . . . 0.0 112.276 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.632 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.2 t -91.22 -3.45 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 117.489 -1.684 . . . . 0.0 110.813 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 104' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' R' ' 100' ' ' LEU . 29.3 tp -101.33 -51.79 3.4 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.692 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' R' R ' 105' ' ' LEU . . . . . 0.695 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.5 OUTLIER -66.17 -26.57 67.48 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 118.905 -1.118 . . . . 0.0 110.525 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 8.6 tttp . . . . . 0 N--CA 1.487 1.389 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.553 -179.983 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 9.7 mtt180 . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.966 0.412 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -133.68 -4.28 2.9 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' S' ' 18' ' ' GLU . 5.6 mt-30 -87.78 -84.19 0.2 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.977 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 3.1 mp0 -45.54 -35.26 3.78 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -44.44 -53.93 6.43 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.564 -1.653 . . . . 0.0 108.685 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 20' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' S' ' 20' ' ' LEU . 7.5 tp -59.78 -46.32 89.54 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 113.758 -1.565 . . . . 0.0 111.758 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.474 ' H ' ' HD3' ' S' ' 21' ' ' ARG . 3.4 mpt_? -44.48 -66.17 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.578 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.577 ' CD2' HD21 ' R' ' 51' ' ' LEU . 0.1 OUTLIER -35.59 -51.03 0.63 Allowed 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.862 179.527 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' S' ' 26' ' ' LEU . 30.7 t -67.76 -68.51 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.815 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' S' ' 23' ' ' VAL . 13.2 t0 -20.86 -54.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 124.248 0.968 . . . . 0.0 113.107 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.794 HD12 ' CE ' ' S' ' 42' ' ' MET . 1.7 mt -74.26 -47.58 34.2 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.778 -1.169 . . . . 0.0 109.695 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.677 HD21 HD12 ' S' ' 39' ' ' LEU . 0.2 OUTLIER -47.42 -16.73 0.06 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.409 -0.916 . . . . 0.0 110.974 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 27' ' ' LYS . . . . . 0.529 ' O ' ' N ' ' S' ' 29' ' ' ALA . 5.7 tptm -93.95 -73.53 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.591 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -46.33 -9.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.607 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 29' ' ' ALA . . . . . 0.529 ' N ' ' O ' ' S' ' 27' ' ' LYS . . . -91.72 -42.22 10.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.722 -1.191 . . . . 0.0 112.331 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 30' ' ' TYR . . . . . 0.425 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 28.1 t80 -43.78 -29.82 0.58 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 118.916 -1.114 . . . . 0.0 110.802 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -36.09 66.13 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.196 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 29.9 m120 -92.78 -7.17 47.27 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.656 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.418 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.7 OUTLIER 76.43 29.58 0.7 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.388 0.613 . . . . 0.0 110.249 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 34' ' ' LEU . . . . . 0.514 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.3 mm? -95.71 -14.25 23.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.999 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 35' ' ' HIS . . . . . 0.447 ' O ' HD13 ' S' ' 39' ' ' LEU . 36.8 p-80 -45.56 -33.72 2.93 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 113.813 -1.54 . . . . 0.0 113.334 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.46 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.9 mt -68.24 -64.58 1.77 Allowed Pre-proline 0 C--N 1.304 -1.378 0 C-N-CA 117.442 -1.703 . . . . 0.0 110.12 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.46 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.6 Cg_exo -47.42 -26.83 6.43 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 C-N-CA 120.524 0.816 . . . . 0.0 110.184 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.93 -37.65 34.12 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.429 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.677 HD12 HD21 ' S' ' 26' ' ' LEU . 0.4 OUTLIER -57.38 -27.29 62.18 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.695 179.865 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.4 5.91 39.92 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.45 -63.05 1.46 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 42' ' ' MET . . . . . 0.794 ' CE ' HD12 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -89.04 34.13 0.79 Allowed 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 118.578 -1.249 . . . . 0.0 112.397 -179.713 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 43' ' ' LEU . . . . . 0.482 ' CD1' ' O ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER 170.26 141.54 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.776 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.665 ' H ' ' CD ' ' S' ' 45' ' ' PRO . 0.3 OUTLIER -176.22 -32.19 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 115.972 1.842 . . . . 0.0 115.972 -179.699 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.665 ' CD ' ' H ' ' S' ' 44' ' ' THR . 24.6 Cg_endo -87.64 -102.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 121.609 1.539 . . . . 0.0 112.529 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 46' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' S' ' 50' ' ' ALA . 8.7 m-20 -49.74 -34.93 20.46 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 118.556 -1.258 . . . . 0.0 108.047 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -49.61 -61.63 2.0 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.507 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.63 -47.46 14.79 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.891 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -83.79 -65.83 0.96 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.478 -1.289 . . . . 0.0 113.009 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 50' ' ' ALA . . . . . 0.822 ' HB1' HH11 ' S' ' 54' ' ' ARG . . . -44.57 -46.5 9.98 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.417 -0.913 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 44.3 mt -45.98 -58.04 3.9 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 118.844 -1.142 . . . . 0.0 110.832 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.63 -54.15 18.28 Favored Glycine 0 N--CA 1.483 1.806 0 C-N-CA 118.84 -1.648 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.45 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.1 OUTLIER -43.14 -83.32 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -179.84 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.822 HH11 ' HB1' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -43.76 -63.7 0.8 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 58.8 t -45.13 -29.42 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.968 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.525 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -92.2 -36.9 13.01 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 118.18 -1.408 . . . . 0.0 112.21 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 0.965 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -62.99 -31.35 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 C-N-CA 115.419 -2.513 . . . . 0.0 105.064 179.876 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 58' ' ' VAL . . . . . 0.965 ' N ' HD13 ' S' ' 57' ' ' ILE . 31.3 t -62.0 -64.84 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 CA-C-N 114.879 -1.055 . . . . 0.0 108.19 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.8 -33.1 15.58 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.746 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -70.43 -54.11 13.7 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.559 -0.857 . . . . 0.0 111.719 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 61' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' S' ' 61' ' ' LEU . 31.5 mt -53.13 -24.18 9.87 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.681 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 tp -57.47 -38.89 75.25 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.045 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 . . . . . 0 N--CA 1.491 1.58 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.972 179.786 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 5.2 tttm . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 110.673 -0.121 . . . . 0.0 110.673 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' S' S ' 73' ' ' ASN . . . . . 0.408 ' O ' ' CB ' ' S' ' 74' ' ' GLU . 11.2 t-20 -113.99 -31.38 6.4 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.541 0.686 . . . . 0.0 109.638 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 74' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' S' ' 73' ' ' ASN . 2.9 pt-20 153.76 -58.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.042 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 75' ' ' LEU . . . . . 0.499 ' H ' ' HG ' ' S' ' 75' ' ' LEU . 0.3 OUTLIER -108.93 21.48 17.17 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 119.837 -0.745 . . . . 0.0 109.237 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 76' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' S' ' 77' ' ' ALA . . . -97.6 -49.19 1.85 Allowed Glycine 0 N--CA 1.492 2.396 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.436 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 77' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' S' ' 76' ' ' GLY . . . 175.94 97.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.517 0.675 . . . . 0.0 110.352 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.71 159.97 8.59 Favored Glycine 0 N--CA 1.482 1.713 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.809 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.503 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.6 OUTLIER -49.33 -38.0 11.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 CA-C-N 114.399 -0.901 . . . . 0.0 110.266 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.442 ' N ' HG13 ' S' ' 79' ' ' ILE . . . -38.44 -44.31 0.92 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.226 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 24.4 m -71.81 -43.75 65.09 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 122.082 0.944 . . . . 0.0 112.211 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 82' ' ' ILE . . . . . 0.408 HG13 ' H ' ' S' ' 82' ' ' ILE . 0.0 OUTLIER -81.33 12.31 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.26 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.503 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -126.25 -18.91 4.83 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 118.934 -1.106 . . . . 0.0 113.508 179.729 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 84' ' ' ARG . . . . . 0.516 ' C ' ' CD ' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -87.06 -19.99 27.79 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 118.254 -1.378 . . . . 0.0 109.05 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.0 -18.75 49.58 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.274 -1.441 . . . . 0.0 110.102 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t -84.35 -60.34 2.11 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.913 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.49 2.92 20.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.625 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 88' ' ' SER . . . . . 0.457 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.2 OUTLIER -55.79 -48.9 74.55 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.768 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 pp -46.88 -14.48 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.386 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 90' ' ' LYS . . . . . 0.457 ' N ' ' O ' ' S' ' 88' ' ' SER . 17.7 tptt -49.09 -52.89 23.09 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.64 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.49 -38.25 13.5 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.258 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 54.6 60.32 10.44 Favored Pre-proline 0 C--N 1.303 -1.424 0 C-N-CA 119.833 -0.747 . . . . 0.0 111.842 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -63.07 97.49 0.19 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 121.239 1.292 . . . . 0.0 110.667 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 94' ' ' VAL . . . . . 0.448 ' H ' HG23 ' S' ' 94' ' ' VAL . 2.9 t -56.75 -10.42 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.905 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -83.48 -24.09 31.92 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.548 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 96' ' ' LEU . . . . . 0.421 ' O ' ' N ' ' S' ' 99' ' ' TRP . 3.7 mp -84.29 -51.31 7.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.211 -0.996 . . . . 0.0 111.181 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.52 -32.82 3.6 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.95 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -82.13 -24.26 35.19 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.387 -0.925 . . . . 0.0 110.584 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.669 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 4.7 t90 -95.09 -63.54 1.16 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.256 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.511 ' O ' ' C ' ' S' ' 101' ' ' GLU . 2.0 mm? -35.58 -39.57 0.14 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.511 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -40.72 -41.47 1.54 Allowed 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 118.155 -1.418 . . . . 0.0 107.571 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.9 -28.09 23.0 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 113.756 -1.565 . . . . 0.0 112.652 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.669 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 3.3 t -84.03 -15.36 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 116.615 -2.034 . . . . 0.0 111.888 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 4.9 mt -99.8 -61.94 1.3 Allowed 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.826 -0.75 . . . . 0.0 111.913 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 105' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' S' ' 107' ' ' SER . 4.5 mm? -63.86 -75.21 0.08 Allowed 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.231 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -42.17 -23.44 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.731 -0.787 . . . . 0.0 110.841 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' S' S ' 107' ' ' SER . . . . . 0.477 ' N ' ' O ' ' S' ' 105' ' ' LEU . 19.6 p . . . . . 0 C--N 1.304 -1.371 0 CA-C-O 116.253 -1.832 . . . . 0.0 110.83 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 121.099 0.476 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -80.37 7.56 9.41 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.798 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.421 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.1 mp0 -84.97 -75.6 0.35 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.285 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 18' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' R' ' 18' ' ' GLU . 1.5 mp0 -46.16 -30.7 2.05 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 122.804 1.288 . . . . 0.0 108.466 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 19' ' ' TRP . . . . . 0.421 ' N ' ' C ' ' R' ' 17' ' ' GLN . 67.2 t-105 -55.61 -58.51 7.48 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 112.645 -2.07 . . . . 0.0 110.229 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.9 tp -50.06 -23.6 2.18 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.521 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.541 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mmt85 -71.68 -69.7 0.37 Allowed 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.813 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.541 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.41 -37.39 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.19 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 23' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t -74.24 -50.48 27.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.413 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' R' ' 21' ' ' ARG . 38.5 t70 -41.17 -72.87 0.05 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.567 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.445 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.2 OUTLIER -47.5 -44.85 25.81 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.579 -0.848 . . . . 0.0 111.13 -179.995 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.88 -56.91 7.4 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.149 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -62.54 -35.9 80.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -81.24 -7.58 59.59 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.886 -1.126 . . . . 0.0 112.537 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' R' ' 31' ' ' GLN . . . -99.94 -57.98 2.02 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.105 -1.038 . . . . 0.0 112.83 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 30' ' ' TYR . . . . . 0.419 ' C ' ' O ' ' R' ' 29' ' ' ALA . 0.2 OUTLIER -34.53 -27.67 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.859 -179.771 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 31' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' R' ' 29' ' ' ALA . 1.2 tt0 -54.84 -44.54 74.03 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.801 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -103.43 -76.48 0.59 Allowed 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.965 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 33' ' ' ASP . . . . . 0.738 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.8 OUTLIER 178.8 27.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.966 -1.094 . . . . 0.0 112.06 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 34' ' ' LEU . . . . . 0.865 HD22 ' N ' ' R' ' 34' ' ' LEU . 1.0 OUTLIER -99.61 -11.59 20.82 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.249 -0.981 . . . . 0.0 110.869 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 47.0 p-80 -59.25 -24.34 63.13 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.829 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' R' ' 36' ' ' LEU . 8.1 mt -76.13 -59.56 1.09 Allowed Pre-proline 0 C--N 1.303 -1.436 0 C-N-CA 118.018 -1.473 . . . . 0.0 110.81 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.5 Cg_exo -54.88 -36.29 91.2 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 N-CA-C 109.404 -1.037 . . . . 0.0 109.404 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.77 -43.84 95.21 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.619 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.5 OUTLIER -52.55 -34.25 49.37 Favored 'General case' 0 C--O 1.203 -1.344 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.628 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -74.12 5.75 4.09 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.316 -0.953 . . . . 0.0 111.542 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.01 -56.64 2.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.46 12.33 2.53 Favored 'General case' 0 N--CA 1.501 2.098 0 C-N-CA 117.429 -1.709 . . . . 0.0 112.841 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 43' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' R' ' 39' ' ' LEU . 2.2 pp 179.95 146.58 0.24 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.601 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -175.44 -38.07 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 116.075 -2.25 . . . . 0.0 116.14 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.601 ' HD2' ' H ' ' R' ' 44' ' ' THR . 41.4 Cg_endo -87.26 -109.43 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 121.444 1.429 . . . . 0.0 113.183 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 46' ' ' ASP . . . . . 0.43 ' H ' ' HB2' ' R' ' 45' ' ' PRO . 3.7 p-10 -54.48 -32.75 58.43 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 119.721 -0.791 . . . . 0.0 110.275 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.431 ' OE1' ' OE1' ' S' ' 47' ' ' GLU . 30.6 mt-10 -54.6 -64.6 0.78 Allowed 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.081 -1.047 . . . . 0.0 110.49 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.19 -38.32 11.75 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.171 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.52 -68.02 0.4 Allowed 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.351 -1.34 . . . . 0.0 111.938 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.499 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -65.84 -52.54 49.61 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.205 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 51' ' ' LEU . . . . . 0.499 ' C ' ' O ' ' R' ' 50' ' ' ALA . 3.2 tt -33.77 -48.89 0.3 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.526 -0.87 . . . . 0.0 110.357 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 52' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -64.85 -69.37 1.35 Allowed Glycine 0 N--CA 1.482 1.753 0 C-N-CA 119.564 -1.303 . . . . 0.0 110.104 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.449 ' C ' ' O ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -34.02 -69.14 0.1 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 122.319 1.057 . . . . 0.0 110.748 179.764 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.525 ' CD ' ' H ' ' R' ' 54' ' ' ARG . 0.1 OUTLIER -35.18 -63.82 0.31 Allowed 'General case' 0 C--N 1.286 -2.156 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.908 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 12.0 p -60.52 -19.24 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 C-N-CA 116.739 -1.984 . . . . 0.0 111.947 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.4 ' HG3' ' N ' ' R' ' 57' ' ' ILE . 0.0 OUTLIER -83.62 -38.07 22.06 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.38 -0.928 . . . . 0.0 112.422 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 1.029 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -81.83 -34.58 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.872 -179.639 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 1.029 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.8 p -69.31 -39.92 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 118.045 -1.462 . . . . 0.0 111.37 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.482 ' N ' HG13 ' R' ' 58' ' ' VAL . 3.3 pt-20 -72.2 -30.57 65.07 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 118.383 -1.327 . . . . 0.0 110.584 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -74.63 -47.47 31.91 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.609 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.53 -26.71 67.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.015 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 62' ' ' LEU . . . . . 0.462 ' O ' HD23 ' R' ' 62' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.425 0 C-N-CA 118.918 -1.113 . . . . 0.0 109.537 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.87 0.366 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' R' R ' 78' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 156.29 122.99 0.77 Allowed Glycine 0 N--CA 1.491 2.357 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.647 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.919 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -37.14 -32.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.622 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.446 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.66 -56.02 14.39 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.962 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 19.7 m -42.89 -50.2 5.79 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 82' ' ' ILE . . . . . 0.439 HD13 HG21 ' R' ' 82' ' ' ILE . 12.1 pt -71.0 -28.72 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 C-N-CA 119.0 -1.08 . . . . 0.0 113.02 -179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -61.02 -73.15 0.1 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 118.648 -1.221 . . . . 0.0 110.922 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -11.37 1.4 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.102 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 85' ' ' GLY . . . . . 0.405 ' N ' ' C ' ' R' ' 83' ' ' THR . . . -69.73 -28.76 71.7 Favored Glycine 0 N--CA 1.486 1.999 0 C-N-CA 119.775 -1.203 . . . . 0.0 110.99 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 40.2 t -150.32 57.24 0.95 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 118.603 -1.239 . . . . 0.0 112.197 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 87' ' ' ASN . . . . . 0.464 ' O ' ' CB ' ' R' ' 88' ' ' SER . 32.1 t-20 -94.36 -13.22 26.58 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 88' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER 75.1 -45.36 0.56 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.088 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.73 -25.93 65.89 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.55 -0.86 . . . . 0.0 111.302 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 90' ' ' LYS . . . . . 0.574 ' C ' ' H ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -48.9 -37.65 20.37 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.526 -1.27 . . . . 0.0 110.797 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' R' R ' 91' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' R' ' 92' ' ' ALA . . . -61.03 11.54 0.02 OUTLIER 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.032 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.704 ' HB3' ' HD3' ' R' ' 93' ' ' PRO . . . -31.34 -59.65 0.32 Allowed Pre-proline 0 N--CA 1.493 1.698 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 93' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' R' ' 92' ' ' ALA . 5.2 Cg_exo -51.31 95.28 0.03 OUTLIER 'Trans proline' 0 C--N 1.324 -0.763 0 C-N-CA 120.506 0.804 . . . . 0.0 110.725 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.13 -16.95 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.588 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.82 -28.62 67.73 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.362 -0.935 . . . . 0.0 111.274 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 4.3 mt -61.88 -41.05 97.4 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.481 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -55.86 -37.81 69.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.645 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.55 -29.37 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.6 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.436 ' CE3' HG21 ' R' ' 103' ' ' VAL . 3.0 t90 -99.2 -67.49 0.85 Allowed 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.362 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.704 ' CD1' HD13 ' R' ' 104' ' ' LEU . 1.3 mm? -38.6 -55.46 1.43 Allowed 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.545 ' C ' ' O ' ' R' ' 100' ' ' LEU . 12.7 pt-20 -33.24 -33.11 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.85 -1.14 . . . . 0.0 109.51 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 102' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' R' ' 100' ' ' LEU . 1.8 tm-20 -92.54 -32.41 14.85 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.802 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.577 ' N ' ' O ' ' R' ' 100' ' ' LEU . 9.8 t -80.81 -15.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 116.959 -1.896 . . . . 0.0 110.883 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 104' ' ' LEU . . . . . 0.704 HD13 ' CD1' ' R' ' 100' ' ' LEU . 1.8 tp -102.14 -55.25 2.52 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.937 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.16 -66.65 0.35 Allowed 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.983 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 26.2 tttt . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.503 -179.844 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 121.233 0.54 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -84.92 10.86 10.58 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.588 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.417 ' C ' ' N ' ' S' ' 19' ' ' TRP . 20.8 mt-30 -76.99 -92.11 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.047 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.581 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 0.4 OUTLIER -44.25 -27.45 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 122.164 0.983 . . . . 0.0 109.54 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 19' ' ' TRP . . . . . 0.417 ' N ' ' C ' ' S' ' 17' ' ' GLN . 32.8 t-105 -53.6 -48.64 69.07 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.627 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 20' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' S' ' 17' ' ' GLN . 1.2 tt -59.84 -36.1 76.14 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 113.253 -1.794 . . . . 0.0 111.016 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 1.4 mpt_? -58.17 -73.02 0.08 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.28 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.556 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -25.6 -50.67 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.78 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.402 ' N ' ' O ' ' S' ' 21' ' ' ARG . 30.6 t -68.89 -63.05 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.745 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' S' ' 24' ' ' ASP . 21.7 t0 -35.55 -60.65 0.5 Allowed 'General case' 0 N--CA 1.488 1.469 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.838 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.49 HD23 ' N ' ' S' ' 25' ' ' LEU . 2.7 mt -57.24 -57.09 14.16 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.161 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.456 HD11 HD11 ' S' ' 39' ' ' LEU . 0.6 OUTLIER -42.37 -25.05 0.07 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.243 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 27' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' S' ' 25' ' ' LEU . 3.3 mtpm? -82.45 -39.28 22.77 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.716 -1.194 . . . . 0.0 113.005 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -83.23 -20.7 34.08 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.42 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 29' ' ' ALA . . . . . 0.606 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -82.95 -32.78 26.95 Favored 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.703 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 30' ' ' TYR . . . . . 0.498 ' CD1' ' O ' ' S' ' 30' ' ' TYR . 0.0 OUTLIER -56.59 -32.53 65.33 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.004 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -47.67 77.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.878 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.57 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 19.9 m-20 -84.09 -41.96 16.6 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.781 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 22.1 t70 116.56 49.35 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.713 0 O-C-N 125.059 1.474 . . . . 0.0 109.393 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 34' ' ' LEU . . . . . 0.606 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.4 mm? -112.55 -14.0 13.26 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.996 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 35' ' ' HIS . . . . . 0.454 ' O ' HD13 ' S' ' 39' ' ' LEU . 15.6 p-80 -52.22 -13.39 0.33 Allowed 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.528 -1.215 . . . . 0.0 112.89 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.481 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.5 mt -80.87 -66.19 0.25 Allowed Pre-proline 0 N--CA 1.486 1.34 0 C-N-CA 118.217 -1.393 . . . . 0.0 110.093 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.481 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.0 Cg_exo -49.55 -29.04 17.82 Favored 'Trans proline' 0 C--N 1.322 -0.862 0 N-CA-C 109.961 -0.823 . . . . 0.0 109.961 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 38' ' ' LEU . . . . . 0.558 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.2 mp -71.25 -51.49 24.28 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.469 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.456 HD11 HD11 ' S' ' 26' ' ' LEU . 0.4 OUTLIER -44.57 -41.6 6.65 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.678 179.869 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -18.08 33.44 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.275 -0.97 . . . . 0.0 111.921 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 16.5 mt -94.25 -62.03 1.41 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.527 -0.869 . . . . 0.0 112.918 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 42' ' ' MET . . . . . 0.558 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.2 OUTLIER -81.46 10.55 5.6 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 117.927 -1.509 . . . . 0.0 111.781 -179.881 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.53 126.7 7.8 Favored 'General case' 0 N--CA 1.509 2.505 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.536 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.465 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -166.53 -42.53 0.0 OUTLIER Pre-proline 0 N--CA 1.499 2.018 0 C-N-CA 116.456 -2.098 . . . . 0.0 116.506 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' S' ' 44' ' ' THR . 43.7 Cg_endo -89.97 -105.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 120.771 0.98 . . . . 0.0 114.577 -179.494 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 46' ' ' ASP . . . . . 0.408 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 0.2 OUTLIER -57.33 -22.79 44.56 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.94 -179.732 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 47' ' ' GLU . . . . . 0.475 ' OE2' HD12 ' R' ' 51' ' ' LEU . 5.0 mm-40 -56.97 -61.3 2.54 Favored 'General case' 0 C--N 1.296 -1.741 0 C-N-CA 118.534 -1.266 . . . . 0.0 109.315 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 4.8 mmt85 -55.2 -33.07 62.73 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.936 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -82.67 -66.67 0.86 Allowed 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 118.405 -1.318 . . . . 0.0 114.365 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 50' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -50.49 -41.15 52.97 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 51' ' ' LEU . . . . . 0.768 HD12 ' N ' ' S' ' 52' ' ' GLY . 3.7 pp -64.52 -42.25 95.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 117.456 -1.697 . . . . 0.0 111.333 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 52' ' ' GLY . . . . . 0.768 ' N ' HD12 ' S' ' 51' ' ' LEU . . . -55.45 -44.53 85.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 107.632 -2.187 . . . . 0.0 107.632 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.2 OUTLIER -46.71 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.921 -1.139 . . . . 0.0 113.096 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.681 ' HA ' HG23 ' S' ' 57' ' ' ILE . 3.9 ppt_? -48.39 -37.48 17.03 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 119.17 -1.012 . . . . 0.0 113.442 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 55' ' ' VAL . . . . . 0.428 HG22 ' NH2' ' S' ' 54' ' ' ARG . 35.2 t -57.6 -28.69 32.46 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.864 0 C-N-CA 117.841 -1.544 . . . . 0.0 109.192 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -83.15 -33.23 26.3 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 1.017 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -82.57 -29.58 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.105 0 C-N-CA 117.489 -1.684 . . . . 0.0 108.041 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 58' ' ' VAL . . . . . 1.017 ' N ' HD13 ' S' ' 57' ' ' ILE . 10.2 t -63.28 -48.99 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.81 -43.04 98.72 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.91 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.35 -45.76 92.32 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.021 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 97.7 mt -74.72 -31.83 61.96 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.15 -1.02 . . . . 0.0 113.131 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 12.8 tp -77.05 -43.08 35.84 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 118.419 -1.313 . . . . 0.0 112.272 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.297 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 72' ' ' LYS . . . . . 0.429 ' C ' ' H ' ' S' ' 74' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 73' ' ' ASN . . . . . 0.661 ' O ' ' N ' ' S' ' 75' ' ' LEU . 0.7 OUTLIER -90.5 26.2 2.05 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 122.097 0.951 . . . . 0.0 108.671 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 74' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' S' ' 76' ' ' GLY . 1.0 OUTLIER 39.6 -71.22 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 112.586 -2.097 . . . . 0.0 112.722 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 75' ' ' LEU . . . . . 0.661 ' N ' ' O ' ' S' ' 73' ' ' ASN . 0.8 OUTLIER -40.78 -21.3 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.789 -179.981 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 76' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' S' ' 74' ' ' GLU . . . -84.01 -65.44 1.54 Allowed Glycine 0 N--CA 1.487 2.081 0 C-N-CA 119.678 -1.249 . . . . 0.0 110.348 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.03 -103.11 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.897 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 78' ' ' GLY . . . . . 0.405 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . -164.49 146.49 11.43 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.844 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.0 OUTLIER -37.43 -39.09 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.886 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.9 -84.33 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -45.11 -19.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -179.625 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 82' ' ' ILE . . . . . 0.432 HD13 HG21 ' S' ' 82' ' ' ILE . 4.1 pt -102.12 6.34 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 C-N-CA 118.38 -1.328 . . . . 0.0 113.523 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 83' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -99.68 -13.41 19.35 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.778 -1.169 . . . . 0.0 112.302 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.56 -36.09 8.9 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.704 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.11 71.69 Favored Glycine 0 N--CA 1.49 2.273 0 C-N-CA 119.66 -1.257 . . . . 0.0 110.83 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.1 p -88.79 -50.03 6.47 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.076 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 87' ' ' ASN . . . . . 0.501 ' N ' ' OD1' ' S' ' 87' ' ' ASN . 1.4 p30 -87.63 -80.46 0.26 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.414 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 88' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' S' ' 87' ' ' ASN . 0.2 OUTLIER 73.09 -37.65 0.39 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.338 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 89' ' ' LEU . . . . . 0.484 ' H ' ' C ' ' S' ' 87' ' ' ASN . 4.7 mt -64.32 -10.41 23.97 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.149 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 90' ' ' LYS . . . . . 0.402 ' O ' ' C ' ' S' ' 91' ' ' ALA . 16.3 mmtm -75.0 -58.64 3.16 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.241 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 91' ' ' ALA . . . . . 0.729 ' O ' ' HB2' ' S' ' 92' ' ' ALA . . . -36.14 -78.42 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.181 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.762 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 92' ' ' ALA . . . . . 0.729 ' HB2' ' O ' ' S' ' 91' ' ' ALA . . . 161.15 -33.68 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.71 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 93' ' ' PRO . . . . . 0.617 ' HD2' ' H ' ' S' ' 92' ' ' ALA . 6.2 Cg_exo -58.89 95.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.325 -0.695 0 C-N-CA 120.524 0.816 . . . . 0.0 112.607 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 94' ' ' VAL . . . . . 0.6 HG23 ' O ' ' S' ' 92' ' ' ALA . 58.4 t -95.13 -18.24 6.79 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.423 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.15 -2.99 6.43 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 3.6 tp -82.53 -36.54 26.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.435 -0.906 . . . . 0.0 111.62 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -1.39 7.34 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.93 -0.708 . . . . 0.0 112.771 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -106.06 -0.41 24.85 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.629 ' CE2' HG21 ' S' ' 103' ' ' VAL . 5.7 t90 -112.53 -64.28 1.32 Allowed 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 114.17 -1.377 . . . . 0.0 113.467 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 1.114 HD22 ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -20.75 -82.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 119.058 2.984 . . . . 0.0 119.058 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 1.114 ' H ' HD22 ' S' ' 100' ' ' LEU . 0.0 OUTLIER -58.58 -43.66 89.53 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 119.15 -1.02 . . . . 0.0 109.071 -179.425 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 102' ' ' GLU . . . . . 0.416 ' H ' ' HG3' ' S' ' 101' ' ' GLU . 1.6 tm-20 -63.15 -18.39 63.41 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.629 HG21 ' CE2' ' S' ' 99' ' ' TRP . 0.5 OUTLIER -91.22 -54.13 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 C-N-CA 117.154 -1.819 . . . . 0.0 111.036 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' S' S ' 104' ' ' LEU . . . . . 0.503 ' N ' HG12 ' S' ' 103' ' ' VAL . 17.5 mt -51.98 -69.01 0.12 Allowed 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.442 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 8.1 mt -45.84 -74.46 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.888 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -43.49 -57.82 2.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.725 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 116.257 -1.83 . . . . 0.0 111.252 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 121.016 0.436 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -150.37 -3.26 0.36 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.421 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 17' ' ' GLN . . . . . 0.44 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.4 mt-30 -92.42 -79.52 0.39 Allowed 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.855 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 18' ' ' GLU . . . . . 0.674 ' CD ' ' H ' ' R' ' 18' ' ' GLU . 0.0 OUTLIER -48.57 -27.71 2.95 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.888 1.327 . . . . 0.0 107.779 179.817 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 19' ' ' TRP . . . . . 0.44 ' N ' ' C ' ' R' ' 17' ' ' GLN . 71.8 t-105 -51.62 -60.42 3.18 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 112.912 -1.949 . . . . 0.0 109.127 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -49.5 -31.61 10.47 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.404 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 21' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.3 mmt180 -61.91 -75.68 0.07 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 118.387 -1.325 . . . . 0.0 109.865 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 22' ' ' PHE . . . . . 0.503 ' CD2' HD11 ' S' ' 51' ' ' LEU . 8.7 t80 -36.32 -39.91 0.21 Allowed 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.404 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 23' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' R' ' 25' ' ' LEU . 46.6 t -73.05 -74.39 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.598 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 24' ' ' ASP . . . . . 0.437 ' C ' ' O ' ' R' ' 23' ' ' VAL . 29.8 t70 -37.85 -29.67 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.757 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 25' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' R' ' 23' ' ' VAL . 13.5 tp -70.54 -66.26 0.63 Allowed 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.142 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 26' ' ' LEU . . . . . 0.841 HD21 HG13 ' S' ' 23' ' ' VAL . 5.5 tp -48.11 -56.25 8.27 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.372 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 27' ' ' LYS . . . . . 0.414 ' NZ ' ' CE1' ' S' ' 30' ' ' TYR . 0.1 OUTLIER -41.37 -57.13 2.26 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.256 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -78.35 -5.55 52.52 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.554 -0.858 . . . . 0.0 112.353 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 29' ' ' ALA . . . . . 0.417 ' O ' ' N ' ' R' ' 33' ' ' ASP . . . -83.24 -51.26 7.61 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.829 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 30' ' ' TYR . . . . . 0.418 ' O ' ' N ' ' R' ' 33' ' ' ASP . 24.0 t80 -41.23 -67.3 0.26 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.155 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -45.95 -25.82 0.61 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.653 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 32' ' ' ASN . . . . . 0.518 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 4.7 t-20 -93.19 -23.48 18.55 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.296 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 33' ' ' ASP . . . . . 0.518 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 3.3 t0 85.69 23.09 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 123.695 0.622 . . . . 0.0 111.346 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 34' ' ' LEU . . . . . 0.484 ' N ' ' CD2' ' R' ' 34' ' ' LEU . 0.6 OUTLIER -104.27 -13.37 16.18 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.679 0.752 . . . . 0.0 109.003 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 35' ' ' HIS . . . . . 0.413 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 27.1 p-80 -49.38 -24.88 2.13 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 114.301 -1.318 . . . . 0.0 113.007 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.2 mt -77.83 -64.33 0.42 Allowed Pre-proline 0 N--CA 1.484 1.235 0 C-N-CA 118.081 -1.447 . . . . 0.0 110.893 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 37' ' ' PRO . . . . . 0.525 ' O ' HD13 ' R' ' 41' ' ' LEU . 2.2 Cg_endo -53.83 -23.9 28.95 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 N-CA-C 109.978 -0.816 . . . . 0.0 109.978 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 38' ' ' LEU . . . . . 0.468 HD22 HD21 ' R' ' 25' ' ' LEU . 78.0 mt -83.9 -33.09 24.84 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.155 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 39' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 43' ' ' LEU . 1.0 OUTLIER -56.43 -32.53 64.97 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.814 179.752 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.77 3.52 25.49 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.792 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 41' ' ' LEU . . . . . 0.525 HD13 ' O ' ' R' ' 37' ' ' PRO . 4.9 mp -105.6 -65.17 1.08 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.255 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 42' ' ' MET . . . . . 0.512 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -94.65 37.59 1.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.23 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 43' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 39' ' ' LEU . 1.1 tp 179.31 127.06 0.07 Allowed 'General case' 0 N--CA 1.505 2.294 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 44' ' ' THR . . . . . 0.684 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.93 -39.22 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.669 0 C-N-CA 117.639 -1.624 . . . . 0.0 115.251 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 45' ' ' PRO . . . . . 0.684 ' HD2' ' H ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -76.14 -95.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.288 0 C-N-CA 120.814 1.009 . . . . 0.0 112.165 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 46' ' ' ASP . . . . . 0.542 ' O ' ' HB3' ' R' ' 50' ' ' ALA . 0.8 OUTLIER -55.86 -6.89 0.25 Allowed 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 118.804 -1.158 . . . . 0.0 109.454 -179.857 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 47' ' ' GLU . . . . . 0.605 ' OE2' ' CH2' ' S' ' 19' ' ' TRP . 25.2 tt0 -72.11 -79.92 0.07 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.044 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 48' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' R' ' 47' ' ' GLU . 9.7 mmm-85 -43.04 -24.59 0.07 Allowed 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.104 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 49' ' ' GLU . . . . . 0.486 ' N ' ' O ' ' R' ' 47' ' ' GLU . 5.4 mt-10 -88.57 -68.23 0.78 Allowed 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.648 -1.221 . . . . 0.0 111.822 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 50' ' ' ALA . . . . . 0.542 ' HB3' ' O ' ' R' ' 46' ' ' ASP . . . -57.98 -60.55 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 51' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' S' ' 22' ' ' PHE . 2.4 mp -33.48 -62.9 0.27 Allowed 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.439 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.36 -47.38 35.3 Favored Glycine 0 N--CA 1.485 1.929 0 C-N-CA 118.74 -1.695 . . . . 0.0 109.416 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 53' ' ' THR . . . . . 0.523 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -58.99 -81.22 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 54' ' ' ARG . . . . . 0.451 ' HG2' ' H ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -34.04 -60.53 0.39 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.578 -179.802 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.04 -31.08 35.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 C-N-CA 118.136 -1.426 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 56' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' R' ' 53' ' ' THR . 22.2 mtp85 -80.73 -37.25 30.89 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.655 -1.218 . . . . 0.0 112.396 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 57' ' ' ILE . . . . . 0.955 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.45 -31.9 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 C-N-CA 116.801 -1.96 . . . . 0.0 108.297 -179.862 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 58' ' ' VAL . . . . . 0.955 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.7 t -61.96 -60.17 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 118.679 -1.208 . . . . 0.0 109.176 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 59' ' ' GLU . . . . . 0.443 ' N ' HG12 ' R' ' 58' ' ' VAL . 48.1 mt-10 -52.96 -34.88 57.8 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.808 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.73 -45.89 64.04 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.845 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 61' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' R' ' 61' ' ' LEU . 65.5 mt -84.82 0.24 51.54 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.563 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.699 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.878 0.37 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.76 145.23 7.27 Favored Glycine 0 N--CA 1.489 2.222 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.476 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 79' ' ' ILE . . . . . 0.901 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -44.75 -36.38 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.855 179.995 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 80' ' ' ALA . . . . . 0.539 ' O ' ' NH1' ' R' ' 84' ' ' ARG . . . -62.26 -31.44 72.01 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.511 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 81' ' ' THR . . . . . 0.508 ' C ' ' H ' ' R' ' 83' ' ' THR . 0.9 OUTLIER -86.6 -50.94 6.46 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.113 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -63.51 7.53 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.899 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 83' ' ' THR . . . . . 0.508 ' H ' ' C ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -91.54 -79.31 0.38 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.077 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 84' ' ' ARG . . . . . 0.814 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.58 -26.8 23.13 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.348 179.86 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.85 -44.69 81.53 Favored Glycine 0 N--CA 1.488 2.143 0 C-N-CA 119.343 -1.408 . . . . 0.0 109.924 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.23 -49.29 5.8 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.527 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 87' ' ' ASN . . . . . 0.424 ' OD1' ' N ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER -75.81 10.6 1.73 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.655 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 88' ' ' SER . . . . . 0.58 ' O ' ' HB3' ' R' ' 92' ' ' ALA . 0.5 OUTLIER -41.51 -27.29 0.09 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.423 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 89' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' R' ' 87' ' ' ASN . 5.6 mt -61.02 -68.6 0.29 Allowed 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.722 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 90' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' R' ' 91' ' ' ALA . 9.4 mmtp -69.5 -75.37 0.11 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.665 0.745 . . . . 0.0 112.622 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 91' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -30.69 -64.83 0.13 Allowed 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.664 -1.607 . . . . 0.0 112.89 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 92' ' ' ALA . . . . . 0.58 ' HB3' ' O ' ' R' ' 88' ' ' SER . . . -68.23 163.08 55.34 Favored Pre-proline 0 N--CA 1.49 1.527 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.774 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 93' ' ' PRO . . . . . 0.555 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.5 Cg_endo -59.23 131.58 41.91 Favored 'Trans proline' 0 C--N 1.32 -0.936 0 C-N-CA 121.656 1.571 . . . . 0.0 111.868 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 94' ' ' VAL . . . . . 0.448 ' C ' ' H ' ' R' ' 96' ' ' LEU . 96.7 t -78.78 -18.74 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.379 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.73 6.36 1.18 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.504 -0.878 . . . . 0.0 110.484 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 96' ' ' LEU . . . . . 0.448 ' H ' ' C ' ' R' ' 94' ' ' VAL . 2.2 tp -80.12 -33.55 38.57 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.717 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -63.63 -25.56 68.28 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.97 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.17 -26.42 68.32 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.863 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 99' ' ' TRP . . . . . 0.617 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.7 t90 -110.48 -62.36 1.53 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.372 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 100' ' ' LEU . . . . . 0.49 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -40.96 -33.03 0.27 Allowed 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 118.999 -1.08 . . . . 0.0 113.334 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 101' ' ' GLU . . . . . 0.49 ' C ' ' O ' ' R' ' 100' ' ' LEU . 6.7 mm-40 -43.76 -37.92 2.95 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 117.668 -1.613 . . . . 0.0 107.366 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 102' ' ' GLU . . . . . 0.405 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.2 mt-10 -90.81 -27.28 18.97 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.567 -1.651 . . . . 0.0 112.05 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 103' ' ' VAL . . . . . 0.617 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.1 t -93.52 -1.25 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 117.651 -1.62 . . . . 0.0 110.79 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 104' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' R' ' 100' ' ' LEU . 20.1 tp -108.22 -51.47 2.89 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.629 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' R' R ' 105' ' ' LEU . . . . . 0.68 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.4 OUTLIER -78.19 -28.52 48.16 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 118.845 -1.142 . . . . 0.0 111.73 -179.894 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttm . . . . . 0 N--CA 1.489 1.522 0 C-N-CA 118.937 -1.105 . . . . 0.0 110.583 -179.99 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 121.075 0.465 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' S' S ' 16' ' ' HIS . . . . . 0.409 ' H ' ' H ' ' S' ' 17' ' ' GLN . 26.3 t-80 -161.78 -12.54 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.606 -0.837 . . . . 0.0 110.637 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 17' ' ' GLN . . . . . 0.409 ' H ' ' H ' ' S' ' 16' ' ' HIS . 4.3 mt-30 -86.26 -85.69 0.15 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.499 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 18' ' ' GLU . . . . . 0.503 ' N ' ' CD ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -47.28 -33.6 5.77 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.901 -1.12 . . . . 0.0 108.116 179.791 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 19' ' ' TRP . . . . . 0.605 ' CH2' ' OE2' ' R' ' 47' ' ' GLU . 27.7 t-105 -51.34 -61.52 2.19 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.437 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 20' ' ' LEU . . . . . 0.439 ' O ' ' N ' ' S' ' 24' ' ' ASP . 1.3 mt -56.34 -41.72 76.55 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.511 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 21' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' S' ' 22' ' ' PHE . 20.4 mmt180 -44.15 -64.3 0.7 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.523 -1.271 . . . . 0.0 109.64 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 22' ' ' PHE . . . . . 0.549 ' O ' HD13 ' S' ' 26' ' ' LEU . 4.3 t80 -40.27 -40.39 1.13 Allowed 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 119.062 -1.055 . . . . 0.0 109.765 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 23' ' ' VAL . . . . . 0.841 HG13 HD21 ' R' ' 26' ' ' LEU . 45.1 t -80.56 -74.09 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 119.953 -0.699 . . . . 0.0 111.065 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 24' ' ' ASP . . . . . 0.511 ' O ' ' ND2' ' S' ' 28' ' ' ASN . 0.7 OUTLIER -36.63 -32.17 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.097 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 25' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' S' ' 23' ' ' VAL . 63.0 tp -73.54 -49.78 24.72 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.676 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 26' ' ' LEU . . . . . 0.562 HD11 ' CD1' ' S' ' 39' ' ' LEU . 1.4 mp -49.75 -59.78 3.5 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.931 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 27' ' ' LYS . . . . . 0.408 ' O ' ' NE2' ' S' ' 31' ' ' GLN . 0.4 OUTLIER -54.74 -21.39 10.8 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.603 -0.839 . . . . 0.0 113.244 -179.711 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 28' ' ' ASN . . . . . 0.511 ' ND2' ' O ' ' S' ' 24' ' ' ASP . 74.6 m-20 -89.89 -21.15 22.65 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 118.754 -1.179 . . . . 0.0 111.421 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 29' ' ' ALA . . . . . 0.602 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -95.42 -29.8 14.23 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.256 -0.978 . . . . 0.0 111.842 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 30' ' ' TYR . . . . . 0.414 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 6.9 t80 -46.83 -58.26 4.09 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 118.906 -1.118 . . . . 0.0 110.887 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 31' ' ' GLN . . . . . 0.595 ' CD ' ' H ' ' S' ' 31' ' ' GLN . 0.0 OUTLIER -56.6 -18.26 11.36 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.211 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 32' ' ' ASN . . . . . 0.442 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -98.69 -17.38 18.59 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.926 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 33' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.8 OUTLIER 78.73 27.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.608 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 34' ' ' LEU . . . . . 0.602 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.5 mm? -103.9 -13.76 16.25 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.017 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 35' ' ' HIS . . . . . 0.446 ' O ' HD13 ' S' ' 39' ' ' LEU . 24.8 p-80 -51.53 -24.63 5.46 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.387 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 36' ' ' LEU . . . . . 0.485 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.0 mt -70.64 -63.92 1.47 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 117.94 -1.504 . . . . 0.0 110.359 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 37' ' ' PRO . . . . . 0.485 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.6 Cg_endo -52.43 -33.67 57.93 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 120.719 0.946 . . . . 0.0 110.8 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.31 -41.28 63.73 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.02 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 39' ' ' LEU . . . . . 0.562 ' CD1' HD11 ' S' ' 26' ' ' LEU . 0.3 OUTLIER -51.55 -44.62 62.75 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.443 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.86 10.92 0.6 Allowed 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.608 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 41' ' ' LEU . . . . . 0.472 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.2 tp -106.87 -61.68 1.5 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.983 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 42' ' ' MET . . . . . 0.453 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 0.1 OUTLIER -100.16 39.34 1.35 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.196 -179.792 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 43' ' ' LEU . . . . . 0.479 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.3 OUTLIER 163.08 129.88 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 44' ' ' THR . . . . . 0.653 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.3 OUTLIER 178.7 -35.72 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.665 0 C-N-CA 117.469 -1.693 . . . . 0.0 115.298 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 45' ' ' PRO . . . . . 0.653 ' HD2' ' H ' ' S' ' 44' ' ' THR . 18.8 Cg_endo -78.89 -109.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 120.81 1.006 . . . . 0.0 112.793 -179.497 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.57 -15.97 43.7 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.016 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 47' ' ' GLU . . . . . 0.408 ' O ' ' CB ' ' S' ' 51' ' ' LEU . 45.5 mt-10 -70.48 -57.4 4.82 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 119.334 -0.947 . . . . 0.0 110.298 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -55.09 -40.38 70.36 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.724 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.23 -66.14 0.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.147 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 50' ' ' ALA . . . . . 0.815 ' HA ' HG22 ' S' ' 53' ' ' THR . . . -63.13 -33.13 74.81 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.778 -1.169 . . . . 0.0 111.044 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 51' ' ' LEU . . . . . 0.525 ' O ' HG23 ' S' ' 55' ' ' VAL . 1.7 tt -50.42 -28.71 8.69 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 52' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' S' ' 50' ' ' ALA . . . -83.05 -39.14 10.35 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 112.695 -2.048 . . . . 0.0 114.002 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 53' ' ' THR . . . . . 0.815 HG22 ' HA ' ' S' ' 50' ' ' ALA . 0.5 OUTLIER -55.04 -60.46 3.34 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 116.039 -2.264 . . . . 0.0 108.309 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 54' ' ' ARG . . . . . 0.678 ' O ' HG23 ' S' ' 58' ' ' VAL . 3.0 ptp180 -48.56 -45.12 37.25 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.416 -1.314 . . . . 0.0 109.665 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 55' ' ' VAL . . . . . 0.525 HG23 ' O ' ' S' ' 51' ' ' LEU . 97.7 t -67.71 -21.91 27.8 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 C-N-CA 116.949 -1.9 . . . . 0.0 109.125 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 56' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' S' ' 53' ' ' THR . 2.4 ptt180 -83.29 -42.64 16.92 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 118.672 -1.211 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 57' ' ' ILE . . . . . 0.904 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -70.81 -31.93 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 115.99 -2.284 . . . . 0.0 105.745 -179.803 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 58' ' ' VAL . . . . . 0.904 ' N ' HD13 ' S' ' 57' ' ' ILE . 24.4 t -57.64 -63.83 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 118.541 -1.263 . . . . 0.0 108.307 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -43.79 -26.86 0.28 Allowed 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.205 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 60' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' S' ' 60' ' ' GLU . 0.0 OUTLIER -88.36 -32.92 18.14 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.585 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 61' ' ' LEU . . . . . 0.771 HD12 ' O ' ' S' ' 61' ' ' LEU . 0.5 OUTLIER -55.09 -20.79 10.66 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 117.254 -1.779 . . . . 0.0 106.623 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 62' ' ' LEU . . . . . 0.476 ' N ' ' C ' ' S' ' 60' ' ' GLU . 0.6 OUTLIER -78.28 30.14 0.18 Allowed 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.874 -1.512 . . . . 0.0 107.736 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 63' ' ' ARG . . . . . 0.578 ' H ' ' C ' ' S' ' 61' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 73' ' ' ASN . . . . . 0.406 ' HB3' ' H ' ' S' ' 74' ' ' GLU . 0.5 OUTLIER -125.92 -92.13 0.51 Allowed 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.22 -1.355 . . . . 0.0 109.318 179.524 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 74' ' ' GLU . . . . . 0.441 ' HG3' ' H ' ' S' ' 75' ' ' LEU . 0.0 OUTLIER -171.75 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.301 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.87 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 75' ' ' LEU . . . . . 0.441 ' H ' ' HG3' ' S' ' 74' ' ' GLU . 1.7 tm? -112.99 -15.98 12.75 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -46.8 -59.86 5.24 Favored Glycine 0 N--CA 1.479 1.526 0 C-N-CA 119.307 -1.425 . . . . 0.0 109.834 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.0 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 117.443 -1.703 . . . . 0.0 114.714 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.62 134.74 6.75 Favored Glycine 0 N--CA 1.501 2.968 0 N-CA-C 106.717 -2.553 . . . . 0.0 106.717 -179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 79' ' ' ILE . . . . . 0.564 ' O ' ' N ' ' S' ' 81' ' ' THR . 0.0 OUTLIER -56.97 -34.96 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 C-N-CA 118.397 -1.321 . . . . 0.0 112.95 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 80' ' ' ALA . . . . . 0.495 ' C ' ' O ' ' S' ' 79' ' ' ILE . . . -35.3 -31.08 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.366 -0.934 . . . . 0.0 109.378 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 81' ' ' THR . . . . . 0.564 ' N ' ' O ' ' S' ' 79' ' ' ILE . 0.2 OUTLIER -78.16 -60.39 2.39 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 114.299 -1.318 . . . . 0.0 111.344 179.683 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 82' ' ' ILE . . . . . 0.405 ' H ' HG23 ' S' ' 82' ' ' ILE . 1.5 pt -63.62 -10.91 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.66 -51.02 15.52 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.2 -1.8 . . . . 0.0 109.549 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 84' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 85' ' ' GLY . 1.8 mpt_? -48.93 -70.88 0.08 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.027 0.918 . . . . 0.0 110.669 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 85' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' S' ' 84' ' ' ARG . . . -20.11 -55.84 0.01 OUTLIER Glycine 0 N--CA 1.487 2.073 0 CA-C-N 113.017 -1.901 . . . . 0.0 114.346 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 86' ' ' SER . . . . . 0.572 ' C ' ' H ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -86.39 -61.83 1.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 118.215 -1.394 . . . . 0.0 112.905 -179.776 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -56.73 5.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.235 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 88' ' ' SER . . . . . 0.572 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -52.61 -36.33 56.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.849 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 89' ' ' LEU . . . . . 0.914 ' H ' HD12 ' S' ' 89' ' ' LEU . 2.4 mp -75.46 -54.21 7.41 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.957 -1.097 . . . . 0.0 110.872 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 90' ' ' LYS . . . . . 0.464 ' O ' ' C ' ' S' ' 91' ' ' ALA . 23.8 mttt -45.28 -64.05 0.8 Allowed 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.67 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 91' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' S' ' 92' ' ' ALA . . . -23.76 -66.76 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 113.676 -1.602 . . . . 0.0 112.914 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 92' ' ' ALA . . . . . 0.675 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . 178.39 -51.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.52 0 C-N-CA 118.792 -1.163 . . . . 0.0 113.181 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 93' ' ' PRO . . . . . 0.675 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 5.6 Cg_exo -58.36 97.51 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.829 0 C-N-CA 120.66 0.906 . . . . 0.0 111.807 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 94' ' ' VAL . . . . . 0.457 ' O ' HG12 ' S' ' 94' ' ' VAL . 28.8 t -110.86 -12.4 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -78.14 -28.81 48.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.209 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 96' ' ' LEU . . . . . 0.434 HD22 HD21 ' R' ' 38' ' ' LEU . 71.3 mt -46.55 -33.3 4.0 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.719 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.76 -36.95 85.57 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.771 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -65.31 -31.34 72.42 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.659 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 99' ' ' TRP . . . . . 0.541 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 14.2 t90 -86.8 -58.73 2.49 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.988 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 100' ' ' LEU . . . . . 0.519 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -36.72 -38.29 0.17 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.352 -0.939 . . . . 0.0 112.929 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 101' ' ' GLU . . . . . 0.519 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.8 mt-10 -41.43 -44.82 2.97 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 102' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' S' ' 99' ' ' TRP . 1.8 tt0 -75.8 -33.77 60.15 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.493 -1.685 . . . . 0.0 111.49 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 103' ' ' VAL . . . . . 0.541 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 3.6 t -85.16 -52.63 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 116.881 -1.928 . . . . 0.0 111.707 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' S' S ' 104' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' S' ' 100' ' ' LEU . 0.9 OUTLIER -56.54 -57.3 12.94 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.935 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 95.1 mt -51.13 -68.11 0.2 Allowed 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.445 -1.302 . . . . 0.0 110.473 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mttp -44.85 -56.86 4.16 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.651 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 116.399 -1.762 . . . . 0.0 110.848 179.99 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 4.4 m -147.43 71.47 11.81 Favored Pre-proline 0 N--CA 1.489 1.48 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.338 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -67.4 133.45 30.28 Favored 'Trans proline' 0 C--N 1.314 -1.289 0 C-N-CA 121.68 1.586 . . . . 0.0 111.977 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -89.6 89.64 7.91 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.103 -1.039 . . . . 0.0 110.754 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 7.8 t 54.87 52.64 11.64 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.526 -0.87 . . . . 0.0 110.55 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . 51.73 -144.41 0.59 Allowed 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.477 -0.889 . . . . 0.0 110.325 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -144.82 169.5 17.92 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.757 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 11.7 mtm -85.91 90.24 8.01 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.135 -1.026 . . . . 0.0 110.437 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.95 150.96 22.99 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.89 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -80.43 -49.7 11.09 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.47 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -72.49 179.42 3.5 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.366 -0.934 . . . . 0.0 111.454 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 -82.96 104.53 13.24 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 119.342 -0.943 . . . . 0.0 111.306 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -144.21 -11.08 0.64 Allowed 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.18 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -90.09 -72.38 0.57 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -49.26 -35.28 17.24 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -51.05 -62.52 1.56 Allowed 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 113.628 -1.624 . . . . 0.0 107.2 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tp -45.79 -38.09 6.76 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 112.938 -1.937 . . . . 0.0 110.316 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' R' ' 22' ' ' PHE . 26.5 mmt180 -55.93 -66.42 0.43 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 117.17 -1.812 . . . . 0.0 107.69 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.454 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -39.35 -43.24 1.15 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.068 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 23' ' ' VAL . . . . . 0.463 ' O ' ' N ' ' R' ' 26' ' ' LEU . 40.4 t -68.11 -70.67 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 119.384 -0.927 . . . . 0.0 111.108 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' R' ' 23' ' ' VAL . 4.7 t0 -25.98 -48.83 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.19 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.689 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -77.3 -45.71 25.34 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 117.017 -1.873 . . . . 0.0 109.322 -179.923 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 26' ' ' LEU . . . . . 0.662 HD12 ' C ' ' R' ' 26' ' ' LEU . 0.2 OUTLIER -47.12 -52.74 14.57 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.101 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 27' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' R' ' 29' ' ' ALA . 18.4 tptm -66.95 -68.46 0.37 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.103 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -41.86 -20.51 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.241 -0.984 . . . . 0.0 112.071 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.487 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -83.59 -54.22 5.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -43.79 -25.97 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.939 -1.104 . . . . 0.0 110.346 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 31' ' ' GLN . . . . . 0.413 ' N ' ' C ' ' R' ' 29' ' ' ALA . 2.6 tt0 -50.8 -41.92 57.63 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.548 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -106.1 -72.17 0.72 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.813 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 33' ' ' ASP . . . . . 0.631 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.7 OUTLIER 170.7 17.43 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.049 -1.06 . . . . 0.0 112.881 -179.746 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 34' ' ' LEU . . . . . 1.022 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.0 OUTLIER -92.69 -10.53 36.86 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.251 -1.379 . . . . 0.0 110.614 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 35' ' ' HIS . . . . . 0.444 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 11.0 p-80 -44.47 -30.88 0.94 Allowed 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.446 -0.901 . . . . 0.0 112.929 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 36' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.68 -58.11 5.96 Favored Pre-proline 0 N--CA 1.487 1.409 0 C-N-CA 117.884 -1.526 . . . . 0.0 109.906 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 37' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.18 -29.98 89.15 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 C-N-CA 119.923 0.415 . . . . 0.0 111.618 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.53 -45.97 34.91 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.694 -0.803 . . . . 0.0 109.283 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 43' ' ' LEU . 0.2 OUTLIER -45.87 -44.15 14.2 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.777 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 40' ' ' ASN . . . . . 0.529 ' O ' ' N ' ' R' ' 109' ' ' TRP . 1.2 m120 -70.21 -16.48 63.07 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.16 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tp -78.62 -48.61 14.76 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.738 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.13 47.39 2.42 Favored 'General case' 0 N--CA 1.511 2.593 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.512 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 43' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER 173.26 117.47 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.387 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.614 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -35.86 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.513 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.614 ' CD ' ' H ' ' R' ' 44' ' ' THR . 32.9 Cg_endo -80.91 -101.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.363 0 C-N-CA 121.154 1.236 . . . . 0.0 114.197 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -53.44 -18.92 3.02 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.516 ' OE2' ' NH1' ' S' ' 54' ' ' ARG . 0.4 OUTLIER -63.76 -65.74 0.64 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.395 -1.73 . . . . 0.0 109.832 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 48' ' ' ARG . . . . . 0.461 ' NH2' ' O ' ' S' ' 15' ' ' ARG . 2.7 mmm180 -51.62 -30.56 21.88 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 118.773 -1.171 . . . . 0.0 110.912 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 49' ' ' GLU . . . . . 0.435 ' O ' ' OG1' ' R' ' 53' ' ' THR . 4.6 mt-10 -82.89 -72.81 0.43 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -62.19 -43.03 99.74 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 51' ' ' LEU . . . . . 0.678 ' C ' HD12 ' R' ' 51' ' ' LEU . 0.2 OUTLIER -58.51 -46.84 85.92 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 117.986 -1.486 . . . . 0.0 111.248 -179.802 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 52' ' ' GLY . . . . . 0.413 ' N ' ' HG ' ' R' ' 51' ' ' LEU . . . -53.95 -59.26 10.14 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 107.496 -2.241 . . . . 0.0 107.496 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.528 ' O ' HG23 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -34.3 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.183 -1.008 . . . . 0.0 112.239 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.459 ' O ' HG12 ' R' ' 58' ' ' VAL . 0.0 OUTLIER -41.77 -56.42 2.68 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.644 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 14.9 p -67.01 -18.86 24.87 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 114.956 -2.698 . . . . 0.0 110.548 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' R' ' 60' ' ' GLU . 0.0 OUTLIER -93.02 -29.38 15.85 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 118.016 -1.474 . . . . 0.0 112.418 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 0.67 HD12 ' C ' ' R' ' 57' ' ' ILE . 0.2 OUTLIER -76.31 -41.43 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 115.663 -2.415 . . . . 0.0 106.872 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 0.609 HG13 ' N ' ' R' ' 59' ' ' GLU . 7.3 p -66.33 -52.94 41.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 117.391 -1.724 . . . . 0.0 110.822 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.609 ' N ' HG13 ' R' ' 58' ' ' VAL . 5.7 tt0 -64.03 -12.99 43.57 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.33 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 60' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' R' ' 56' ' ' ARG . 3.4 mm-40 -78.97 -52.3 8.44 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.739 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 61' ' ' LEU . . . . . 0.464 ' C ' ' H ' ' R' ' 63' ' ' ARG . 2.1 pp -89.4 -25.85 21.33 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.067 -1.453 . . . . 0.0 111.554 -179.753 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp -77.8 22.92 0.26 Allowed 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 118.321 -1.351 . . . . 0.0 110.696 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 63' ' ' ARG . . . . . 0.464 ' H ' ' C ' ' R' ' 61' ' ' LEU . 20.1 ttt180 -114.58 -47.02 2.92 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.846 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.71 -88.56 1.83 Allowed Glycine 0 N--CA 1.494 2.555 0 C-N-CA 119.451 -1.357 . . . . 0.0 109.715 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 65' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -143.62 -54.55 0.37 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.565 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 66' ' ' MET . . . . . 0.446 ' O ' ' CB ' ' R' ' 67' ' ' SER . 5.5 ttm -159.97 178.97 9.18 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.422 -0.911 . . . . 0.0 111.053 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 67' ' ' SER . . . . . 0.446 ' CB ' ' O ' ' R' ' 66' ' ' MET . 1.3 t 163.62 86.67 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.834 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 68' ' ' GLN . . . . . 0.512 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.4 OUTLIER -124.89 -24.65 4.04 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.941 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -72.36 28.98 0.05 Allowed 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.733 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 70' ' ' GLU . . . . . 0.512 ' H ' ' C ' ' R' ' 68' ' ' GLN . 26.0 mt-10 -85.56 1.33 49.48 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.183 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 tp 61.39 147.39 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.142 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -42.62 128.27 4.0 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.119 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 73' ' ' ASN . . . . . 0.61 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.5 OUTLIER -96.73 10.56 38.38 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.81 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 74' ' ' GLU . . . . . 0.444 ' O ' ' N ' ' R' ' 76' ' ' GLY . 23.5 mm-40 40.55 -75.02 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 110.926 -2.852 . . . . 0.0 112.231 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.61 ' N ' ' O ' ' R' ' 73' ' ' ASN . 6.3 mt -42.67 -22.75 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 113.384 -1.735 . . . . 0.0 110.845 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 76' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' R' ' 74' ' ' GLU . . . -102.54 -61.17 0.73 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.96 -94.56 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.54 1.01 46.76 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.867 -1.159 . . . . 0.0 113.958 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.845 ' H ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -122.11 -72.98 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.824 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.534 ' O ' ' N ' ' R' ' 82' ' ' ILE . . . -102.34 -71.28 0.72 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 81' ' ' THR . . . . . 0.647 ' HG1' ' HE1' ' R' ' 1' ' ' TRP . 0.6 OUTLIER -37.09 -21.13 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 82' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -79.75 -31.26 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 118.118 -1.433 . . . . 0.0 112.389 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.35 19.71 16.14 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.671 ' NE ' ' CE2' ' R' ' 1' ' ' TRP . 0.1 OUTLIER -93.46 -39.74 10.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 117.575 -1.65 . . . . 0.0 107.804 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 85' ' ' GLY . . . . . 0.418 ' N ' ' CD ' ' R' ' 84' ' ' ARG . . . -40.57 -24.72 0.08 OUTLIER Glycine 0 N--CA 1.481 1.699 0 CA-C-N 113.48 -1.691 . . . . 0.0 110.561 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 86' ' ' SER . . . . . 0.478 ' N ' ' O ' ' R' ' 84' ' ' ARG . 1.8 t -81.48 -70.3 0.55 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.281 -0.968 . . . . 0.0 110.312 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -60.26 -3.59 0.65 Allowed 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.97 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 88' ' ' SER . . . . . 0.477 ' HA ' ' HB3' ' R' ' 91' ' ' ALA . 0.6 OUTLIER -48.48 -26.73 2.29 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.98 -1.088 . . . . 0.0 110.698 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -41.18 -42.12 1.98 Allowed 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.957 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.97 -50.26 3.03 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.799 0.809 . . . . 0.0 110.399 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 91' ' ' ALA . . . . . 0.477 ' HB3' ' HA ' ' R' ' 88' ' ' SER . . . -39.26 -55.34 1.71 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.351 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -63.45 162.77 23.44 Favored Pre-proline 0 N--CA 1.489 1.503 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.814 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 93' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 1.5 Cg_endo -56.82 170.04 1.58 Allowed 'Trans proline' 0 C--N 1.316 -1.143 0 C-N-CA 121.02 1.146 . . . . 0.0 111.593 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 94' ' ' VAL . . . . . 0.445 ' C ' ' H ' ' R' ' 96' ' ' LEU . 79.5 t -93.98 -31.08 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.797 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.47 3.6 0.93 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.894 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 96' ' ' LEU . . . . . 0.486 HD13 ' HG2' ' R' ' 93' ' ' PRO . 1.3 tp -84.69 -44.93 12.95 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.593 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -59.07 -24.32 62.8 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.764 -0.775 . . . . 0.0 109.543 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -63.25 -40.08 96.41 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.435 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.635 ' CE3' HG21 ' R' ' 103' ' ' VAL . 7.3 t90 -101.2 -60.04 1.59 Allowed 'General case' 0 N--CA 1.512 2.672 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.327 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -43.67 -19.74 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 118.386 -1.325 . . . . 0.0 113.57 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.455 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.2 mm-40 -53.23 -37.13 61.79 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.418 ' N ' ' C ' ' R' ' 100' ' ' LEU . 3.7 mt-10 -86.81 -37.66 17.57 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 111.622 -2.535 . . . . 0.0 114.556 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.635 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.0 t -82.62 -9.53 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 116.08 -2.248 . . . . 0.0 111.69 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 tp -94.37 -56.2 2.9 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.12 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 105' ' ' LEU . . . . . 0.654 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.4 OUTLIER -68.3 -27.17 66.06 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.847 -1.141 . . . . 0.0 111.548 -179.643 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -60.38 -40.12 89.73 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 119.111 -1.036 . . . . 0.0 110.438 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 116.326 -1.797 . . . . 0.0 110.415 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' S' S ' 5' ' ' SER . . . . . 0.537 ' N ' ' CD ' ' S' ' 6' ' ' PRO . 0.2 OUTLIER -81.98 -41.82 1.01 Allowed Pre-proline 0 N--CA 1.485 1.306 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.764 179.914 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 6' ' ' PRO . . . . . 0.537 ' CD ' ' N ' ' S' ' 5' ' ' SER . 2.0 Cg_endo -74.74 148.64 36.84 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 120.471 0.781 . . . . 0.0 111.86 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 43.1 t80 54.06 80.14 0.12 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.975 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -153.73 -57.19 0.12 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.696 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -147.16 -2.1 0.62 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.87 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -84.88 65.82 9.37 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.28 -0.968 . . . . 0.0 110.54 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 36.7 mtt -92.25 115.13 27.81 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.423 -0.911 . . . . 0.0 110.688 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -171.28 103.08 0.21 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.554 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 13' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' S' ' 15' ' ' ARG . 0.4 OUTLIER -155.32 71.51 0.78 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 118.981 -1.088 . . . . 0.0 111.368 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -61.86 80.63 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.009 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 15' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' S' ' 13' ' ' GLU . 4.1 mtt180 -88.34 142.02 28.08 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.185 -1.006 . . . . 0.0 110.656 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -157.32 -0.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.223 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.444 ' C ' ' N ' ' S' ' 19' ' ' TRP . 6.1 mt-30 -95.4 -83.33 0.36 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.833 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' S' ' 17' ' ' GLN . 9.2 pt-20 -45.22 -30.52 1.23 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 19' ' ' TRP . . . . . 0.444 ' N ' ' C ' ' S' ' 17' ' ' GLN . 62.4 t-105 -55.89 -64.01 0.99 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.146 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 20' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' S' ' 24' ' ' ASP . 6.5 tp -48.14 -36.71 13.92 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.92 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' S' ' 22' ' ' PHE . 17.6 mmt180 -56.53 -67.39 0.31 Allowed 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 117.383 -1.727 . . . . 0.0 106.361 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.459 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -37.55 -47.29 0.91 Allowed 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.58 178.924 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.433 HG23 ' CD2' ' S' ' 22' ' ' PHE . 48.6 t -74.27 -74.7 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.594 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' S' ' 20' ' ' LEU . 14.3 t0 -37.1 -41.73 0.38 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.596 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.517 HD23 ' SD ' ' S' ' 42' ' ' MET . 58.6 tp -60.62 -53.11 61.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.07 -61.51 2.34 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.361 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 21.8 tptp -39.67 -53.97 2.1 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.047 -0.661 . . . . 0.0 112.572 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -65.97 -25.28 67.03 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.473 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 29' ' ' ALA . . . . . 0.549 ' HB1' HD13 ' S' ' 34' ' ' LEU . . . -82.99 -48.95 10.08 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.875 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 30' ' ' TYR . . . . . 0.485 ' CE2' ' NE2' ' S' ' 35' ' ' HIS . 9.4 t80 -42.09 -21.7 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.916 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 31' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' S' ' 29' ' ' ALA . 0.9 OUTLIER -69.63 -47.18 64.29 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.926 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.8 OUTLIER -74.72 -27.74 60.5 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.504 -0.879 . . . . 0.0 109.293 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.5 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 1.3 t70 86.49 50.72 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.479 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 34' ' ' LEU . . . . . 0.58 ' CD1' ' N ' ' S' ' 34' ' ' LEU . 0.0 OUTLIER -136.08 14.62 3.3 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.708 1.242 . . . . 0.0 109.223 179.672 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 35' ' ' HIS . . . . . 0.485 ' NE2' ' CE2' ' S' ' 30' ' ' TYR . 31.1 p-80 -61.73 -19.15 62.11 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 112.904 -1.953 . . . . 0.0 111.526 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' S' ' 36' ' ' LEU . 7.8 mt -69.61 -59.01 5.09 Favored Pre-proline 0 N--CA 1.483 1.184 0 C-N-CA 118.894 -1.122 . . . . 0.0 109.213 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -54.31 -34.83 81.77 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 N-CA-C 110.115 -0.763 . . . . 0.0 110.115 179.109 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 38' ' ' LEU . . . . . 0.474 HD22 HD21 ' S' ' 25' ' ' LEU . 19.5 mt -72.13 -40.45 68.07 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 118.991 -1.084 . . . . 0.0 110.523 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.494 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.4 OUTLIER -50.61 -50.8 53.15 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-O 121.523 0.678 . . . . 0.0 109.315 179.644 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -56.49 -6.06 0.26 Allowed 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.349 -179.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 41' ' ' LEU . . . . . 0.501 ' CD1' HH22 ' R' ' 84' ' ' ARG . 1.8 tp -100.43 -67.87 0.84 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.901 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 42' ' ' MET . . . . . 0.517 ' SD ' HD23 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -70.6 -3.88 20.43 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.658 -1.217 . . . . 0.0 111.172 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 43' ' ' LEU . . . . . 0.448 ' O ' ' O ' ' S' ' 39' ' ' LEU . 1.5 mp -157.0 132.91 9.52 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.177 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.597 ' H ' ' CD ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -170.42 -30.45 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 115.916 -2.314 . . . . 0.0 116.407 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.597 ' CD ' ' H ' ' S' ' 44' ' ' THR . 34.1 Cg_endo -99.03 -102.97 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.398 0 CA-C-N 119.277 0.777 . . . . 0.0 113.701 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.44 -16.75 2.48 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 118.142 -1.423 . . . . 0.0 107.831 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 47' ' ' GLU . . . . . 0.457 ' N ' ' C ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -68.27 -67.48 0.46 Allowed 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.554 -1.203 . . . . 0.0 107.804 179.498 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.56 -33.81 0.5 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.927 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 49' ' ' GLU . . . . . 0.441 ' O ' ' OG1' ' S' ' 53' ' ' THR . 4.2 mt-10 -84.79 -67.83 0.77 Allowed 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 119.536 -0.866 . . . . 0.0 113.041 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 50' ' ' ALA . . . . . 0.574 ' HB1' HH12 ' S' ' 54' ' ' ARG . . . -45.88 -23.67 0.31 Allowed 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.195 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 51' ' ' LEU . . . . . 0.411 ' C ' ' N ' ' S' ' 53' ' ' THR . 4.2 mp -77.46 -56.74 4.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.086 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -21.63 4.07 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 118.635 -1.745 . . . . 0.0 109.434 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.441 ' OG1' ' O ' ' S' ' 49' ' ' GLU . 0.1 OUTLIER -73.64 -78.67 0.09 Allowed 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 114.173 -1.013 . . . . 0.0 111.007 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.574 HH12 ' HB1' ' S' ' 50' ' ' ALA . 23.3 mtt85 -41.58 -26.99 0.08 Allowed 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.742 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 98.7 t -80.0 -41.5 21.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 C-N-CA 119.022 -1.071 . . . . 0.0 108.845 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' S' ' 53' ' ' THR . 19.7 mtt180 -58.33 -50.61 73.01 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 116.993 -1.883 . . . . 0.0 107.34 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -66.57 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 C-N-CA 117.035 -1.866 . . . . 0.0 111.293 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 52.0 t -42.93 -64.45 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 C-N-CA 118.424 -1.31 . . . . 0.0 113.318 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -48.55 -46.7 39.23 Favored 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.985 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.74 -30.63 70.16 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 119.297 -0.961 . . . . 0.0 112.227 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.15 -27.46 69.39 Favored 'General case' 0 C--N 1.284 -2.252 0 C-N-CA 118.467 -1.293 . . . . 0.0 110.757 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 62' ' ' LEU . . . . . 0.624 HD13 HD21 ' S' ' 104' ' ' LEU . 4.9 mt -81.87 -62.91 1.5 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 116.479 2.029 . . . . 0.0 116.479 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -109.04 1.36 20.47 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.638 ' O ' ' N ' ' S' ' 66' ' ' MET . . . -110.35 21.23 24.51 Favored Glycine 0 C--N 1.295 -1.72 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 65' ' ' GLU . . . . . 0.55 ' C ' ' O ' ' S' ' 64' ' ' GLY . 75.3 mt-10 -20.3 -44.32 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 O-C-N 125.267 1.216 . . . . 0.0 110.014 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 66' ' ' MET . . . . . 0.638 ' N ' ' O ' ' S' ' 64' ' ' GLY . 4.3 mmt -55.63 108.26 0.42 Allowed 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 106.064 -1.828 . . . . 0.0 106.064 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 37.2 t -147.6 76.16 1.39 Allowed 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.427 ' C ' ' H ' ' S' ' 70' ' ' GLU . 18.8 pt20 -122.67 -37.95 2.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 109.498 -3.501 . . . . 0.0 111.287 179.447 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.02 30.6 1.06 Allowed 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 123.03 1.395 . . . . 0.0 107.873 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.473 ' O ' ' C ' ' S' ' 71' ' ' LEU . 5.5 mm-40 -137.06 -31.5 0.83 Allowed 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 112.818 -1.992 . . . . 0.0 113.782 -179.446 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 71' ' ' LEU . . . . . 0.473 ' C ' ' O ' ' S' ' 70' ' ' GLU . 10.4 mt -39.75 106.52 0.06 Allowed 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 113.772 -1.558 . . . . 0.0 110.465 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 72' ' ' LYS . . . . . 0.788 ' C ' ' H ' ' S' ' 74' ' ' GLU . 14.8 tttt 48.83 57.18 6.67 Favored 'General case' 0 N--CA 1.525 3.282 1 N-CA-C 122.063 4.097 . . . . 0.0 122.063 178.699 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . 0.26 0.2 OUTLIER -74.1 18.18 0.15 Allowed 'General case' 0 N--CA 1.519 2.989 0 O-C-N 118.418 -2.677 . . . . 0.0 108.844 179.455 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 74' ' ' GLU . . . . . 0.788 ' H ' ' C ' ' S' ' 72' ' ' LYS 0.363 0.0 OUTLIER 40.81 -51.1 0.0 OUTLIER 'General case' 1 N--CA 1.58 6.033 1 N-CA-C 126.846 5.869 . . . . 0.0 126.846 -171.986 . . . . . . . . 6 4 . 1 . 001 nuclear build full ' S' S ' 75' ' ' LEU . . . . . 0.501 HD12 ' N ' ' S' ' 76' ' ' GLY . 3.4 pp -91.29 -20.36 21.97 Favored 'General case' 0 C--N 1.267 -2.982 0 CA-C-N 118.796 0.725 . . . . 0.0 112.039 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 76' ' ' GLY . . . . . 0.501 ' N ' HD12 ' S' ' 75' ' ' LEU . . . -82.18 -16.38 72.03 Favored Glycine 1 N--CA 1.548 6.125 0 CA-C-N 112.728 -2.033 . . . . 0.0 115.106 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -136.72 -69.18 0.47 Allowed 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 115.923 -2.311 . . . . 0.0 113.344 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 78' ' ' GLY . . . . . 0.439 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 149.12 127.72 1.61 Allowed Glycine 0 CA--C 1.456 -3.644 1 N-CA-C 98.104 -5.999 . . . . 0.0 98.104 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.21 -22.61 27.71 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.211 1 C-N-CA 111.581 -4.047 . . . . 0.0 106.397 -178.572 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.478 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -63.66 -37.32 86.88 Favored 'General case' 0 N--CA 1.511 2.619 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' S' ' 78' ' ' GLY . 9.1 p -53.67 -55.94 21.62 Favored 'General case' 0 C--N 1.297 -1.683 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.296 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 82' ' ' ILE . . . . . 0.468 HG21 HD13 ' S' ' 82' ' ' ILE 0.37 0.3 OUTLIER -63.28 11.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 117.812 2.523 . . . . 0.0 117.812 -178.761 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -96.55 -62.28 1.29 Allowed 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 118.402 -1.319 . . . . 0.0 108.063 178.686 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 84' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -52.34 -23.7 6.34 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 118.357 -1.337 . . . . 0.0 109.006 179.241 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.63 -11.1 59.45 Favored Glycine 0 N--CA 1.498 2.825 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.386 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -100.49 -23.16 14.78 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 87' ' ' ASN . . . . . 0.462 ' C ' ' N ' ' S' ' 89' ' ' LEU . 4.5 m120 -105.49 -3.8 22.05 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.573 179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 88' ' ' SER . . . . . 0.51 ' N ' ' O ' ' S' ' 84' ' ' ARG . 0.2 OUTLIER -62.01 -15.6 45.36 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 89' ' ' LEU . . . . . 0.462 ' N ' ' C ' ' S' ' 87' ' ' ASN . 3.4 mt -71.72 -78.9 0.08 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.221 -1.809 . . . . 0.0 111.366 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -53.96 -66.61 0.36 Allowed 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.54 0.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 160.04 76.9 Favored Pre-proline 0 N--CA 1.501 2.085 0 C-N-CA 118.482 -1.287 . . . . 0.0 110.359 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -68.27 158.22 58.46 Favored 'Trans proline' 0 C--N 1.324 -0.723 0 N-CA-C 108.29 -1.465 . . . . 0.0 108.29 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 94' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' S' ' 96' ' ' LEU . 36.4 t -88.04 -65.12 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.353 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -45.37 -12.39 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 C-N-CA 119.065 -1.054 . . . . 0.0 112.783 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 96' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' S' ' 94' ' ' VAL . 0.9 OUTLIER -65.59 -34.95 79.42 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.04 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -54.08 -24.18 16.51 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.559 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -82.81 -28.92 29.9 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 118.516 -1.274 . . . . 0.0 110.814 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.712 ' CE3' HG21 ' S' ' 103' ' ' VAL . 6.2 t90 -90.34 -56.25 3.28 Favored 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.518 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.611 HD12 HD23 ' S' ' 104' ' ' LEU . 1.6 mm? -40.18 -31.58 0.14 Allowed 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 118.954 -1.098 . . . . 0.0 113.829 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.484 ' C ' ' O ' ' S' ' 100' ' ' LEU . 42.5 mt-10 -46.72 -39.7 12.05 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 105.02 -2.215 . . . . 0.0 105.02 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -86.01 -32.76 21.31 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 112.79 -2.004 . . . . 0.0 114.333 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.712 HG21 ' CE3' ' S' ' 99' ' ' TRP . 2.8 t -90.64 -2.43 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 116.64 -2.024 . . . . 0.0 113.125 -179.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 104' ' ' LEU . . . . . 0.624 HD21 HD13 ' S' ' 62' ' ' LEU . 0.2 OUTLIER -109.06 -49.36 3.14 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.92 -179.922 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' S' S ' 105' ' ' LEU . . . . . 0.433 ' N ' ' CD2' ' S' ' 105' ' ' LEU . 3.9 mm? -69.04 -64.2 0.91 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 118.832 -1.147 . . . . 0.0 109.602 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -57.83 10.49 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.646 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 116.371 -1.776 . . . . 0.0 109.858 -179.996 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.671 ' CE2' ' NE ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 116.429 -1.748 . . . . 0.0 109.664 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.529 ' N ' ' O ' ' R' ' 40' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 117.141 -1.409 . . . . 0.0 107.71 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.817 0.341 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' R' R ' 5' ' ' SER . . . . . 0.462 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.3 OUTLIER -60.57 -49.84 88.15 Favored Pre-proline 0 N--CA 1.486 1.33 0 C-N-CA 118.902 -1.119 . . . . 0.0 111.963 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 6' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' R' ' 5' ' ' SER . 6.1 Cg_endo -70.22 139.66 39.16 Favored 'Trans proline' 0 C--N 1.325 -0.696 0 C-N-CA 120.842 1.028 . . . . 0.0 111.164 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -87.24 117.3 25.9 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.906 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.11 146.24 41.56 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.351 -0.94 . . . . 0.0 111.042 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -172.34 95.31 0.14 Allowed 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.579 -0.848 . . . . 0.0 110.532 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.68 -176.53 1.05 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.078 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 11' ' ' MET . . . . . 0.46 ' N ' ' SD ' ' R' ' 11' ' ' MET . 0.8 OUTLIER -83.24 178.91 7.87 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.551 -0.86 . . . . 0.0 111.22 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.44 122.61 29.22 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.579 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -66.48 -37.1 84.37 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.133 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 51.85 83.71 0.05 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.587 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmm-85 -87.62 117.46 26.45 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.22 -0.992 . . . . 0.0 110.299 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -147.94 -2.2 0.55 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.934 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.416 ' C ' ' N ' ' R' ' 19' ' ' TRP . 2.7 mt-30 -83.88 -80.24 0.19 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.022 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 18' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' R' ' 17' ' ' GLN . 5.3 mt-10 -44.2 -31.5 1.0 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 122.708 1.242 . . . . 0.0 108.666 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 19' ' ' TRP . . . . . 0.416 ' N ' ' C ' ' R' ' 17' ' ' GLN . 74.7 t-105 -56.82 -61.5 2.39 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.78 -2.009 . . . . 0.0 110.823 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 tt -48.11 -24.89 1.24 Allowed 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.533 ' O ' ' N ' ' R' ' 23' ' ' VAL . 10.1 mmt180 -69.78 -70.61 0.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.017 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.472 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.35 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.318 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 23' ' ' VAL . . . . . 0.533 ' N ' ' O ' ' R' ' 21' ' ' ARG . 48.9 t -75.22 -55.88 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.323 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -38.64 -52.84 1.65 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.459 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.413 ' N ' HD23 ' R' ' 25' ' ' LEU . 0.5 OUTLIER -64.38 -55.85 18.33 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.698 -1.201 . . . . 0.0 110.432 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 26' ' ' LEU . . . . . 0.501 HD11 HD11 ' R' ' 39' ' ' LEU . 0.4 OUTLIER -63.54 -7.05 6.04 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.149 -179.91 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -83.66 -36.15 24.01 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 118.882 -1.127 . . . . 0.0 112.821 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -113.08 -0.14 14.8 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 119.69 -0.804 . . . . 0.0 113.098 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 30' ' ' TYR . . . -80.2 -53.17 6.92 Favored 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 118.884 -1.127 . . . . 0.0 112.647 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 30' ' ' TYR . . . . . 0.436 ' C ' ' O ' ' R' ' 29' ' ' ALA . 14.8 t80 -30.75 -46.63 0.08 Allowed 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 2.8 mm-40 -58.7 -52.43 65.71 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.346 -0.942 . . . . 0.0 111.191 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 32' ' ' ASN . . . . . 0.507 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 15.9 m120 -78.03 -12.14 59.96 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.245 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 33' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.9 t70 78.91 36.24 0.18 Allowed 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.233 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -99.48 -15.04 18.83 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.022 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 35' ' ' HIS . . . . . 0.446 ' O ' HD13 ' R' ' 39' ' ' LEU . 29.4 p-80 -52.42 -31.67 35.4 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.358 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' R' ' 36' ' ' LEU . 5.8 mt -69.95 -61.52 2.88 Favored Pre-proline 0 C--N 1.303 -1.431 0 C-N-CA 117.849 -1.541 . . . . 0.0 111.768 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 1.5 Cg_endo -54.3 -25.44 38.88 Favored 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 120.493 0.795 . . . . 0.0 111.208 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 46.5 mt -85.26 -35.81 21.3 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.123 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.501 HD11 HD11 ' R' ' 26' ' ' LEU . 0.1 OUTLIER -53.91 -36.15 62.42 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.514 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 12.6 m-20 -73.31 4.57 4.46 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.012 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 41' ' ' LEU . . . . . 0.437 HD12 HD23 ' R' ' 38' ' ' LEU . 50.3 mt -110.68 -67.32 1.0 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.857 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.0 OUTLIER -83.8 40.29 0.73 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.778 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -154.92 165.84 35.43 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.626 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.651 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.293 0.2 OUTLIER -121.76 -151.69 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.353 -179.785 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.651 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.8 Cg_endo -101.09 -37.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.33 -0.444 0 N-CA-C 109.953 -0.826 . . . . 0.0 109.953 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -26.2 63.8 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.709 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.422 ' O ' ' CB ' ' R' ' 51' ' ' LEU . 4.7 mm-40 -64.46 -51.0 65.27 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -51.73 -38.76 56.65 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 119.141 -1.023 . . . . 0.0 110.327 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 49' ' ' GLU . . . . . 0.447 ' O ' ' OG1' ' R' ' 53' ' ' THR . 1.2 tt0 -74.66 -67.84 0.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.164 -1.015 . . . . 0.0 112.101 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.505 ' HB1' HH21 ' R' ' 54' ' ' ARG . . . -56.36 -41.35 76.02 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.042 -0.663 . . . . 0.0 112.718 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 51' ' ' LEU . . . . . 0.422 ' CB ' ' O ' ' R' ' 47' ' ' GLU . 0.9 OUTLIER -53.5 -66.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.67 -44.62 6.89 Favored Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.295 -1.431 . . . . 0.0 109.941 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.546 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -49.02 -80.45 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.964 179.893 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.505 HH21 ' HB1' ' R' ' 50' ' ' ALA . 38.1 mtt-85 -37.53 -34.36 0.09 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.849 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -77.56 -32.62 18.51 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 118.197 -1.401 . . . . 0.0 110.446 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -79.8 -35.47 38.42 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.258 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 0.937 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.84 -36.37 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 117.641 -1.624 . . . . 0.0 108.941 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 0.937 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.3 t -61.76 -61.44 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 118.295 -1.362 . . . . 0.0 109.141 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.508 ' N ' HG12 ' R' ' 58' ' ' VAL . 1.3 mm-40 -45.9 -44.42 14.57 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.813 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -52.93 -52.26 58.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.106 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 65.8 mt -76.4 -1.66 28.06 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.619 -0.832 . . . . 0.0 111.53 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp -112.06 22.37 14.89 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 119.701 -0.799 . . . . 0.0 112.138 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 -77.23 -78.79 0.12 Allowed 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 118.672 -1.211 . . . . 0.0 110.163 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -119.45 -72.36 0.37 Allowed Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.404 ' O ' ' C ' ' R' ' 66' ' ' MET . 70.9 mt-10 -154.43 -55.51 0.1 Allowed 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.207 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 66' ' ' MET . . . . . 0.404 ' C ' ' O ' ' R' ' 65' ' ' GLU . 8.4 tpp -35.1 141.84 0.06 Allowed 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.425 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 19.5 p -167.2 71.21 0.11 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.713 -0.795 . . . . 0.0 110.932 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 68' ' ' GLN . . . . . 0.52 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.2 OUTLIER -128.35 -25.35 2.96 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 119.879 -0.729 . . . . 0.0 110.656 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -71.65 32.51 0.05 Allowed 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.815 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 70' ' ' GLU . . . . . 0.52 ' H ' ' C ' ' R' ' 68' ' ' GLN . 3.3 pt-20 -100.77 24.13 9.58 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.989 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.12 131.15 45.78 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.994 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 72' ' ' LYS . . . . . 0.469 ' NZ ' ' CB ' ' R' ' 72' ' ' LYS . 1.7 ttmp? -69.41 126.73 30.65 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 119.568 -0.853 . . . . 0.0 111.117 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -101.07 -105.96 0.24 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 121.775 0.798 . . . . 0.0 110.474 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 74' ' ' GLU . . . . . 0.462 ' CG ' ' N ' ' R' ' 75' ' ' LEU . 8.3 pt-20 -144.41 -35.77 0.34 Allowed 'General case' 0 C--N 1.279 -2.459 0 CA-C-N 114.365 -1.289 . . . . 0.0 109.769 179.786 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.462 ' N ' ' CG ' ' R' ' 74' ' ' GLU . 0.9 OUTLIER -116.22 -0.7 12.57 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.397 179.853 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -55.59 -73.77 0.39 Allowed Glycine 0 N--CA 1.491 2.333 0 C-N-CA 119.647 -1.263 . . . . 0.0 110.529 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -164.98 -98.4 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.991 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.99 143.09 7.64 Favored Glycine 0 N--CA 1.493 2.464 0 C-N-CA 119.364 -1.398 . . . . 0.0 111.159 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.854 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.47 -42.23 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.226 -179.914 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.471 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.33 -65.98 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.594 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 50.3 m -36.15 -45.82 0.47 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 22.6 pt -72.87 -36.68 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 118.962 -1.095 . . . . 0.0 112.612 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.471 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -52.51 -72.31 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.814 -1.154 . . . . 0.0 111.145 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.418 ' NE ' ' CD1' ' R' ' 1' ' ' TRP . 0.0 OUTLIER -54.89 -14.9 1.62 Allowed 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.486 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.18 -59.48 7.86 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.342 -1.408 . . . . 0.0 110.229 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 86' ' ' SER . . . . . 0.471 ' C ' ' H ' ' R' ' 88' ' ' SER . 100.0 p -88.0 -43.88 11.41 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.781 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.64 8.65 0.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.49 -0.884 . . . . 0.0 110.847 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 88' ' ' SER . . . . . 0.526 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.4 OUTLIER -68.92 -23.59 64.19 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.622 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 89' ' ' LEU . . . . . 0.465 ' C ' ' O ' ' R' ' 88' ' ' SER . 10.2 mt -30.87 -34.9 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.69 0.619 . . . . 0.0 112.022 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 90' ' ' LYS . . . . . 0.526 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -110.14 -64.82 1.22 Allowed 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.63 0.728 . . . . 0.0 111.413 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' R' R ' 91' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.23 -37.86 0.06 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.025 -1.443 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.428 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -56.58 159.21 7.04 Favored Pre-proline 0 N--CA 1.49 1.561 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.859 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 93' ' ' PRO . . . . . 0.428 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 3.1 Cg_exo -59.62 169.55 4.19 Favored 'Trans proline' 0 C--N 1.325 -0.672 0 C-N-CA 121.257 1.304 . . . . 0.0 111.333 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 63.9 t -108.98 -21.43 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.182 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -94.11 -1.15 54.74 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 119.363 -0.935 . . . . 0.0 111.12 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.55 -31.03 12.53 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.879 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -37.65 71.29 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.442 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -66.38 -10.32 42.21 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.311 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.71 ' CE3' HG21 ' R' ' 103' ' ' VAL . 5.9 t90 -97.87 -62.24 1.27 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.553 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.516 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -39.43 -38.09 0.53 Allowed 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.516 ' C ' ' O ' ' R' ' 100' ' ' LEU . 1.1 mm-40 -41.57 -38.61 1.38 Allowed 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 117.928 -1.509 . . . . 0.0 107.806 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -90.6 -27.2 19.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.484 -1.689 . . . . 0.0 112.868 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.71 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.6 t -87.97 -9.19 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 117.26 -1.776 . . . . 0.0 111.023 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -98.61 -52.97 3.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.018 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 105' ' ' LEU . . . . . 0.48 HD22 ' N ' ' R' ' 105' ' ' LEU . 4.5 mm? -70.29 -68.51 0.42 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.74 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -48.77 -17.97 0.23 Allowed 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.875 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 116.339 -1.791 . . . . 0.0 110.81 -179.918 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.858 0.361 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' S' S ' 5' ' ' SER . . . . . 0.455 ' C ' ' H ' ' S' ' 7' ' ' TYR . 2.4 m -66.09 154.55 89.56 Favored Pre-proline 0 N--CA 1.487 1.411 0 C-N-CA 119.324 -0.95 . . . . 0.0 110.148 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -56.22 -4.49 0.74 Allowed 'Trans proline' 0 C--N 1.322 -0.855 0 C-N-CA 120.923 1.082 . . . . 0.0 111.534 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 7' ' ' TYR . . . . . 0.455 ' H ' ' C ' ' S' ' 5' ' ' SER . 4.6 m-85 -74.28 -60.96 2.03 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.297 -0.961 . . . . 0.0 110.956 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.62 21.33 0.66 Allowed 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.892 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.85 -71.59 0.16 Allowed 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.876 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.49 153.25 16.34 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.765 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 38.8 mtp -128.41 69.97 1.37 Allowed 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.947 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.29 156.33 19.25 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.763 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -164.94 155.1 13.7 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.894 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.15 171.59 0.53 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.036 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 15' ' ' ARG . . . . . 0.442 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER -89.53 -11.8 41.78 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.157 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -7.33 0.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.384 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.442 ' H ' ' C ' ' S' ' 15' ' ' ARG . 0.0 OUTLIER -76.89 -86.24 0.05 Allowed 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.775 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -43.24 -34.77 1.24 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.279 1.038 . . . . 0.0 109.176 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -51.97 -57.55 9.13 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 113.815 -1.538 . . . . 0.0 109.075 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mt -59.37 -30.71 68.61 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.105 -1.407 . . . . 0.0 111.493 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.557 ' O ' ' N ' ' S' ' 24' ' ' ASP . 9.0 mmt85 -56.24 -65.23 0.64 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 117.902 -1.519 . . . . 0.0 109.519 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.482 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -36.62 -39.49 0.21 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.076 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 23.0 t -74.2 -36.69 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.136 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.557 ' N ' ' O ' ' S' ' 21' ' ' ARG . 54.7 t0 -58.83 -64.01 1.09 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.577 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.66 -56.03 8.13 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 118.956 -1.098 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.737 HD13 ' C ' ' S' ' 26' ' ' LEU . 2.3 tm? -38.68 -46.4 1.22 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.244 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 27' ' ' LYS . . . . . 0.428 ' NZ ' ' CE2' ' R' ' 30' ' ' TYR . 26.0 mtmm -66.16 -77.37 0.07 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.523 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -39.13 -47.76 1.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 29' ' ' ALA . . . . . 0.525 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -69.91 -27.37 64.73 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.641 -0.824 . . . . 0.0 113.132 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -41.31 98.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 118.582 -1.247 . . . . 0.0 111.089 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -50.13 -30.97 12.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.791 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.448 ' O ' ' OD1' ' S' ' 33' ' ' ASP . 87.7 m-20 -101.77 -83.5 0.46 Allowed 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.482 -0.887 . . . . 0.0 111.402 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.463 ' C ' HD22 ' S' ' 34' ' ' LEU . 0.3 OUTLIER 172.74 24.47 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.787 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 34' ' ' LEU . . . . . 0.761 HD22 ' N ' ' S' ' 34' ' ' LEU . 2.1 mm? -98.07 -13.34 21.07 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -51.15 -18.0 0.78 Allowed 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 119.249 -0.98 . . . . 0.0 111.055 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.476 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.1 mt -78.51 -65.86 0.31 Allowed Pre-proline 0 N--CA 1.482 1.14 0 C-N-CA 118.592 -1.243 . . . . 0.0 110.278 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.476 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 6.1 Cg_exo -49.22 -33.44 28.02 Favored 'Trans proline' 0 C--N 1.318 -1.079 0 N-CA-C 110.161 -0.746 . . . . 0.0 110.161 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.21 -38.59 75.3 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 119.48 -0.888 . . . . 0.0 110.05 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.5 OUTLIER -57.65 -22.55 46.36 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.079 179.655 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.58 15.69 19.2 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.696 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -115.52 -63.85 1.4 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.24 -21.82 61.33 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.704 -1.198 . . . . 0.0 112.532 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 43' ' ' LEU . . . . . 0.472 HD12 ' H ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -152.84 160.2 43.07 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.854 179.777 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.6 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER 178.93 -41.65 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 118.306 -1.357 . . . . 0.0 114.32 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.6 ' HD2' ' H ' ' S' ' 44' ' ' THR . 10.6 Cg_endo -75.88 -98.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.255 1.303 . . . . 0.0 113.064 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.59 -24.88 1.48 Allowed 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.875 -1.13 . . . . 0.0 110.351 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -59.31 -69.17 0.21 Allowed 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.778 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -29.45 4.48 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.7 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -82.56 -67.88 0.75 Allowed 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 118.759 -1.176 . . . . 0.0 112.203 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.11 -51.09 71.1 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 51' ' ' LEU . . . . . 0.481 HD12 ' O ' ' R' ' 42' ' ' MET . 3.9 tp -39.47 -58.32 1.28 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.214 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 52' ' ' GLY . . . . . 0.4 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -53.98 -44.0 72.2 Favored Glycine 0 N--CA 1.492 2.383 0 C-N-CA 119.28 -1.438 . . . . 0.0 109.912 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -47.6 -75.87 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.64 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.66 ' HE ' ' CA ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -48.74 -24.87 1.55 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.437 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -79.06 -27.61 13.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.342 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -81.79 -37.91 26.41 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.307 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 0.804 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -73.61 -35.07 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 117.326 -1.75 . . . . 0.0 107.931 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 58' ' ' VAL . . . . . 0.804 ' N ' HD13 ' S' ' 57' ' ' ILE . 11.8 t -60.56 -56.02 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 117.925 -1.51 . . . . 0.0 109.292 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.83 -27.06 49.54 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.462 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -71.79 -52.19 18.81 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.017 -1.073 . . . . 0.0 112.821 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 61' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -60.74 -24.69 65.91 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 117.738 -1.585 . . . . 0.0 110.269 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 62' ' ' LEU . . . . . 0.663 ' O ' ' N ' ' S' ' 64' ' ' GLY . 5.3 tp -85.38 25.48 1.02 Allowed 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.539 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 63' ' ' ARG . . . . . 0.43 ' C ' ' O ' ' S' ' 62' ' ' LEU . 6.6 mtp-105 14.7 40.72 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.1 0 O-C-N 124.696 1.248 . . . . 0.0 114.315 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.663 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -90.22 -14.23 59.19 Favored Glycine 0 N--CA 1.489 2.224 0 C-N-CA 119.494 -1.336 . . . . 0.0 109.84 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -135.4 -66.76 0.56 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.016 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.94 -175.09 2.61 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.64 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 67' ' ' SER . . . . . 0.521 ' O ' ' N ' ' S' ' 69' ' ' ARG . 3.1 p -163.05 -78.67 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.468 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.52 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.9 OUTLIER -30.26 -36.23 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.784 179.681 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 69' ' ' ARG . . . . . 0.521 ' N ' ' O ' ' S' ' 67' ' ' SER . 7.9 tpt180 -73.05 31.4 0.07 Allowed 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.291 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.52 ' H ' ' C ' ' S' ' 68' ' ' GLN . 3.0 mt-10 -91.7 -51.3 5.31 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.611 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 11.8 mt -47.39 145.06 2.61 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.146 -1.022 . . . . 0.0 110.26 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 29.1 tttm -60.85 124.56 20.82 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.863 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -104.19 -103.06 0.31 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.539 0.685 . . . . 0.0 110.696 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -147.85 -40.67 0.17 Allowed 'General case' 0 C--N 1.28 -2.434 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.816 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.2 tp -130.17 18.97 5.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.484 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -73.58 -57.89 4.8 Favored Glycine 0 N--CA 1.491 2.353 0 C-N-CA 119.577 -1.297 . . . . 0.0 110.89 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.44 -67.31 0.16 Allowed 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.199 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 78' ' ' GLY . . . . . 0.469 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 152.74 161.64 10.41 Favored Glycine 0 N--CA 1.491 2.333 0 C-N-CA 119.193 -1.48 . . . . 0.0 110.945 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.873 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -65.57 -40.68 88.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 C-N-CA 120.024 -0.671 . . . . 0.0 111.055 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.418 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -67.29 -37.11 82.87 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.274 -0.971 . . . . 0.0 111.617 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' S' ' 78' ' ' GLY . 77.7 p -60.2 -56.42 21.84 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.337 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 82' ' ' ILE . . . . . 0.421 HD13 HG21 ' S' ' 82' ' ' ILE . 18.5 pt -57.25 -0.63 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.515 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.468 ' C ' ' H ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -98.49 -69.98 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.257 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 84' ' ' ARG . . . . . 0.54 ' NH2' ' N ' ' R' ' 109' ' ' TRP . 0.1 OUTLIER -58.68 -3.84 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 118.859 -1.136 . . . . 0.0 110.922 -179.884 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 85' ' ' GLY . . . . . 0.468 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -95.69 -22.59 20.74 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.341 -1.409 . . . . 0.0 110.292 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 65.2 p -87.32 -12.83 45.3 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.279 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 87' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' S' ' 89' ' ' LEU . 55.9 m-20 -102.87 3.72 36.9 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -40.32 -24.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.852 -0.739 . . . . 0.0 111.22 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 89' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' S' ' 87' ' ' ASN . 7.3 mt -55.84 -49.58 72.93 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.922 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -103.92 -34.96 8.31 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.092 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.0 -71.42 0.07 Allowed 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.2 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 92' ' ' ALA . . . . . 0.434 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -70.7 159.22 85.9 Favored Pre-proline 0 N--CA 1.488 1.436 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.351 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 93' ' ' PRO . . . . . 0.434 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 5.8 Cg_exo -57.12 176.79 0.22 Allowed 'Trans proline' 0 C--N 1.323 -0.791 0 C-N-CA 121.668 1.579 . . . . 0.0 112.038 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 94' ' ' VAL . . . . . 0.478 ' O ' HG12 ' S' ' 94' ' ' VAL . 65.7 t -96.08 -9.64 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.628 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -77.12 -22.29 52.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.584 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -37.9 79.45 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.847 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 -47.9 82.3 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.747 -0.781 . . . . 0.0 111.439 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -80.2 -8.15 59.3 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.908 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.594 ' CH2' HG21 ' S' ' 103' ' ' VAL . 6.2 t90 -101.37 -65.63 0.96 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 118.925 -1.11 . . . . 0.0 112.398 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.554 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -59.15 -39.9 83.87 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -179.67 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.554 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.0 OUTLIER -40.98 -29.91 0.12 Allowed 'General case' 0 C--N 1.296 -1.748 0 C-N-CA 117.563 -1.655 . . . . 0.0 106.95 179.738 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' S' S ' 102' ' ' GLU . . . . . 0.545 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 mt-10 -91.88 -24.6 19.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 112.9 -1.955 . . . . 0.0 112.348 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.594 HG21 ' CH2' ' S' ' 99' ' ' TRP . 18.9 t -87.96 -21.19 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 116.536 -2.066 . . . . 0.0 109.833 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tp -86.94 -57.78 2.84 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.949 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.35 -75.09 0.2 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 118.728 -1.189 . . . . 0.0 110.343 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -76.63 47.39 0.49 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.381 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.305 -1.352 0 CA-C-O 116.324 -1.798 . . . . 0.0 110.921 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.418 ' CD1' ' NE ' ' R' ' 84' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.281 0 CA-C-O 116.36 -1.781 . . . . 0.0 110.413 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.54 ' N ' ' NH2' ' S' ' 84' ' ' ARG . 21.6 p-90 . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 116.411 -1.757 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 4' ' ' GLN . . . . . 0.672 HE21 ' N ' ' R' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.896 0.379 . . . . 0.0 110.119 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 51.5 m 45.41 67.83 3.87 Favored Pre-proline 0 C--N 1.304 -1.407 0 C-N-CA 119.493 -0.883 . . . . 0.0 111.657 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -63.82 109.89 1.18 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 121.606 1.537 . . . . 0.0 111.092 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -145.39 7.36 1.14 Allowed 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.237 -0.985 . . . . 0.0 111.208 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 3.2 m -80.16 79.46 6.71 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.912 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -96.72 -112.13 0.14 Allowed 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 119.556 -0.858 . . . . 0.0 110.676 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . 45.61 -164.0 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.32 -0.952 . . . . 0.0 110.839 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 11' ' ' MET . . . . . 0.526 ' N ' ' SD ' ' R' ' 11' ' ' MET . 0.0 OUTLIER -69.4 145.36 52.92 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.684 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -140.69 -137.58 0.12 Allowed 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.637 -0.825 . . . . 0.0 111.044 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -97.94 56.16 1.22 Allowed 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.644 -0.822 . . . . 0.0 111.121 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -115.58 -140.75 0.37 Allowed 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.579 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 15' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' R' ' 17' ' ' GLN . 23.5 ttt180 -160.55 -93.66 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 118.945 -1.102 . . . . 0.0 111.145 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -38.74 83.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' R' ' 15' ' ' ARG . 1.5 mt-30 -123.15 -91.42 0.55 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.301 -0.56 . . . . 0.0 109.795 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -57.24 -24.1 52.47 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 19' ' ' TRP . . . . . 0.4 ' N ' ' C ' ' R' ' 17' ' ' GLN . 9.4 t-105 -59.17 -46.99 86.95 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 112.559 -2.11 . . . . 0.0 106.214 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.0 tp -56.34 -47.22 79.25 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.562 -2.108 . . . . 0.0 110.411 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.0 OUTLIER -47.99 -70.0 0.11 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 119.05 -1.06 . . . . 0.0 110.416 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.5 OUTLIER -27.38 -51.14 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.329 179.675 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 23' ' ' VAL . . . . . 0.423 HG23 ' H ' ' R' ' 23' ' ' VAL . 1.2 t -68.73 -46.29 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.326 -0.949 . . . . 0.0 110.991 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.504 ' N ' ' O ' ' R' ' 21' ' ' ARG . 64.0 t0 -39.03 -45.37 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.709 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.409 ' HG ' ' H ' ' R' ' 25' ' ' LEU . 1.4 mt -75.88 -34.91 60.0 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.06 -1.056 . . . . 0.0 109.986 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 26' ' ' LEU . . . . . 0.423 ' N ' ' O ' ' R' ' 23' ' ' VAL . 1.0 OUTLIER -55.57 -31.81 62.49 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.048 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -79.93 -39.53 30.1 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 118.931 -1.108 . . . . 0.0 112.244 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -85.86 -18.18 33.53 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.898 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.423 ' HB1' ' N ' ' R' ' 35' ' ' HIS . . . -82.36 -58.84 2.76 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 118.968 -1.093 . . . . 0.0 111.766 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -45.47 -32.15 2.06 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.596 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 31' ' ' GLN . . . . . 0.43 ' O ' ' OE1' ' R' ' 31' ' ' GLN . 0.3 OUTLIER -46.79 -40.75 14.22 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.099 -1.04 . . . . 0.0 109.667 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 32' ' ' ASN . . . . . 0.4 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 63.6 t30 -106.51 -73.53 0.68 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.561 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 33' ' ' ASP . . . . . 0.4 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.5 OUTLIER 170.6 18.17 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 119.134 -1.026 . . . . 0.0 112.63 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 34' ' ' LEU . . . . . 0.502 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.9 OUTLIER -88.8 -13.44 39.41 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.05 -1.06 . . . . 0.0 109.19 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 35' ' ' HIS . . . . . 0.542 ' O ' HD13 ' R' ' 39' ' ' LEU . 46.5 p-80 -51.55 -27.52 11.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.385 -1.279 . . . . 0.0 113.024 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.456 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.9 mt -70.17 -62.52 2.21 Favored Pre-proline 0 N--CA 1.486 1.365 0 C-N-CA 117.872 -1.531 . . . . 0.0 110.815 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.1 Cg_exo -51.63 -25.21 19.34 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 C-N-CA 120.743 0.962 . . . . 0.0 110.667 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 24.5 mt -81.08 -38.83 26.68 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.096 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.542 HD13 ' O ' ' R' ' 35' ' ' HIS . 0.5 OUTLIER -59.94 -21.09 60.7 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.163 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 40' ' ' ASN . . . . . 0.546 ' O ' ' ND2' ' R' ' 40' ' ' ASN . 0.1 OUTLIER -103.69 11.68 35.68 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.374 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 39.4 tp -107.0 -69.81 0.82 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.635 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 42' ' ' MET . . . . . 0.462 ' C ' HD12 ' R' ' 43' ' ' LEU . 1.1 mtt -77.36 7.74 4.97 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 118.121 -1.432 . . . . 0.0 112.81 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 43' ' ' LEU . . . . . 0.462 HD12 ' C ' ' R' ' 42' ' ' MET . 9.0 mp -116.5 -176.2 2.91 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.513 ' HB ' ' CD ' ' R' ' 45' ' ' PRO 0.275 0.0 OUTLIER -126.2 -153.33 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 118.543 -1.263 . . . . 0.0 109.62 179.996 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.513 ' CD ' ' HB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -97.99 -38.27 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.612 0 CA-C-N 119.95 1.018 . . . . 0.0 111.351 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 46' ' ' ASP . . . . . 0.439 ' OD1' ' OE1' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -56.42 -18.96 12.84 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.092 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.439 ' OE1' ' OD1' ' R' ' 46' ' ' ASP . 3.6 mp0 -60.67 -71.33 0.14 Allowed 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.327 -0.949 . . . . 0.0 109.727 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -43.67 -44.45 6.44 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.674 -0.81 . . . . 0.0 109.867 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 49' ' ' GLU . . . . . 0.466 ' O ' ' OG1' ' R' ' 53' ' ' THR . 8.0 mm-40 -56.47 -77.32 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.06 -1.056 . . . . 0.0 111.58 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -66.73 -60.07 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.286 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 51' ' ' LEU . . . . . 0.542 HD23 ' C ' ' R' ' 51' ' ' LEU . 4.5 tt -34.02 -58.53 0.45 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.122 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.2 -48.09 59.87 Favored Glycine 0 N--CA 1.488 2.11 0 C-N-CA 119.042 -1.551 . . . . 0.0 109.44 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.506 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.3 OUTLIER -48.46 -79.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.895 -0.722 . . . . 0.0 112.453 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.618 ' CD ' ' H ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -39.88 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.826 -179.843 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 55' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' R' ' 53' ' ' THR . 1.5 t -88.43 -30.18 5.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 C-N-CA 118.488 -1.285 . . . . 0.0 111.236 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -76.58 -37.41 56.56 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.146 -1.022 . . . . 0.0 110.163 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 0.476 HG22 ' O ' ' R' ' 53' ' ' THR . 0.1 OUTLIER -76.79 -52.42 17.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 C-N-CA 118.834 -1.147 . . . . 0.0 109.651 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.5 p -51.99 -44.42 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 117.692 -1.603 . . . . 0.0 110.742 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.503 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 1.5 tm-20 -66.73 -29.56 69.57 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.625 -0.83 . . . . 0.0 111.251 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -48.81 20.88 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.985 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 97.8 mt -70.69 -22.69 62.44 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.681 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 62' ' ' LEU . . . . . 0.415 ' C ' ' H ' ' R' ' 64' ' ' GLY . 6.5 tp -61.58 -36.84 81.8 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.297 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 63' ' ' ARG . . . . . 0.651 ' O ' ' N ' ' R' ' 65' ' ' GLU . 17.1 ttm180 -80.19 16.13 1.35 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.311 -0.956 . . . . 0.0 109.999 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 64' ' ' GLY . . . . . 0.415 ' H ' ' C ' ' R' ' 62' ' ' LEU . . . 17.58 37.18 0.01 OUTLIER Glycine 0 N--CA 1.504 3.215 0 O-C-N 124.697 1.248 . . . . 0.0 114.37 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.651 ' N ' ' O ' ' R' ' 63' ' ' ARG . 0.3 OUTLIER -54.52 -29.77 51.59 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 118.793 -1.163 . . . . 0.0 109.767 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -151.77 157.78 42.45 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.251 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 6.2 t -169.29 70.67 0.07 Allowed 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.987 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -131.13 -97.44 0.33 Allowed 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.922 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.13 30.16 3.22 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 120.194 -0.602 . . . . 0.0 111.042 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 70' ' ' GLU . . . . . 0.444 ' O ' ' OE1' ' R' ' 74' ' ' GLU . 43.7 mt-10 -130.09 33.29 4.39 Favored 'General case' 0 C--N 1.295 -1.768 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.794 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 23.1 mt -103.66 19.48 19.77 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 119.448 -0.901 . . . . 0.0 112.276 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 4.6 mttt -157.33 -68.5 0.1 Allowed 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 117.948 -1.501 . . . . 0.0 113.048 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -77.38 0.02 23.98 Favored 'General case' 0 C--N 1.308 -1.197 0 C-N-CA 118.661 -1.215 . . . . 0.0 112.298 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 74' ' ' GLU . . . . . 0.444 ' OE1' ' O ' ' R' ' 70' ' ' GLU . 1.2 pt-20 -60.19 -28.68 68.16 Favored 'General case' 0 C--N 1.278 -2.511 0 C-N-CA 118.201 -1.4 . . . . 0.0 107.471 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.623 ' O ' ' N ' ' R' ' 77' ' ' ALA . 0.8 OUTLIER -136.04 15.08 3.3 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 114.002 -1.454 . . . . 0.0 109.593 179.766 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 76' ' ' GLY . . . . . 0.482 ' C ' ' O ' ' R' ' 75' ' ' LEU . . . 21.34 38.95 0.01 OUTLIER Glycine 0 N--CA 1.505 3.298 0 O-C-N 124.266 0.979 . . . . 0.0 112.25 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 77' ' ' ALA . . . . . 0.623 ' N ' ' O ' ' R' ' 75' ' ' LEU . . . -75.39 -78.86 0.1 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.384 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 78' ' ' GLY . . . . . 0.478 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 171.19 157.8 13.86 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.771 -1.332 . . . . 0.0 109.771 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.76 HD13 ' N ' ' R' ' 79' ' ' ILE . 0.7 OUTLIER -73.56 28.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 C-N-CA 119.754 -0.778 . . . . 0.0 112.51 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.478 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.99 -37.4 5.61 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 81' ' ' THR . . . . . 0.505 ' HA ' ' HE1' ' R' ' 1' ' ' TRP . 17.4 p -95.87 -56.44 2.66 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.182 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 82' ' ' ILE . . . . . 0.409 ' H ' HG23 ' R' ' 82' ' ' ILE . 1.5 pp -47.43 -13.99 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.393 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.487 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -66.25 -80.43 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.642 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.801 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -54.18 -20.5 6.92 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.808 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.99 -46.7 91.05 Favored Glycine 0 N--CA 1.489 2.194 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.101 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -27.95 7.55 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.187 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 87' ' ' ASN . . . . . 0.607 ' C ' ' H ' ' R' ' 89' ' ' LEU . 1.9 t-20 -88.3 -56.27 3.39 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.793 -1.163 . . . . 0.0 111.446 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 88' ' ' SER . . . . . 0.597 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.8 -2.91 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.605 -1.238 . . . . 0.0 110.459 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 89' ' ' LEU . . . . . 0.749 ' O ' ' N ' ' R' ' 91' ' ' ALA . 1.2 mm? 28.79 32.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.805 1.316 . . . . 0.0 110.929 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 90' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' R' ' 88' ' ' SER . 6.9 tptt 20.19 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 114.163 -1.381 . . . . 0.0 113.927 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 91' ' ' ALA . . . . . 0.749 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -88.13 -3.09 58.93 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.749 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.715 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -70.89 171.13 8.99 Favored Pre-proline 0 N--CA 1.487 1.416 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.83 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 93' ' ' PRO . . . . . 0.715 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 6.1 Cg_exo -59.33 120.35 8.15 Favored 'Trans proline' 0 C--N 1.324 -0.758 0 C-N-CA 121.112 1.208 . . . . 0.0 111.618 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 43.1 t -60.99 -37.61 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 118.966 -1.094 . . . . 0.0 109.979 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -60.4 -10.05 4.36 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.709 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 96' ' ' LEU . . . . . 0.53 HD23 ' O ' ' R' ' 96' ' ' LEU . 3.2 tt -72.3 -55.03 7.82 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.678 -0.809 . . . . 0.0 110.074 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 97' ' ' ARG . . . . . 0.488 ' O ' ' CG ' ' R' ' 101' ' ' GLU . 0.0 OUTLIER -63.13 -12.06 24.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.088 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -80.96 -34.2 33.32 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.049 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.519 ' CH2' HG21 ' R' ' 103' ' ' VAL . 46.2 t90 -80.52 -58.84 2.93 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 121.952 0.882 . . . . 0.0 111.129 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.587 ' C ' ' N ' ' R' ' 102' ' ' GLU . 0.3 OUTLIER -70.43 -15.2 62.8 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 117.416 -1.714 . . . . 0.0 115.26 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' R' ' 97' ' ' ARG . 3.0 mm-40 -57.94 -18.71 25.1 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.587 ' N ' ' C ' ' R' ' 100' ' ' LEU . 5.0 mt-10 -99.13 -35.63 9.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 112.378 -2.192 . . . . 0.0 114.195 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.519 HG21 ' CH2' ' R' ' 99' ' ' TRP . 5.1 t -73.55 -14.18 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 113.958 -3.097 . . . . 0.0 108.761 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 104' ' ' LEU . . . . . 0.548 HD22 ' NH2' ' R' ' 63' ' ' ARG . 2.1 mt -88.65 -58.6 2.49 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.399 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 15.8 mt -62.5 -77.87 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.887 -1.125 . . . . 0.0 110.38 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.8 tptm -43.58 -81.22 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.718 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 CA-C-O 116.27 -1.824 . . . . 0.0 110.67 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.963 0.411 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 70.2 m 45.29 67.61 4.05 Favored Pre-proline 0 N--CA 1.488 1.437 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.431 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -68.7 -52.8 0.39 Allowed 'Trans proline' 0 C--N 1.313 -1.317 0 C-N-CA 121.897 1.732 . . . . 0.0 111.794 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -80.9 52.1 1.67 Allowed 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.302 -0.959 . . . . 0.0 111.596 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 60.3 p -80.88 3.38 22.9 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 119.183 -1.007 . . . . 0.0 111.148 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.13 -44.16 92.02 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.756 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . 50.28 95.78 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.696 -0.802 . . . . 0.0 111.435 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 3.6 mtm -93.72 -57.08 2.67 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.436 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 12' ' ' ALA . . . . . 0.431 ' O ' ' O ' ' S' ' 13' ' ' GLU . . . -165.94 -33.33 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.601 -0.839 . . . . 0.0 110.727 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 13' ' ' GLU . . . . . 0.431 ' O ' ' O ' ' S' ' 12' ' ' ALA . 7.1 mt-10 52.09 169.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.946 -0.702 . . . . 0.0 111.523 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -127.57 107.14 9.67 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.291 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -97.76 117.7 32.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.633 -0.827 . . . . 0.0 111.446 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.49 15.72 6.55 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.174 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.473 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.5 mp0 -88.58 -90.07 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.906 -0.717 . . . . 0.0 110.461 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -43.45 -26.54 0.21 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.443 1.116 . . . . 0.0 109.198 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 19' ' ' TRP . . . . . 0.473 ' N ' ' C ' ' S' ' 17' ' ' GLN . 53.9 t-105 -57.11 -60.96 2.82 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 113.114 -1.857 . . . . 0.0 109.724 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 4.9 tp -43.49 -35.35 1.61 Allowed 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.851 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' S' ' 23' ' ' VAL . 29.7 mtt180 -64.01 -71.95 0.16 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.945 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.513 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -25.89 -40.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.461 0.476 . . . . 0.0 111.791 179.604 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.552 ' N ' ' O ' ' S' ' 21' ' ' ARG . 89.4 t -73.65 -71.65 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 C-N-CA 119.959 -0.696 . . . . 0.0 111.718 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.417 ' C ' ' O ' ' S' ' 23' ' ' VAL . 33.1 t70 -28.28 -35.83 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.589 HD12 ' CE ' ' S' ' 42' ' ' MET . 1.5 mt -87.3 -44.07 11.69 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.015 -1.074 . . . . 0.0 111.069 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -57.15 -63.13 1.32 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.156 -1.017 . . . . 0.0 111.74 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -50.55 -49.17 56.7 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -67.46 -35.61 79.53 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.737 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -27.91 69.46 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 118.896 -1.121 . . . . 0.0 111.771 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -51.19 -53.57 33.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 118.694 -1.202 . . . . 0.0 110.519 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.12 -14.82 4.35 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.404 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.485 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.3 OUTLIER -105.43 -17.16 14.52 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.544 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.485 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.7 t0 75.13 25.35 1.35 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.847 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.5 -13.97 17.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.881 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 35' ' ' HIS . . . . . 0.441 ' O ' HD13 ' S' ' 39' ' ' LEU . 12.2 p-80 -47.11 -19.8 0.14 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.926 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -80.16 -65.71 0.27 Allowed Pre-proline 0 N--CA 1.484 1.254 0 C-N-CA 117.593 -1.643 . . . . 0.0 110.43 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -50.25 -24.52 11.7 Favored 'Trans proline' 0 C--N 1.32 -0.95 0 N-CA-C 110.066 -0.782 . . . . 0.0 110.066 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 38' ' ' LEU . . . . . 0.51 ' O ' ' SD ' ' S' ' 42' ' ' MET . 73.1 mt -82.5 -39.1 22.91 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.929 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.2 OUTLIER -52.36 -38.26 58.31 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.898 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -76.23 13.13 0.97 Allowed 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 118.748 -1.181 . . . . 0.0 110.16 179.856 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 41' ' ' LEU . . . . . 0.417 ' H ' ' C ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER -116.2 -54.9 2.44 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.568 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 42' ' ' MET . . . . . 0.589 ' CE ' HD12 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -82.85 -8.02 59.61 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 118.13 -1.428 . . . . 0.0 112.057 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -112.78 173.47 6.36 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.62 HG22 ' HD3' ' S' ' 45' ' ' PRO 0.295 0.3 OUTLIER -129.12 -140.63 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.57 0 CA-C-O 117.37 -1.3 . . . . 0.0 109.497 179.941 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.62 ' HD3' HG22 ' S' ' 44' ' ' THR . 12.1 Cg_endo -98.95 -44.4 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.501 0 CA-C-N 122.282 1.851 . . . . 0.0 111.102 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -23.03 5.49 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.102 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -68.5 -51.01 47.92 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.022 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 4.8 mpt_? -55.76 -46.96 77.76 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.459 -0.792 . . . . 0.0 112.442 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.49 -66.08 0.6 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 50' ' ' ALA . . . . . 0.486 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -60.32 -61.59 2.49 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 51' ' ' LEU . . . . . 0.633 HD12 ' C ' ' S' ' 51' ' ' LEU . 0.2 OUTLIER -45.48 -38.11 5.91 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.529 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 52' ' ' GLY . . . . . 0.41 ' N ' ' HG ' ' S' ' 51' ' ' LEU . . . -63.22 -40.66 99.33 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 108.279 -1.928 . . . . 0.0 108.279 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.531 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -54.74 -73.89 0.05 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.291 -0.954 . . . . 0.0 110.921 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.501 ' CD ' ' H ' ' S' ' 54' ' ' ARG . 1.3 mmt180 -37.43 -39.15 0.28 Allowed 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.262 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.1 t -64.11 -40.86 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 C-N-CA 117.742 -1.583 . . . . 0.0 109.246 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' S' ' 53' ' ' THR . 30.2 mtt180 -62.27 -51.59 67.11 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.691 -1.203 . . . . 0.0 109.325 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 0.494 HG22 HD11 ' S' ' 61' ' ' LEU . 2.0 mt -54.76 -64.96 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.784 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 86.2 t -43.29 -70.68 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.915 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -52.79 -31.13 36.98 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -34.38 64.25 Favored 'General case' 0 C--N 1.308 -1.225 0 C-N-CA 118.238 -1.385 . . . . 0.0 111.438 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 61' ' ' LEU . . . . . 0.494 HD11 HG22 ' S' ' 57' ' ' ILE . 15.3 mt -75.5 -39.39 58.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.292 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mt -60.04 -31.53 70.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.284 -0.967 . . . . 0.0 110.197 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 63' ' ' ARG . . . . . 0.66 ' O ' ' N ' ' S' ' 65' ' ' GLU . 0.4 OUTLIER -83.81 5.08 26.37 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.405 -0.918 . . . . 0.0 110.629 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.443 ' C ' ' O ' ' S' ' 63' ' ' ARG . . . 19.88 36.83 0.01 OUTLIER Glycine 0 N--CA 1.506 3.364 0 O-C-N 124.429 1.081 . . . . 0.0 113.122 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 65' ' ' GLU . . . . . 0.66 ' N ' ' O ' ' S' ' 63' ' ' ARG . 2.4 mm-40 -89.42 -36.12 15.63 Favored 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 119.439 -0.905 . . . . 0.0 110.82 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -168.15 111.54 0.61 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.367 -0.933 . . . . 0.0 111.428 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 90.2 p -159.09 64.6 0.4 Allowed 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.511 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.479 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.4 OUTLIER -133.16 -18.23 2.31 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 119.774 -0.77 . . . . 0.0 112.381 -179.774 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 69' ' ' ARG . . . . . 0.678 ' O ' ' N ' ' S' ' 71' ' ' LEU . 1.9 tpt180 -68.45 31.31 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.479 ' H ' ' C ' ' S' ' 68' ' ' GLN . 49.3 mt-10 5.91 49.69 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.775 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 71' ' ' LEU . . . . . 0.678 ' N ' ' O ' ' S' ' 69' ' ' ARG . 0.6 OUTLIER -46.63 -21.0 0.15 Allowed 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 119.641 -0.824 . . . . 0.0 112.357 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt 52.73 -112.28 0.67 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.462 -0.895 . . . . 0.0 111.219 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 73' ' ' ASN . . . . . 0.497 ' O ' ' C ' ' S' ' 74' ' ' GLU . 52.7 t30 -129.09 6.16 5.39 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.292 -0.963 . . . . 0.0 113.405 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 74' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 73' ' ' ASN . 2.5 mm-40 -42.77 -46.85 5.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.094 -1.817 . . . . 0.0 106.094 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.3 tp -143.32 24.58 1.76 Allowed 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 112.919 -1.946 . . . . 0.0 108.514 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -127.42 -99.79 1.06 Allowed Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.896 -1.621 . . . . 0.0 113.023 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 77' ' ' ALA . . . . . 0.418 ' HB2' HG21 ' S' ' 53' ' ' THR . . . -150.59 -67.66 0.19 Allowed 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.062 -1.055 . . . . 0.0 112.765 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.57 160.08 33.11 Favored Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.093 -1.527 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.865 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -61.97 -39.87 85.23 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.273 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.21 -58.48 6.89 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.329 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.553 HG22 ' HE1' ' R' ' 109' ' ' TRP . 73.1 p -42.2 -59.29 1.84 Allowed 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 34.1 pt -60.14 -3.16 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 119.093 -1.043 . . . . 0.0 112.925 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -107.81 -37.77 6.03 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.749 -0.78 . . . . 0.0 111.396 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.34 19.19 1.0 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.482 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.9 -38.88 2.81 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.595 -1.288 . . . . 0.0 110.424 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -51.55 5.92 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.688 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -79.37 11.18 3.1 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.321 -0.951 . . . . 0.0 110.107 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 88' ' ' SER . . . . . 0.441 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.1 OUTLIER -72.9 -31.5 64.71 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.331 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 89' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' S' ' 88' ' ' SER . 7.3 mt -34.95 -50.49 0.48 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.539 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -40.01 -66.72 0.28 Allowed 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.576 0.703 . . . . 0.0 112.358 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.27 -46.47 17.71 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.442 -1.253 . . . . 0.0 112.572 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -42.49 153.69 0.3 Allowed Pre-proline 0 N--CA 1.49 1.571 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.252 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -58.26 141.42 96.74 Favored 'Trans proline' 0 C--O 1.216 -0.6 0 C-N-CA 121.53 1.487 . . . . 0.0 112.139 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 94' ' ' VAL . . . . . 0.671 ' O ' HG12 ' S' ' 94' ' ' VAL . 63.4 t -109.71 11.13 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.087 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -99.21 -0.17 42.02 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.816 -0.753 . . . . 0.0 111.005 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 70.0 mt -101.64 -21.0 14.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.171 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.11 -24.05 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.679 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -101.57 -22.32 14.51 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.88 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.616 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 17.7 t90 -82.13 -60.45 2.22 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.999 -1.081 . . . . 0.0 112.959 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.644 ' HA ' HG23 ' S' ' 103' ' ' VAL . 0.4 OUTLIER -50.41 -36.27 32.12 Favored 'General case' 0 C--N 1.286 -2.188 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.998 -179.493 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.4 mt-10 -40.87 -32.14 0.21 Allowed 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.842 -1.543 . . . . 0.0 107.439 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 102' ' ' GLU . . . . . 0.527 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -88.56 -28.19 20.9 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.042 -1.89 . . . . 0.0 112.381 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.644 HG23 ' HA ' ' S' ' 100' ' ' LEU . 2.1 t -79.9 -35.91 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 115.233 -2.587 . . . . 0.0 108.331 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.5 -52.68 63.49 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.951 -1.1 . . . . 0.0 108.054 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 105' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' S' ' 105' ' ' LEU . 12.7 tp -56.48 -57.08 13.85 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 119.469 -0.892 . . . . 0.0 109.909 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -95.91 80.57 3.34 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.502 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.304 -1.411 0 CA-C-O 116.186 -1.864 . . . . 0.0 111.029 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.505 ' HE1' ' HA ' ' R' ' 81' ' ' THR . 1.0 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 116.409 -1.758 . . . . 0.0 110.474 . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.553 ' HE1' HG22 ' S' ' 81' ' ' THR . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 116.219 -1.848 . . . . 0.0 109.994 . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 121.061 0.458 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 59.2 m 51.08 62.45 11.4 Favored Pre-proline 0 C--N 1.303 -1.418 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.768 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -65.03 156.03 64.96 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 C-N-CA 121.483 1.456 . . . . 0.0 111.139 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -109.52 -0.47 18.8 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.755 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m 59.2 28.43 17.73 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.981 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.74 117.69 17.76 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.599 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.54 -173.86 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.48 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -106.16 133.22 51.21 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.698 -0.801 . . . . 0.0 110.72 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -90.11 40.31 1.0 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.367 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -90.1 121.51 32.23 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.146 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -67.67 124.85 24.42 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.662 -0.815 . . . . 0.0 110.952 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.58 23.79 14.01 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.83 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -103.83 55.91 0.73 Allowed 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.556 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.6 tt0 -113.09 -82.27 0.59 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.272 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 18' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.1 OUTLIER -49.52 -21.66 1.02 Allowed 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 123.445 1.593 . . . . 0.0 106.937 179.571 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 19' ' ' TRP . . . . . 0.556 ' N ' ' C ' ' R' ' 17' ' ' GLN 0.257 43.2 t-105 -55.49 -51.66 66.25 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.607 -2.542 . . . . 0.0 109.042 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.07 -21.95 48.17 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.24 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.475 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.0 mmt85 -71.28 -72.07 0.23 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.354 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.481 ' CD2' HG23 ' R' ' 23' ' ' VAL . 0.0 OUTLIER -35.5 -32.66 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.193 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 23' ' ' VAL . . . . . 0.481 HG23 ' CD2' ' R' ' 22' ' ' PHE . 89.0 t -81.95 -58.16 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.805 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -34.94 -45.2 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.385 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' R' ' 25' ' ' LEU . 0.7 OUTLIER -82.83 -40.2 20.67 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.726 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 26' ' ' LEU . . . . . 0.412 ' CD1' HD11 ' R' ' 39' ' ' LEU . 4.8 tp -37.75 -52.63 1.28 Allowed 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.789 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -51.85 28.3 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.615 -1.234 . . . . 0.0 112.501 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -51.02 -31.4 18.13 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.855 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.476 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -83.39 -53.45 5.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.0 -1.08 . . . . 0.0 112.692 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 30' ' ' TYR . . . . . 0.411 ' O ' ' C ' ' R' ' 31' ' ' GLN . 61.5 t80 -36.51 -51.19 0.82 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 31' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' R' ' 30' ' ' TYR . 4.9 tt0 -38.45 -35.69 0.19 Allowed 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.576 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -101.77 -80.82 0.5 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.796 -0.762 . . . . 0.0 110.638 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 168.35 35.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.689 0.757 . . . . 0.0 109.106 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 34' ' ' LEU . . . . . 0.421 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 2.1 mm? -100.86 -19.3 16.0 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.434 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 35' ' ' HIS . . . . . 0.406 ' CG ' ' N ' ' R' ' 36' ' ' LEU . 6.3 p-80 -48.09 -41.2 25.61 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 114.842 -1.072 . . . . 0.0 112.754 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.1 mt -58.06 -64.07 3.18 Favored Pre-proline 0 C--N 1.302 -1.494 0 C-N-CA 117.988 -1.485 . . . . 0.0 111.146 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.9 Cg_endo -56.35 -17.26 20.46 Favored 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.955 1.103 . . . . 0.0 111.27 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.82 -56.46 3.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.099 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.446 ' C ' ' N ' ' R' ' 41' ' ' LEU . 2.6 mm? -51.71 -33.78 35.93 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 117.988 -1.485 . . . . 0.0 108.049 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -12.94 0.07 Allowed 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.058 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 41' ' ' LEU . . . . . 0.446 ' N ' ' C ' ' R' ' 39' ' ' LEU . 11.6 mt -112.0 -58.01 2.19 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 120.0 -0.68 . . . . 0.0 111.349 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 42' ' ' MET . . . . . 0.498 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -87.03 39.11 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 118.235 -1.386 . . . . 0.0 110.279 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -160.48 170.62 20.58 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.275 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.487 ' HB ' ' CD ' ' R' ' 45' ' ' PRO 0.314 0.1 OUTLIER -132.86 -153.68 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.619 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.817 -179.955 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.487 ' CD ' ' HB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -95.21 -40.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.217 -0.531 0 N-CA-C 110.01 -0.804 . . . . 0.0 110.01 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -58.93 -34.19 71.45 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.111 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.47 ' OE1' ' N ' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -63.23 -48.06 79.86 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.945 179.908 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -37.94 28.94 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.016 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -77.64 -73.27 0.31 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.972 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.42 -48.03 37.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.906 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -61.69 1.59 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.176 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.57 -44.95 68.26 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 119.69 -1.243 . . . . 0.0 111.451 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.482 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.1 OUTLIER -52.57 -83.42 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.61 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.407 ' HG2' ' CE2' ' R' ' 1' ' ' TRP . 10.1 mtt85 -42.33 -21.77 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.798 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 55' ' ' VAL . . . . . 0.643 HG22 ' HB3' ' S' ' 42' ' ' MET . 2.3 t -82.04 -40.61 17.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.027 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' R' ' 60' ' ' GLU . 0.0 OUTLIER -81.4 -30.93 33.45 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 118.594 -1.242 . . . . 0.0 112.825 -179.599 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 0.411 HG21 HD13 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -78.66 -42.51 25.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 C-N-CA 118.007 -1.477 . . . . 0.0 109.228 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 0.535 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.9 p -62.1 -49.42 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.68 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.535 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 3.9 pt-20 -66.91 -28.15 68.07 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 117.93 -1.508 . . . . 0.0 111.351 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 60' ' ' GLU . . . . . 0.402 ' HG3' HH11 ' R' ' 56' ' ' ARG . 17.2 mm-40 -72.18 -44.9 62.32 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 119.067 -1.053 . . . . 0.0 112.253 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 40.0 mt -82.61 -7.15 59.66 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.497 -1.281 . . . . 0.0 111.983 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp -66.37 -0.83 2.89 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 118.708 -1.197 . . . . 0.0 110.871 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 63' ' ' ARG . . . . . 0.655 ' O ' ' N ' ' R' ' 65' ' ' GLU . 2.3 mtp180 -95.27 7.86 44.86 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 119.389 -0.924 . . . . 0.0 111.299 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 64' ' ' GLY . . . . . 0.443 ' C ' ' O ' ' R' ' 63' ' ' ARG . . . 19.05 37.15 0.01 OUTLIER Glycine 0 N--CA 1.503 3.162 0 O-C-N 124.422 1.076 . . . . 0.0 113.491 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.655 ' N ' ' O ' ' R' ' 63' ' ' ARG . 2.5 mm-40 -63.86 -35.86 82.01 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.943 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mtm -140.23 166.22 25.28 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.489 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 9.6 t -171.98 70.9 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.231 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -130.79 -100.36 0.31 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.54 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.08 26.11 2.25 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.806 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 70' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -129.32 26.26 5.42 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.073 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 71' ' ' LEU . . . . . 0.658 ' O ' HD13 ' R' ' 82' ' ' ILE . 1.3 mt -92.11 -19.62 22.11 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.422 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -134.41 -55.61 0.85 Allowed 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 119.285 -0.966 . . . . 0.0 112.405 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -72.93 2.27 7.19 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 118.512 -1.275 . . . . 0.0 111.719 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 74' ' ' GLU . . . . . 0.401 ' OE2' ' CB ' ' R' ' 75' ' ' LEU . 0.4 OUTLIER -50.77 -43.79 58.53 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 179.82 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' R' ' 77' ' ' ALA . 5.4 tp -136.84 28.76 2.9 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.052 -1.431 . . . . 0.0 108.862 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 76' ' ' GLY . . . . . 0.462 ' C ' ' O ' ' R' ' 75' ' ' LEU . . . 23.16 37.49 0.01 OUTLIER Glycine 0 N--CA 1.504 3.198 0 O-C-N 124.347 1.03 . . . . 0.0 112.499 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 77' ' ' ALA . . . . . 0.598 ' N ' ' O ' ' R' ' 75' ' ' LEU . . . -76.6 -83.46 0.07 Allowed 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 119.709 -0.797 . . . . 0.0 110.985 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 78' ' ' GLY . . . . . 0.52 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 178.09 155.82 15.14 Favored Glycine 0 N--CA 1.488 2.165 0 C-N-CA 119.527 -1.32 . . . . 0.0 110.557 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.773 HD13 ' N ' ' R' ' 79' ' ' ILE . 0.8 OUTLIER -71.48 25.63 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 C-N-CA 119.887 -0.725 . . . . 0.0 112.168 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.52 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.2 -39.69 5.17 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 81' ' ' THR . . . . . 0.465 ' O ' ' N ' ' R' ' 83' ' ' THR . 18.2 p -94.91 -61.16 1.54 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.857 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 82' ' ' ILE . . . . . 0.658 HD13 ' O ' ' R' ' 71' ' ' LEU . 1.8 pp -43.43 -22.29 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 119.319 -0.953 . . . . 0.0 110.998 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.465 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -60.24 -81.98 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.036 -179.922 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.836 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -50.12 -26.01 4.06 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 118.738 -1.185 . . . . 0.0 110.015 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.95 -47.37 19.65 Favored Glycine 0 N--CA 1.486 1.981 0 C-N-CA 119.493 -1.337 . . . . 0.0 110.307 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.51 -56.18 2.43 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.103 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 87' ' ' ASN . . . . . 0.611 ' C ' ' H ' ' R' ' 89' ' ' LEU . 2.5 m-80 -43.41 -49.82 7.01 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.656 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 88' ' ' SER . . . . . 0.61 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.78 -1.05 0.5 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.377 -1.329 . . . . 0.0 109.954 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 89' ' ' LEU . . . . . 0.744 ' O ' ' N ' ' R' ' 91' ' ' ALA . 0.3 OUTLIER 27.59 33.37 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.172 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 90' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' R' ' 88' ' ' SER . 5.1 tptp 21.52 25.85 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 CA-C-N 114.249 -1.341 . . . . 0.0 113.404 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 91' ' ' ALA . . . . . 0.744 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -79.9 -20.65 45.33 Favored 'General case' 0 C--N 1.286 -2.171 0 C-N-CA 117.133 -1.827 . . . . 0.0 111.03 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.487 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -61.12 161.02 18.21 Favored Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.93 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 93' ' ' PRO . . . . . 0.487 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.9 Cg_endo -58.31 168.48 3.76 Favored 'Trans proline' 0 C--N 1.323 -0.8 0 C-N-CA 121.543 1.495 . . . . 0.0 111.525 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 12.5 t -91.46 -24.03 5.66 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.532 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.26 -9.23 38.56 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.515 -0.874 . . . . 0.0 110.996 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 96' ' ' LEU . . . . . 0.432 HD23 HD23 ' R' ' 100' ' ' LEU . 0.5 OUTLIER -66.33 -47.65 72.83 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.806 -0.758 . . . . 0.0 111.463 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -31.55 68.48 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.229 -0.989 . . . . 0.0 111.157 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -73.99 -19.69 60.57 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.206 -0.998 . . . . 0.0 111.298 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.66 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 1.8 t90 -96.14 -70.22 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.311 -0.955 . . . . 0.0 112.629 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.586 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.1 mm? -36.6 -52.35 0.87 Allowed 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.586 ' C ' ' O ' ' R' ' 100' ' ' LEU . 47.9 mt-10 -33.85 -42.06 0.11 Allowed 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.087 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' R' ' 100' ' ' LEU . 0.4 OUTLIER -85.17 -29.74 24.51 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 113.455 -1.702 . . . . 0.0 112.874 -179.949 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.66 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 4.7 t -80.79 -35.97 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 116.603 -2.039 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.37 -58.38 3.8 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 4.7 mt -47.51 -70.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 118.642 -1.223 . . . . 0.0 111.533 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -52.71 -60.94 2.64 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.993 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 107' ' ' SER . . . . . 0.407 ' C ' ' O ' ' R' ' 103' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 116.385 -1.769 . . . . 0.0 111.172 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mm-40 . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 121.029 0.442 . . . . 0.0 110.223 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' S' S ' 5' ' ' SER . . . . . 0.431 ' N ' ' HD3' ' S' ' 6' ' ' PRO . 17.5 m 52.07 58.74 15.33 Favored Pre-proline 0 C--N 1.302 -1.479 0 C-N-CA 119.862 -0.735 . . . . 0.0 111.801 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 6' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' S' ' 5' ' ' SER . 1.0 OUTLIER -63.84 -44.7 12.51 Favored 'Trans proline' 0 C--N 1.314 -1.25 0 C-N-CA 121.246 1.297 . . . . 0.0 110.54 179.898 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -61.29 137.8 58.24 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.753 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.33 -25.63 33.73 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.28 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 9' ' ' ALA . . . . . 0.431 ' O ' ' O ' ' S' ' 10' ' ' ALA . . . -163.45 -4.15 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.162 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 10' ' ' ALA . . . . . 0.431 ' O ' ' O ' ' S' ' 9' ' ' ALA . . . 52.67 168.01 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.519 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 13.7 mtm -145.16 143.41 30.32 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.7 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 12' ' ' ALA . . . . . 0.449 ' O ' ' N ' ' S' ' 14' ' ' GLN . . . -58.12 -94.85 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.24 -0.984 . . . . 0.0 110.648 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 64.49 -73.25 0.06 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.877 -0.729 . . . . 0.0 111.162 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 14' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' S' ' 12' ' ' ALA . 24.1 mt-30 -122.34 98.74 6.07 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.828 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 -88.21 157.4 18.81 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.241 -0.984 . . . . 0.0 110.944 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 16' ' ' HIS . . . . . 0.451 ' CG ' ' O ' ' S' ' 16' ' ' HIS . 58.1 t-80 -142.68 12.69 1.9 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.926 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.449 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.3 mt-30 -88.94 -83.92 0.22 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.928 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.478 ' H ' ' HG3' ' S' ' 18' ' ' GLU . 24.5 mt-10 -43.58 -32.74 1.0 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 19' ' ' TRP . . . . . 0.449 ' N ' ' C ' ' S' ' 17' ' ' GLN . 65.2 t-105 -48.5 -56.33 8.59 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 112.881 -1.963 . . . . 0.0 109.65 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.48 -35.9 42.05 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 113.693 -1.594 . . . . 0.0 111.679 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.559 ' O ' ' C ' ' S' ' 22' ' ' PHE . 50.4 mtt-85 -63.35 -73.24 0.12 Allowed 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.566 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.637 ' CE1' HD12 ' S' ' 26' ' ' LEU . 1.5 t80 -24.92 -50.68 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.643 0.735 . . . . 0.0 111.34 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.414 ' O ' ' C ' ' S' ' 24' ' ' ASP . 24.8 t -70.56 -46.78 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.787 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' S' ' 21' ' ' ARG . 16.8 t0 -36.64 -62.95 0.44 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.919 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.426 ' H ' ' HG ' ' S' ' 25' ' ' LEU . 0.3 OUTLIER -64.0 -49.88 70.7 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 118.658 -1.217 . . . . 0.0 110.391 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.637 HD12 ' CE1' ' S' ' 22' ' ' PHE . 0.7 OUTLIER -40.1 -63.27 0.63 Allowed 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.879 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -57.04 6.39 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.404 -0.918 . . . . 0.0 112.606 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -64.36 -16.84 63.02 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.099 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 29' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' S' ' 31' ' ' GLN . . . -90.36 -47.9 7.46 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 118.933 -1.107 . . . . 0.0 112.491 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 30' ' ' TYR . . . . . 0.413 ' C ' ' O ' ' S' ' 29' ' ' ALA . 0.4 OUTLIER -40.19 -26.8 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.376 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 31' ' ' GLN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.3 tt0 -75.71 -37.93 59.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.384 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 18.1 t-20 -95.1 -8.33 36.85 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.6 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.5 t0 84.71 23.05 0.1 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 123.626 0.579 . . . . 0.0 110.794 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.88 -16.46 31.88 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.025 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 35' ' ' HIS . . . . . 0.476 ' O ' HD22 ' S' ' 39' ' ' LEU . 26.4 p-80 -54.95 -25.3 28.6 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 113.97 -1.468 . . . . 0.0 113.018 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 5.6 mt -70.75 -63.34 1.63 Allowed Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.417 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.7 Cg_endo -54.61 -36.54 89.6 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 C-N-CA 120.636 0.89 . . . . 0.0 111.57 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 38' ' ' LEU . . . . . 0.511 ' O ' ' SD ' ' S' ' 42' ' ' MET . 19.7 mt -74.8 -37.52 62.33 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.656 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.476 HD22 ' O ' ' S' ' 35' ' ' HIS . 0.1 OUTLIER -53.07 -38.31 62.4 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.384 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -76.27 7.62 4.12 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.95 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.57 -55.62 2.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.724 -0.79 . . . . 0.0 112.457 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 42' ' ' MET . . . . . 0.643 ' HB3' HG22 ' R' ' 55' ' ' VAL . 0.0 OUTLIER -78.67 6.38 8.96 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 118.496 -1.282 . . . . 0.0 111.474 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 68.6 mt -127.38 -175.62 3.5 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.68 HG22 ' HD3' ' S' ' 45' ' ' PRO 0.299 0.3 OUTLIER -129.23 -147.34 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.364 0 C-N-CA 118.681 -1.207 . . . . 0.0 109.51 -179.91 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.68 ' HD3' HG22 ' S' ' 44' ' ' THR . 8.0 Cg_endo -96.55 -42.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.218 -0.492 0 CA-C-N 120.147 1.088 . . . . 0.0 110.566 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -52.27 -29.94 25.48 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.891 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -59.92 -54.21 48.8 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.645 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.1 -39.82 60.37 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.471 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 49' ' ' GLU . . . . . 0.431 ' O ' ' OG1' ' S' ' 53' ' ' THR . 85.6 mt-10 -82.34 -68.65 0.68 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.831 -1.148 . . . . 0.0 112.49 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 50' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -49.68 -50.01 45.25 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 51' ' ' LEU . . . . . 0.662 HD12 ' C ' ' S' ' 51' ' ' LEU . 0.4 OUTLIER -60.08 -40.97 91.43 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 118.155 -1.418 . . . . 0.0 110.7 -179.947 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 52' ' ' GLY . . . . . 0.463 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -61.4 -30.96 75.65 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.518 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -65.16 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 114.748 -0.726 . . . . 0.0 110.733 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -41.35 -24.11 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 55' ' ' VAL . . . . . 0.485 ' N ' ' O ' ' S' ' 53' ' ' THR . 12.9 t -71.42 -44.28 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 117.957 -1.497 . . . . 0.0 107.627 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.3 OUTLIER -59.55 -48.65 80.81 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.997 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 mt -57.44 -63.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.968 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 79.5 t -46.5 -59.92 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 C-N-CA 118.243 -1.383 . . . . 0.0 111.467 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -61.02 -18.8 59.75 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.502 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -79.95 -39.38 30.32 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.657 -1.217 . . . . 0.0 111.002 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.15 -29.7 64.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.95 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.97 -66.59 0.36 Allowed 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 118.981 -1.088 . . . . 0.0 109.719 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 63' ' ' ARG . . . . . 0.678 ' O ' ' N ' ' S' ' 65' ' ' GLU . 0.0 OUTLIER -78.61 -44.0 25.01 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 179.773 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.431 ' C ' ' N ' ' S' ' 66' ' ' MET . . . 13.75 38.65 0.0 OUTLIER Glycine 0 N--CA 1.503 3.101 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.469 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 65' ' ' GLU . . . . . 0.678 ' N ' ' O ' ' S' ' 63' ' ' ARG . 0.0 OUTLIER -47.05 -25.41 0.82 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 118.542 -1.263 . . . . 0.0 109.177 179.726 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 66' ' ' MET . . . . . 0.431 ' N ' ' C ' ' S' ' 64' ' ' GLY . 0.5 OUTLIER -139.5 109.46 6.38 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.144 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 11.5 p -168.75 82.68 0.15 Allowed 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.297 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.585 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.0 OUTLIER -125.26 -17.16 5.74 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.521 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 69' ' ' ARG . . . . . 0.685 ' O ' ' N ' ' S' ' 71' ' ' LEU . 1.4 tpt180 -68.41 27.45 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.609 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.585 ' H ' ' C ' ' S' ' 68' ' ' GLN . 6.6 mt-10 13.11 40.09 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 71' ' ' LEU . . . . . 0.685 ' N ' ' O ' ' S' ' 69' ' ' ARG . 5.7 mp 11.13 -73.67 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 72' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' S' ' 70' ' ' GLU . 1.1 tptm 84.31 -156.66 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 O-C-N 123.791 0.682 . . . . 0.0 109.992 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 73' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' S' ' 77' ' ' ALA . 14.4 t-20 -107.74 6.51 27.69 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.319 -0.952 . . . . 0.0 112.281 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 74' ' ' GLU . . . . . 0.482 ' C ' ' O ' ' S' ' 73' ' ' ASN . 1.4 mt-10 -44.99 -44.67 10.09 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 tp -145.0 21.4 1.59 Allowed 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.929 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -129.94 -100.02 0.9 Allowed Glycine 0 N--CA 1.499 2.841 0 C-N-CA 118.829 -1.653 . . . . 0.0 112.96 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 77' ' ' ALA . . . . . 0.52 ' O ' ' ND2' ' S' ' 73' ' ' ASN . . . -147.29 -59.34 0.27 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.202 -0.999 . . . . 0.0 112.688 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 179.24 161.06 26.09 Favored Glycine 0 N--CA 1.491 2.331 0 C-N-CA 118.666 -1.731 . . . . 0.0 111.593 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.937 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -59.73 -28.69 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 115.093 -0.554 . . . . 0.0 111.249 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.448 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.38 -55.29 16.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.508 -0.877 . . . . 0.0 113.248 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.751 HG22 ' HE1' ' R' ' 109' ' ' TRP . 80.9 p -46.52 -51.61 15.03 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 82' ' ' ILE . . . . . 0.409 ' H ' HG23 ' S' ' 82' ' ' ILE . 7.3 pt -70.81 11.47 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 C-N-CA 119.165 -1.014 . . . . 0.0 113.304 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -120.9 -46.48 2.34 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.062 179.89 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 84' ' ' ARG . . . . . 0.482 ' C ' ' H ' ' S' ' 86' ' ' SER . 3.0 ptm180 -63.89 -23.02 67.19 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.974 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.55 -4.9 1.54 Allowed Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.217 -1.468 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 86' ' ' SER . . . . . 0.482 ' H ' ' C ' ' S' ' 84' ' ' ARG . 1.0 OUTLIER -157.24 -12.92 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.542 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -92.91 -22.6 19.14 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.72 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 88' ' ' SER . . . . . 0.414 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.4 OUTLIER -75.85 -37.51 58.91 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.58 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 89' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' S' ' 88' ' ' SER . 26.4 mt -37.62 -43.7 0.64 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 120.229 -0.589 . . . . 0.0 111.844 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -42.66 -64.3 0.64 Allowed 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.47 15.69 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.825 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 92' ' ' ALA . . . . . 0.624 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -59.28 164.84 4.38 Favored Pre-proline 0 N--CA 1.489 1.492 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.035 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 93' ' ' PRO . . . . . 0.624 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 21.4 Cg_exo -45.55 133.39 12.99 Favored 'Trans proline' 0 C--N 1.321 -0.913 0 C-N-CA 121.871 1.714 . . . . 0.0 112.49 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 4.1 t -108.92 -5.25 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.251 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.94 -7.16 1.58 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.932 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 2.7 mt -75.8 -32.96 60.1 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.716 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -37.47 72.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.456 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -72.47 -30.47 64.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.051 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.544 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 16.7 t90 -88.2 -61.77 1.64 Allowed 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.657 ' HA ' HG23 ' S' ' 103' ' ' VAL . 0.3 OUTLIER -52.36 -32.61 39.23 Favored 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 115.435 1.642 . . . . 0.0 115.435 -179.64 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' S' ' 100' ' ' LEU . 0.4 OUTLIER -43.78 -27.95 0.38 Allowed 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 117.751 -1.58 . . . . 0.0 106.953 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' S' S ' 102' ' ' GLU . . . . . 0.526 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.8 mt-10 -94.98 -28.24 15.24 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.122 -1.853 . . . . 0.0 112.942 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.657 HG23 ' HA ' ' S' ' 100' ' ' LEU . 2.1 t -77.65 -28.65 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 114.893 -2.723 . . . . 0.0 108.322 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.66 -56.82 4.32 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.458 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 6.5 mt -60.78 -69.42 0.23 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.709 -1.196 . . . . 0.0 110.957 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' S' S ' 106' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' S' ' 107' ' ' SER . 1.7 ttmm -96.86 162.38 13.44 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.406 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' S' S ' 107' ' ' SER . . . . . 0.466 ' N ' ' CG ' ' S' ' 106' ' ' LYS . 81.8 p . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 116.243 -1.837 . . . . 0.0 110.844 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.407 ' CE2' ' HG2' ' R' ' 54' ' ' ARG . 32.0 m-90 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 116.478 -1.725 . . . . 0.0 110.152 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.751 ' HE1' HG22 ' S' ' 81' ' ' THR . 11.5 m-90 . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 116.418 -1.753 . . . . 0.0 110.114 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 4' ' ' GLN . . . . . 0.508 HE21 ' N ' ' R' ' 4' ' ' GLN . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.881 0.372 . . . . 0.0 110.171 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 5' ' ' SER . . . . . 0.519 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.2 OUTLIER -87.8 -46.08 0.48 Allowed Pre-proline 0 C--N 1.305 -1.354 0 C-N-CA 118.971 -1.092 . . . . 0.0 112.304 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 6' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.7 Cg_endo -68.39 141.68 52.06 Favored 'Trans proline' 0 C--N 1.32 -0.924 0 C-N-CA 120.699 0.933 . . . . 0.0 111.019 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.13 179.47 2.35 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 118.991 -1.084 . . . . 0.0 110.852 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.61 -27.87 1.29 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.647 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -112.97 58.98 0.65 Allowed 'General case' 0 N--CA 1.487 1.378 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.436 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.23 120.86 25.9 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.857 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 21.8 mmt -88.09 123.26 32.59 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.747 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.89 113.92 7.58 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.531 -0.868 . . . . 0.0 111.534 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.78 103.91 0.3 Allowed 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.343 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -43.29 147.46 0.37 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.429 -0.909 . . . . 0.0 111.38 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -97.33 78.61 2.72 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.588 -0.845 . . . . 0.0 111.374 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 16' ' ' HIS . . . . . 0.424 ' H ' ' H ' ' R' ' 17' ' ' GLN . 0.9 OUTLIER -157.1 -4.74 0.1 Allowed 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.076 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.424 ' H ' ' H ' ' R' ' 16' ' ' HIS . 1.1 mt-30 -91.42 -85.56 0.23 Allowed 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.231 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 18' ' ' GLU . . . . . 0.436 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.5 OUTLIER -45.52 -33.96 3.02 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 123.106 1.431 . . . . 0.0 107.66 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -52.71 -58.55 6.46 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 112.925 -1.943 . . . . 0.0 108.175 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.68 -28.66 65.96 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.695 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.535 ' O ' ' C ' ' R' ' 22' ' ' PHE . 10.4 mmt-85 -56.3 -68.02 0.25 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 117.885 -1.526 . . . . 0.0 110.144 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.535 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -33.3 -40.09 0.06 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.049 179.613 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 23' ' ' VAL . . . . . 0.428 ' N ' ' O ' ' R' ' 21' ' ' ARG . 14.9 t -72.05 -47.47 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 C-N-CA 119.469 -0.893 . . . . 0.0 110.44 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' R' ' 21' ' ' ARG . 36.0 t70 -45.5 -21.34 0.09 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.241 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 -43.37 6.36 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.994 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 tt -47.74 -38.0 14.46 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.325 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttp -76.64 -38.55 54.46 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -82.88 -2.2 54.17 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.113 -1.035 . . . . 0.0 113.63 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.478 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -115.47 -30.97 6.06 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.144 -1.022 . . . . 0.0 113.426 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -44.01 -38.95 3.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.111 -1.035 . . . . 0.0 112.164 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.76 -29.71 58.9 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.524 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.5 m-20 -87.86 -11.32 48.14 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 118.981 -1.088 . . . . 0.0 111.377 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 2.5 t70 81.19 24.69 0.27 Allowed 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.773 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 34' ' ' LEU . . . . . 0.478 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 1.7 mm? -95.7 -22.15 17.73 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.821 0.82 . . . . 0.0 109.828 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 35' ' ' HIS . . . . . 0.425 ' O ' HD13 ' R' ' 39' ' ' LEU . 37.9 p-80 -52.82 -18.26 1.79 Allowed 'General case' 0 C--N 1.295 -1.804 0 CA-C-N 114.227 -1.352 . . . . 0.0 113.068 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.474 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.5 mt -78.82 -65.69 0.31 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 118.503 -1.279 . . . . 0.0 111.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.474 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.1 Cg_endo -50.93 -28.13 23.0 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 120.541 0.828 . . . . 0.0 110.227 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 7.2 mt -82.54 -34.83 27.72 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 119.354 -0.939 . . . . 0.0 111.482 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -58.14 -26.36 62.58 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.775 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.87 15.28 8.67 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 118.825 -1.15 . . . . 0.0 109.204 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 41' ' ' LEU . . . . . 0.55 HD23 HH21 ' S' ' 54' ' ' ARG . 1.8 tp -114.2 -63.6 1.43 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.376 -0.829 . . . . 0.0 113.007 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.6 OUTLIER -62.56 7.46 0.07 Allowed 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 117.443 -1.703 . . . . 0.0 112.253 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 43' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' R' ' 41' ' ' LEU . 2.3 pp -150.95 -177.25 5.9 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.389 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.6 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.312 0.3 OUTLIER -119.04 -150.82 0.01 OUTLIER Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.327 -179.846 . . . . . . . . 4 4 . 1 . 005 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.6 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.6 Cg_endo -93.37 -42.69 0.03 OUTLIER 'Trans proline' 0 C--O 1.213 -0.745 0 CA-C-N 119.228 0.76 . . . . 0.0 110.614 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.35 -21.98 6.64 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.391 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.5 ' HG3' ' H ' ' R' ' 44' ' ' THR . 2.3 mt-10 -76.71 -41.89 43.48 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.018 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -62.63 -30.43 71.35 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.63 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -73.6 -62.97 1.3 Allowed 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.915 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.489 ' C ' HH21 ' R' ' 54' ' ' ARG . . . -52.73 -31.37 37.52 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.574 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.0 mt -56.36 -61.27 2.52 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.97 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.28 -53.37 9.47 Favored Glycine 0 N--CA 1.484 1.843 0 C-N-CA 119.119 -1.515 . . . . 0.0 110.009 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.48 ' O ' HG22 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -39.71 -80.1 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.559 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.489 HH21 ' C ' ' R' ' 50' ' ' ALA . 20.7 mtt180 -38.11 -53.74 1.39 Allowed 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.51 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 5.8 t -63.21 -31.18 51.77 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.75 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.95 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -78.67 -33.59 46.94 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.161 -1.416 . . . . 0.0 111.468 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 0.798 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -82.67 -34.99 12.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 117.754 -1.578 . . . . 0.0 108.264 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 0.798 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.6 t -59.61 -53.49 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.419 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.471 ' O ' ' N ' ' R' ' 63' ' ' ARG . 27.2 mt-10 -58.65 -46.84 86.26 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.012 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -48.36 -31.1 5.65 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.768 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 61' ' ' LEU . . . . . 0.412 HD23 ' O ' ' R' ' 66' ' ' MET . 96.3 mt -96.92 -24.68 15.73 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.189 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp -97.06 -0.51 47.07 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 119.365 -0.934 . . . . 0.0 111.484 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 63' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' R' ' 59' ' ' GLU . 14.6 tpp180 -63.83 -71.43 0.17 Allowed 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 118.654 -1.219 . . . . 0.0 109.017 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -127.73 -68.71 0.15 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.268 -1.533 . . . . 0.0 109.268 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.502 ' O ' ' C ' ' R' ' 66' ' ' MET . 31.5 mt-10 -153.39 -48.02 0.09 Allowed 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 120.166 -0.614 . . . . 0.0 109.839 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 66' ' ' MET . . . . . 0.502 ' C ' ' O ' ' R' ' 65' ' ' GLU . 0.0 OUTLIER -8.21 111.23 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.771 1.294 . . . . 0.0 113.514 179.986 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 97.5 p -154.59 60.39 0.68 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.044 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 68' ' ' GLN . . . . . 0.531 ' C ' ' H ' ' R' ' 70' ' ' GLU . 2.9 mt-30 -130.41 -43.56 1.15 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 120.039 -0.665 . . . . 0.0 110.486 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.15 31.5 0.07 Allowed 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 120.079 -0.649 . . . . 0.0 110.901 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 70' ' ' GLU . . . . . 0.531 ' H ' ' C ' ' R' ' 68' ' ' GLN . 0.2 OUTLIER -89.03 10.2 22.48 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.893 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mt -51.37 176.87 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.211 -0.996 . . . . 0.0 110.666 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -118.66 118.4 31.54 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.961 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -101.24 -107.07 0.23 Allowed 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.335 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -153.73 -61.57 0.14 Allowed 'General case' 0 C--N 1.28 -2.443 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.881 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 75' ' ' LEU . . . . . . . . . . . . . 46.5 mt -85.72 -24.27 27.02 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.308 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -47.3 -71.56 0.53 Allowed Glycine 0 N--CA 1.489 2.175 0 C-N-CA 119.637 -1.268 . . . . 0.0 110.642 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -150.53 -101.44 0.07 Allowed 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.169 -1.012 . . . . 0.0 110.794 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -178.66 155.46 16.52 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 119.221 -1.466 . . . . 0.0 110.723 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.794 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -46.74 -47.67 7.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.466 -179.987 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.423 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -59.83 -62.15 2.09 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 118.768 -1.173 . . . . 0.0 110.637 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 43.9 m -39.23 -47.76 1.7 Allowed 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 pt -77.32 -13.11 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.48 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -87.72 -58.94 2.39 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.607 -1.237 . . . . 0.0 112.099 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.633 ' NE ' ' CD1' ' R' ' 1' ' ' TRP . 0.0 OUTLIER -65.92 6.6 0.35 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.362 -179.887 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' R' R ' 85' ' ' GLY . . . . . 0.482 ' HA3' HD11 ' R' ' 57' ' ' ILE . . . -102.51 -33.82 4.35 Favored Glycine 0 N--CA 1.492 2.378 0 C-N-CA 119.69 -1.243 . . . . 0.0 110.412 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 1.5 t -83.07 -30.59 27.9 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.477 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -93.63 8.42 40.94 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.956 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.41 -27.26 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.29 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 90.2 mt -44.11 -28.09 0.46 Allowed 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.202 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 90' ' ' LYS . . . . . 0.409 ' O ' ' C ' ' R' ' 91' ' ' ALA . 18.3 mttt -80.9 -71.45 0.47 Allowed 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.309 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -36.72 -63.18 0.43 Allowed 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.163 -1.38 . . . . 0.0 111.959 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -40.72 109.06 0.59 Allowed Pre-proline 0 N--CA 1.488 1.438 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.915 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -55.92 156.41 19.68 Favored 'Trans proline' 0 C--O 1.215 -0.629 0 C-N-CA 120.667 0.911 . . . . 0.0 111.83 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.5 -41.41 90.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.38 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -66.44 -27.93 68.2 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.803 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -39.05 83.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.545 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -27.83 63.39 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.467 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 1.5 pt20 -75.31 -22.37 57.74 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.104 -1.039 . . . . 0.0 109.96 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.699 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 2.9 t90 -95.56 -66.48 0.91 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.509 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.2 mm? -41.16 -38.01 1.0 Allowed 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.509 ' C ' ' O ' ' R' ' 100' ' ' LEU . 7.3 mt-10 -41.31 -39.16 1.33 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 117.874 -1.53 . . . . 0.0 107.702 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.403 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.1 mt-10 -90.01 -27.63 19.63 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 113.428 -1.715 . . . . 0.0 112.427 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.699 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.3 t -89.05 -7.94 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 117.361 -1.736 . . . . 0.0 110.746 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 8.6 tp -97.93 -54.03 3.21 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.507 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -69.28 -68.3 0.41 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 118.76 -1.176 . . . . 0.0 110.765 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -48.68 -23.93 1.2 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.91 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 19.5 t . . . . . 0 C--N 1.306 -1.319 0 CA-C-O 116.357 -1.782 . . . . 0.0 110.785 -179.974 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.44 164.0 0.53 Allowed Pre-proline 0 N--CA 1.487 1.386 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.479 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -60.04 -20.86 62.84 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 C-N-CA 121.129 1.219 . . . . 0.0 110.452 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.62 145.9 55.48 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.16 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 8' ' ' SER . . . . . 0.516 ' O ' ' HB2' ' S' ' 9' ' ' ALA . 74.4 m -103.62 -107.4 0.27 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.606 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 9' ' ' ALA . . . . . 0.516 ' HB2' ' O ' ' S' ' 8' ' ' SER . . . 174.49 139.33 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.202 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.57 105.2 2.16 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.543 -0.863 . . . . 0.0 110.68 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 11' ' ' MET . . . . . 0.461 ' CG ' ' O ' ' S' ' 11' ' ' MET . 3.2 ptp -57.12 98.55 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.042 -1.063 . . . . 0.0 110.404 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -143.19 -54.73 0.39 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.717 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -79.29 -10.1 59.74 Favored 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.089 -1.044 . . . . 0.0 110.453 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -85.99 100.16 11.95 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.071 -1.052 . . . . 0.0 109.766 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.97 120.46 5.38 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 118.887 -1.125 . . . . 0.0 110.392 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.23 -25.17 0.06 Allowed 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.326 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.429 ' O ' ' C ' ' S' ' 18' ' ' GLU . 4.0 mt-30 -85.53 -69.57 0.65 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.693 179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.429 ' C ' ' O ' ' S' ' 17' ' ' GLN . 3.3 mp0 -43.55 -41.39 4.47 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 123.133 1.444 . . . . 0.0 107.862 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.265 42.3 t-105 -52.73 -53.72 43.79 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 111.958 -2.383 . . . . 0.0 108.899 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.11 -37.54 72.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 113.8 -1.545 . . . . 0.0 110.759 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.507 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.6 mmt180 -51.0 -70.75 0.08 Allowed 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 118.283 -1.367 . . . . 0.0 109.28 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.507 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.53 -42.93 0.06 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.333 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 3.6 t -81.6 -33.15 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.119 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.498 ' N ' ' O ' ' S' ' 21' ' ' ARG . 55.6 t0 -53.42 -34.64 58.58 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 120.075 -0.65 . . . . 0.0 112.273 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.96 -44.55 7.65 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.664 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.73 HD21 HD22 ' S' ' 39' ' ' LEU . 0.1 OUTLIER -45.01 -49.5 11.27 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.298 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.95 -71.18 0.07 Allowed 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.37 -0.932 . . . . 0.0 112.743 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.19 -5.86 1.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.791 -0.764 . . . . 0.0 113.054 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.55 -46.16 7.09 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.712 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -45.71 -52.5 10.84 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.618 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -42.0 -30.72 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.849 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.43 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 56.5 m-20 -99.5 -84.72 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 119.625 -0.83 . . . . 0.0 110.658 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.553 ' H ' HD22 ' S' ' 34' ' ' LEU . 0.5 OUTLIER 170.95 23.43 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 119.253 -0.979 . . . . 0.0 112.151 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 34' ' ' LEU . . . . . 0.848 HD22 ' N ' ' S' ' 34' ' ' LEU . 1.3 mm? -94.43 -14.63 25.03 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.0 -1.08 . . . . 0.0 109.856 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 35' ' ' HIS . . . . . 0.688 ' O ' HD23 ' S' ' 39' ' ' LEU . 38.4 p-80 -48.76 -28.56 3.72 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.735 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.453 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.8 mt -72.74 -63.33 1.14 Allowed Pre-proline 0 C--N 1.303 -1.439 0 C-N-CA 118.285 -1.366 . . . . 0.0 111.419 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -52.28 -21.62 13.75 Favored 'Trans proline' 0 C--N 1.321 -0.882 0 C-N-CA 121.088 1.192 . . . . 0.0 111.376 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 23.5 mt -86.12 -44.51 12.18 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.73 HD22 HD21 ' S' ' 26' ' ' LEU . 0.9 OUTLIER -49.39 -45.55 46.25 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.12 -1.032 . . . . 0.0 109.858 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 40' ' ' ASN . . . . . 0.542 ' O ' ' N ' ' R' ' 1' ' ' TRP . 1.0 OUTLIER -60.87 -4.0 0.89 Allowed 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.618 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 mp -103.66 -59.25 1.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.091 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 42' ' ' MET . . . . . 0.48 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -95.64 22.66 6.9 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.586 -179.805 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 43' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.1 OUTLIER -169.39 123.85 0.81 Allowed 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.586 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.75 -41.54 0.0 OUTLIER Pre-proline 0 N--CA 1.484 1.261 0 C-N-CA 117.084 -1.846 . . . . 0.0 114.855 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.586 ' HD2' ' H ' ' S' ' 44' ' ' THR . 19.1 Cg_endo -79.43 -109.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 121.12 1.213 . . . . 0.0 113.196 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 46' ' ' ASP . . . . . 0.444 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 2.3 m-20 -50.66 -12.8 0.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.488 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 47' ' ' GLU . . . . . 0.473 ' N ' ' C ' ' S' ' 45' ' ' PRO . 8.9 mm-40 -75.94 -71.82 0.36 Allowed 'General case' 0 C--N 1.297 -1.676 0 C-N-CA 119.544 -0.862 . . . . 0.0 110.582 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -49.55 -15.43 0.16 Allowed 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.894 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' C ' ' S' ' 47' ' ' GLU . 9.8 mm-40 -91.45 -69.11 0.75 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.433 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.04 -27.69 69.28 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.211 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.54 -63.59 1.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.629 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 52' ' ' GLY . . . . . 0.436 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -45.72 -48.15 13.05 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.013 -1.635 . . . . 0.0 109.013 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.509 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -45.43 -74.54 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.616 0.722 . . . . 0.0 111.86 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.55 HH21 HD23 ' R' ' 41' ' ' LEU . 0.0 OUTLIER -35.24 -58.99 0.54 Allowed 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.71 -1.132 . . . . 0.0 112.873 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 16.1 t -59.62 -25.28 31.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 C-N-CA 117.465 -1.694 . . . . 0.0 110.971 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -79.3 -38.72 34.63 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.296 -1.362 . . . . 0.0 111.443 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 0.751 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -79.08 -34.65 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 117.801 -1.56 . . . . 0.0 108.827 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 58' ' ' VAL . . . . . 0.751 ' N ' HD13 ' S' ' 57' ' ' ILE . 78.1 t -68.68 -63.11 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.183 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -50.19 -31.14 13.02 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.412 -1.315 . . . . 0.0 110.193 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 60' ' ' GLU . . . . . 0.415 ' CG ' ' O ' ' S' ' 56' ' ' ARG . 7.7 mm-40 -62.12 -62.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.551 -0.86 . . . . 0.0 112.089 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 61' ' ' LEU . . . . . 0.501 ' C ' HD12 ' S' ' 61' ' ' LEU . 4.6 pp -62.45 -8.63 6.46 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 117.738 -1.585 . . . . 0.0 109.716 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 62' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' S' ' 64' ' ' GLY . 2.3 tp -79.97 33.02 0.27 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.717 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 63' ' ' ARG . . . . . 0.488 ' H ' ' C ' ' S' ' 61' ' ' LEU . 19.7 mtm180 22.64 35.87 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.979 0 O-C-N 124.555 1.16 . . . . 0.0 113.736 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.598 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -96.28 -30.06 8.02 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -119.52 -73.23 0.65 Allowed 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.563 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 66' ' ' MET . . . . . 0.449 ' O ' ' CB ' ' S' ' 67' ' ' SER . 1.5 mmt -121.27 -134.55 0.31 Allowed 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.453 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 67' ' ' SER . . . . . 0.546 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.3 OUTLIER 165.08 -64.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 119.941 -0.704 . . . . 0.0 109.671 -179.992 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.513 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.9 OUTLIER -29.61 -33.65 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.74 179.745 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' S' ' 67' ' ' SER . 1.6 tpt180 -70.75 33.14 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 120.212 -0.595 . . . . 0.0 112.025 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.513 ' H ' ' C ' ' S' ' 68' ' ' GLN . 5.0 tt0 -81.24 -21.09 39.72 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.459 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 10.7 mt -83.07 140.82 32.45 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.156 -1.017 . . . . 0.0 111.13 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.58 126.93 27.43 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.249 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 22.9 m120 -99.2 -103.13 0.22 Allowed 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.83 0.824 . . . . 0.0 110.839 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -140.61 -56.97 0.52 Allowed 'General case' 0 C--N 1.283 -2.3 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.139 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 tp -121.01 13.37 11.32 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.25 -55.83 27.98 Favored Glycine 0 N--CA 1.492 2.416 0 C-N-CA 119.816 -1.183 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -163.71 -68.98 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.984 -1.087 . . . . 0.0 111.225 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 78' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . 149.38 131.18 1.93 Allowed Glycine 0 N--CA 1.488 2.134 0 C-N-CA 119.372 -1.394 . . . . 0.0 110.371 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.901 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.78 -36.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.237 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.91 -44.26 73.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.583 -0.847 . . . . 0.0 112.314 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.448 HG22 ' HE1' ' R' ' 109' ' ' TRP . 25.3 p -62.54 -40.9 98.29 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 pt -73.35 -15.07 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 119.344 -0.943 . . . . 0.0 112.758 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.434 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -81.51 -57.21 3.57 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.492 -1.283 . . . . 0.0 111.391 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -68.68 -4.55 16.11 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.008 -1.077 . . . . 0.0 110.747 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.86 -25.55 60.0 Favored Glycine 0 N--CA 1.488 2.104 0 C-N-CA 119.321 -1.418 . . . . 0.0 110.124 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 41.8 p -105.94 -34.91 7.46 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.657 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 87' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' S' ' 89' ' ' LEU . 24.3 m120 -77.0 12.99 1.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.909 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -38.71 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.294 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 89' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' S' ' 87' ' ' ASN . 1.0 OUTLIER -42.02 -66.37 0.36 Allowed 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.646 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.49 -62.09 1.78 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.687 -1.205 . . . . 0.0 111.669 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.35 -70.85 0.09 Allowed 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.168 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.64 148.54 90.19 Favored Pre-proline 0 N--CA 1.489 1.498 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.908 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -55.0 159.54 9.38 Favored 'Trans proline' 0 C--N 1.325 -0.667 0 C-N-CA 121.066 1.177 . . . . 0.0 110.996 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -83.24 -32.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.917 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -67.46 -20.95 65.55 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.648 -0.821 . . . . 0.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 1.2 tp -62.02 -36.35 81.29 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.576 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -16.29 38.75 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.256 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -101.49 -35.47 9.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.234 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.625 ' CH2' HG21 ' S' ' 103' ' ' VAL . 19.6 t90 -66.6 -62.29 1.53 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.911 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.529 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -57.07 -32.57 66.39 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -179.711 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.529 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.9 mm-40 -42.77 -29.65 0.33 Allowed 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 117.692 -1.603 . . . . 0.0 106.746 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 102' ' ' GLU . . . . . 0.528 ' N ' ' C ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -94.99 -26.41 16.11 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.987 -1.915 . . . . 0.0 112.157 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.625 HG21 ' CH2' ' S' ' 99' ' ' TRP . 14.0 t -83.28 -14.83 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 C-N-CA 115.964 -2.294 . . . . 0.0 108.102 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 104' ' ' LEU . . . . . 0.404 ' HA ' HD12 ' S' ' 104' ' ' LEU . 19.9 tp -83.56 -53.48 5.64 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.203 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 86.4 mt -77.8 -80.03 0.11 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' S' S ' 106' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' S' ' 102' ' ' GLU . 16.2 mtpt -95.51 -160.05 0.76 Allowed 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.166 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' S' S ' 107' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' S' ' 102' ' ' GLU . 65.5 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 116.445 -1.74 . . . . 0.0 111.533 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.633 ' CD1' ' NE ' ' R' ' 84' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 116.255 -1.831 . . . . 0.0 110.296 . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.467 ' HB3' HG23 ' R' ' 44' ' ' THR . 1.1 m-90 . . . . . 0 N--CA 1.483 1.223 0 CA-C-O 116.351 -1.785 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' R' R ' 5' ' ' SER . . . . . 0.568 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.0 OUTLIER -84.96 -43.44 0.68 Allowed Pre-proline 0 C--N 1.306 -1.316 0 C-N-CA 119.293 -0.963 . . . . 0.0 112.41 -179.934 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 6' ' ' PRO . . . . . 0.568 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.0 OUTLIER -70.26 117.3 5.04 Favored 'Trans proline' 0 C--N 1.32 -0.972 0 C-N-CA 121.027 1.151 . . . . 0.0 111.414 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.61 123.8 36.17 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.755 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 1.1 p -157.4 76.68 0.83 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.586 -0.846 . . . . 0.0 110.728 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.76 -168.97 2.34 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.882 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.94 143.37 32.22 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.988 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -114.18 165.92 12.16 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.423 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.91 139.62 34.54 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.967 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -132.17 13.29 4.68 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 119.964 -0.694 . . . . 0.0 110.405 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 81.1 mm-40 51.84 91.5 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.433 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -84.11 95.0 8.47 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.152 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 16' ' ' HIS . . . . . 0.464 ' CG ' ' O ' ' R' ' 16' ' ' HIS . 76.8 t60 -111.62 6.74 20.18 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.6 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' R' ' 18' ' ' GLU . 1.0 OUTLIER -91.05 -80.19 0.35 Allowed 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.358 -0.937 . . . . 0.0 111.36 -179.939 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.0 OUTLIER -44.33 -35.06 2.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 123.231 1.491 . . . . 0.0 107.824 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -52.69 -61.34 2.35 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 112.33 -2.214 . . . . 0.0 109.16 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -47.11 -44.4 21.37 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.459 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 1.0 OUTLIER -47.77 -73.1 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 118.645 -1.222 . . . . 0.0 109.639 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -25.45 -47.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.156 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 23' ' ' VAL . . . . . 0.435 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.5 t -71.14 -53.32 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 118.956 -1.097 . . . . 0.0 111.478 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 32.9 t0 -35.68 -65.19 0.26 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.647 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.11 -48.43 70.75 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.13 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.37 -46.44 62.76 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.545 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -61.6 -45.0 95.96 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 -74.73 -36.02 62.66 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.473 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -70.25 -29.26 66.02 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.622 -1.231 . . . . 0.0 113.077 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 30' ' ' TYR . . . . . 0.429 ' CD2' ' N ' ' R' ' 31' ' ' GLN . 23.7 t80 -42.01 -60.25 1.48 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.005 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 31' ' ' GLN . . . . . 0.429 ' N ' ' CD2' ' R' ' 30' ' ' TYR . 1.8 tt0 -60.43 -28.84 68.6 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.084 -1.046 . . . . 0.0 110.703 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 32' ' ' ASN . . . . . 0.436 ' OD1' ' NE1' ' S' ' 99' ' ' TRP . 0.2 OUTLIER -80.78 -15.86 55.32 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.534 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 33' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 74.15 23.98 2.02 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.949 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.82 -10.52 20.65 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 114.724 -1.125 . . . . 0.0 108.712 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -53.77 -15.57 1.33 Allowed 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.225 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -77.75 -65.4 0.36 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 117.544 -1.663 . . . . 0.0 110.662 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.8 Cg_exo -50.19 -31.76 29.99 Favored 'Trans proline' 0 C--N 1.321 -0.889 0 N-CA-C 109.686 -0.929 . . . . 0.0 109.686 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 5.6 mt -73.39 -40.41 64.35 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.443 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -60.01 -22.5 62.68 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.205 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -91.53 11.48 23.98 Favored 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.513 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.19 -64.22 1.35 Allowed 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.933 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 42' ' ' MET . . . . . 0.489 ' SD ' ' O ' ' R' ' 22' ' ' PHE . 3.4 ptp -73.71 8.96 1.62 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 117.369 -1.732 . . . . 0.0 112.246 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 65.5 mt -128.77 -174.07 3.15 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.647 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.306 0.3 OUTLIER -134.97 -145.12 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 119.093 -1.043 . . . . 0.0 109.305 179.908 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.647 ' HD3' HG22 ' R' ' 44' ' ' THR . 10.2 Cg_endo -98.62 -43.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.554 0 CA-C-N 120.614 1.255 . . . . 0.0 111.16 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.53 -27.45 38.51 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.208 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.417 ' CG ' ' H ' ' R' ' 44' ' ' THR . 5.1 mm-40 -61.56 -49.8 75.19 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.983 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.98 -34.72 66.01 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.927 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -75.56 -71.46 0.37 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.127 -1.029 . . . . 0.0 112.521 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.445 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.88 -46.49 51.7 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.304 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 tt -52.68 -45.09 66.65 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.776 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.74 -42.04 97.79 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 118.91 -1.614 . . . . 0.0 109.302 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.5 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.3 OUTLIER -49.55 -78.91 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.835 -0.682 . . . . 0.0 112.022 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.1 -37.06 0.8 Allowed 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.088 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 33.3 t -72.31 -34.24 48.55 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.593 -1.243 . . . . 0.0 110.227 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.1 OUTLIER -73.42 -38.31 65.6 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.553 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 0.994 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -77.19 -39.86 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 117.577 -1.649 . . . . 0.0 109.631 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 0.994 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.2 t -63.21 -68.76 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 117.438 -1.705 . . . . 0.0 109.325 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.522 ' N ' HG12 ' R' ' 58' ' ' VAL . 16.7 tt0 -43.16 -36.27 1.65 Allowed 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.956 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -65.67 -54.32 29.07 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 118.971 -1.091 . . . . 0.0 112.109 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 34.7 mt -78.88 -6.31 55.8 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.439 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 5.1 tp -104.77 5.98 33.69 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 119.621 -0.831 . . . . 0.0 110.981 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -80.84 -72.5 0.42 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.416 -0.914 . . . . 0.0 111.196 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -125.92 -69.16 0.18 Allowed Glycine 0 N--CA 1.494 2.528 0 N-CA-C 110.093 -1.203 . . . . 0.0 110.093 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.525 ' O ' ' C ' ' R' ' 66' ' ' MET . 80.2 mt-10 -151.85 -74.09 0.15 Allowed 'General case' 0 C--N 1.301 -1.504 0 C-N-CA 119.592 -0.843 . . . . 0.0 110.469 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 66' ' ' MET . . . . . 0.525 ' C ' ' O ' ' R' ' 65' ' ' GLU . 20.2 mtp 7.35 97.23 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.142 0 O-C-N 124.732 1.27 . . . . 0.0 113.093 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 4.2 p -143.3 60.37 1.4 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 68' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.3 OUTLIER -126.67 -24.28 3.58 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -75.37 29.09 0.1 Allowed 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 119.974 -0.69 . . . . 0.0 111.147 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 70' ' ' GLU . . . . . 0.501 ' H ' ' C ' ' R' ' 68' ' ' GLN . 12.6 mt-10 -86.16 19.27 2.73 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.436 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.39 140.64 53.32 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.389 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 3.4 tttm -106.05 88.29 2.77 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.997 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -79.33 -102.25 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.731 0.777 . . . . 0.0 112.121 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -136.6 -65.99 0.54 Allowed 'General case' 0 C--N 1.282 -2.333 0 CA-C-N 114.142 -1.39 . . . . 0.0 110.965 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 75' ' ' LEU . . . . . . . . . . . . . 2.2 mt -103.51 5.51 36.87 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.825 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -50.97 -51.97 32.62 Favored Glycine 0 N--CA 1.489 2.192 0 C-N-CA 119.556 -1.307 . . . . 0.0 110.408 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -166.94 -95.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.145 -1.022 . . . . 0.0 111.102 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.16 131.99 2.08 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 119.43 -1.367 . . . . 0.0 110.295 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.827 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -45.34 -44.54 3.62 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.258 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.41 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -64.9 -62.95 1.25 Allowed 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 118.797 -1.161 . . . . 0.0 109.678 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 23.0 m -33.85 -49.23 0.32 Allowed 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.938 -1.028 . . . . 0.0 113.092 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 82' ' ' ILE . . . . . 0.438 HD13 HG21 ' R' ' 82' ' ' ILE . 30.3 pt -73.73 -34.85 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 119.006 -1.078 . . . . 0.0 113.014 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.529 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.1 OUTLIER -55.55 -67.42 0.28 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.715 -1.194 . . . . 0.0 110.83 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -6.62 1.0 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.889 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.5 -48.42 36.7 Favored Glycine 0 N--CA 1.489 2.184 0 C-N-CA 119.414 -1.375 . . . . 0.0 110.3 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.68 -7.53 54.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.718 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 87' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.2 OUTLIER -109.89 12.91 23.69 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.99 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -41.36 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.767 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 89' ' ' LEU . . . . . 0.468 ' N ' ' O ' ' R' ' 87' ' ' ASN . 4.2 mt -50.85 -33.82 25.42 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.737 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.39 -19.26 18.59 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.264 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.46 -62.81 1.42 Allowed 'General case' 0 C--N 1.291 -1.942 0 C-N-CA 118.976 -1.09 . . . . 0.0 112.31 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.612 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -99.95 164.98 15.42 Favored Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.305 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 93' ' ' PRO . . . . . 0.612 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 4.0 Cg_exo -58.83 171.87 1.86 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 C-N-CA 121.465 1.443 . . . . 0.0 111.611 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 94' ' ' VAL . . . . . 0.521 HG12 ' O ' ' R' ' 94' ' ' VAL . 75.3 t -82.11 -8.91 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 119.386 -0.926 . . . . 0.0 110.787 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -65.37 -30.36 71.18 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.598 -0.841 . . . . 0.0 111.049 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 96' ' ' LEU . . . . . 0.483 ' HG ' HD23 ' R' ' 100' ' ' LEU . 0.7 OUTLIER -60.71 -44.09 97.02 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.718 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.53 -44.89 26.16 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.17 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -73.03 -24.22 60.7 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.348 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.587 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 3.6 t90 -92.04 -66.19 0.95 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.158 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.483 HD23 ' HG ' ' R' ' 96' ' ' LEU . 2.1 mm? -43.17 -28.07 0.27 Allowed 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 118.729 -1.188 . . . . 0.0 112.865 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.456 ' C ' ' O ' ' R' ' 100' ' ' LEU . 3.5 mt-10 -46.98 -38.81 11.31 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 117.491 -1.684 . . . . 0.0 106.823 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.475 ' O ' ' N ' ' R' ' 107' ' ' SER . 3.0 mt-10 -90.67 -30.9 16.85 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.908 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.587 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.5 t -85.88 -12.37 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 C-N-CA 117.331 -1.747 . . . . 0.0 111.224 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 104' ' ' LEU . . . . . 0.413 ' HA ' HD12 ' R' ' 104' ' ' LEU . 18.8 tp -96.98 -55.3 2.91 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.625 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 105' ' ' LEU . . . . . 0.493 HD22 ' N ' ' R' ' 105' ' ' LEU . 4.0 mm? -72.49 -74.55 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.923 -1.111 . . . . 0.0 111.32 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 106' ' ' LYS . . . . . 0.438 ' O ' ' O ' ' R' ' 107' ' ' SER . 11.0 ttpt -72.22 -77.51 0.1 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 119.513 -0.875 . . . . 0.0 110.955 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' R' R ' 107' ' ' SER . . . . . 0.475 ' N ' ' O ' ' R' ' 102' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 116.521 -1.704 . . . . 0.0 111.013 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.741 0.305 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.24 165.53 49.65 Favored Pre-proline 0 N--CA 1.486 1.358 0 C-N-CA 119.171 -1.011 . . . . 0.0 110.34 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -56.87 -14.49 14.09 Favored 'Trans proline' 0 C--N 1.317 -1.107 0 C-N-CA 121.195 1.263 . . . . 0.0 110.529 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -132.83 -172.14 2.84 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.787 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 8' ' ' SER . . . . . 0.468 ' O ' ' N ' ' S' ' 10' ' ' ALA . 23.3 t -161.17 42.7 0.16 Allowed 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.014 -1.075 . . . . 0.0 110.945 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.2 90.89 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.719 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 10' ' ' ALA . . . . . 0.468 ' N ' ' O ' ' S' ' 8' ' ' SER . . . -64.25 149.15 48.58 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.243 -0.983 . . . . 0.0 110.965 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 3.8 ptp -104.77 50.39 0.79 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.999 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.12 -37.74 88.43 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.775 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -120.62 158.11 28.08 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.528 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -164.76 108.06 0.88 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.237 -0.985 . . . . 0.0 110.923 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.35 99.95 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.157 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 16' ' ' HIS . . . . . 0.401 ' H ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER -171.34 -4.07 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' S' ' 18' ' ' GLU . 63.8 tt0 -82.01 -86.01 0.1 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.051 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' S' ' 17' ' ' GLN . 1.0 OUTLIER -40.43 -34.83 0.37 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 122.648 1.213 . . . . 0.0 109.156 179.789 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -51.26 -60.91 2.61 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.041 -1.891 . . . . 0.0 110.457 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.32 -31.97 35.75 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.645 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.506 ' O ' ' C ' ' S' ' 22' ' ' PHE . 11.7 mmm-85 -59.68 -71.56 0.12 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.506 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.1 t80 -32.74 -50.47 0.26 Allowed 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 119.341 -0.944 . . . . 0.0 111.096 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.31 -44.81 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.427 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.419 ' O ' ' C ' ' S' ' 25' ' ' LEU . 25.7 t0 -48.14 -75.88 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.651 -0.82 . . . . 0.0 111.609 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.419 ' C ' ' O ' ' S' ' 24' ' ' ASP . 1.2 mt -39.91 -44.78 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.756 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.557 HD21 ' CD1' ' S' ' 39' ' ' LEU . 0.2 OUTLIER -54.41 -57.39 11.49 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.01 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.75 -49.86 0.8 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -85.59 -32.62 21.99 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 118.922 -1.111 . . . . 0.0 113.355 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 29' ' ' ALA . . . . . 0.463 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -66.75 -39.85 88.08 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.072 -1.051 . . . . 0.0 112.541 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -58.21 -38.32 76.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.93 -1.108 . . . . 0.0 112.028 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.0 -21.79 4.89 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 118.712 -1.195 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.46 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 35.3 m120 -111.57 -76.27 0.6 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.829 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.0 OUTLIER 172.06 1.28 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 118.644 -1.222 . . . . 0.0 113.02 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 34' ' ' LEU . . . . . 0.978 HD22 ' H ' ' S' ' 34' ' ' LEU . 0.9 OUTLIER -75.01 -18.51 60.35 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.609 -0.836 . . . . 0.0 111.558 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -51.12 -22.68 2.63 Favored 'General case' 0 C--N 1.293 -1.866 0 C-N-CA 119.494 -0.882 . . . . 0.0 112.746 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.467 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.4 mt -73.35 -64.03 0.89 Allowed Pre-proline 0 N--CA 1.486 1.338 0 C-N-CA 118.327 -1.349 . . . . 0.0 110.234 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.467 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -53.45 -32.73 64.09 Favored 'Trans proline' 0 C--N 1.322 -0.864 0 C-N-CA 120.769 0.979 . . . . 0.0 110.455 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 38' ' ' LEU . . . . . 0.421 HD21 HD21 ' R' ' 96' ' ' LEU . 21.8 mt -74.12 -39.7 63.17 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.19 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.557 ' CD1' HD21 ' S' ' 26' ' ' LEU . 0.2 OUTLIER -52.97 -44.2 66.98 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.332 179.802 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 40' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.1 OUTLIER -66.94 -0.92 3.44 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.536 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 tp -105.32 -67.36 0.92 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.623 -0.831 . . . . 0.0 112.964 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 42' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 2.0 mmm -91.04 47.6 1.42 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 118.761 -1.175 . . . . 0.0 111.624 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 43' ' ' LEU . . . . . 0.848 ' O ' HD23 ' S' ' 43' ' ' LEU . 0.3 OUTLIER 160.72 125.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.641 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -179.33 -41.86 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.376 0 C-N-CA 116.507 -2.077 . . . . 0.0 115.794 -179.694 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.641 ' HD2' ' H ' ' S' ' 44' ' ' THR . 5.5 Cg_endo -65.71 -110.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 120.713 0.942 . . . . 0.0 113.343 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 46' ' ' ASP . . . . . 0.483 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 0.2 OUTLIER -54.91 -12.14 0.76 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 119.029 -1.068 . . . . 0.0 110.361 -179.735 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 47' ' ' GLU . . . . . 0.428 ' N ' ' C ' ' S' ' 45' ' ' PRO . 6.4 mm-40 -68.17 -64.39 0.87 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.607 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -57.82 -33.45 68.62 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.255 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -70.41 -63.12 1.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.21 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.09 -37.52 83.01 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.336 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 mt -46.74 -57.57 4.72 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 118.64 -1.224 . . . . 0.0 109.293 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 52' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' S' ' 53' ' ' THR . . . -52.2 -64.96 3.57 Favored Glycine 0 N--CA 1.484 1.852 0 N-CA-C 108.486 -1.846 . . . . 0.0 108.486 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.574 ' O ' HG22 ' S' ' 57' ' ' ILE . 0.2 OUTLIER -34.85 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.641 0.734 . . . . 0.0 112.78 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.486 ' CG ' ' CZ3' ' R' ' 109' ' ' TRP . 8.1 ttp85 -51.57 -46.11 63.31 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.376 -1.284 . . . . 0.0 113.393 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 95.1 t -68.95 -19.08 23.61 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 C-N-CA 117.473 -1.691 . . . . 0.0 109.918 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.411 ' CD ' ' C ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -85.62 -37.06 19.93 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.542 -1.263 . . . . 0.0 110.804 -179.958 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 0.738 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -74.54 -38.38 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 117.429 -1.708 . . . . 0.0 107.902 179.942 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 58' ' ' VAL . . . . . 0.738 ' N ' HD13 ' S' ' 57' ' ' ILE . 0.9 OUTLIER -60.43 -50.95 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 117.156 -1.817 . . . . 0.0 107.399 179.452 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 59' ' ' GLU . . . . . 0.446 ' N ' HG12 ' S' ' 58' ' ' VAL . 3.4 tt0 -51.7 -31.88 27.82 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.092 179.682 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -68.99 -57.58 5.28 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 118.98 -1.088 . . . . 0.0 112.178 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 61' ' ' LEU . . . . . 0.646 ' C ' HD12 ' S' ' 61' ' ' LEU . 3.6 pp -61.43 -7.47 3.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.912 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 62' ' ' LEU . . . . . 0.611 ' O ' ' N ' ' S' ' 64' ' ' GLY . 7.0 tp -76.13 28.88 0.12 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 119.494 -0.882 . . . . 0.0 110.586 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 63' ' ' ARG . . . . . 0.514 ' H ' ' C ' ' S' ' 61' ' ' LEU . 3.9 mtm180 19.37 40.03 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.075 0 O-C-N 124.361 1.038 . . . . 0.0 113.625 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.611 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -108.43 -38.37 1.95 Allowed Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.895 -1.145 . . . . 0.0 110.262 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -112.02 -91.73 0.48 Allowed 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.176 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 5.0 tpp -108.66 -145.99 0.4 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.869 -0.733 . . . . 0.0 111.526 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 67' ' ' SER . . . . . 0.572 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.1 OUTLIER 176.28 -68.08 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.094 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.537 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.0 OUTLIER -24.61 -36.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 124.213 0.945 . . . . 0.0 113.516 179.764 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 69' ' ' ARG . . . . . 0.572 ' N ' ' O ' ' S' ' 67' ' ' SER . 0.0 OUTLIER -69.32 31.53 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 120.158 -0.617 . . . . 0.0 112.221 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.537 ' H ' ' C ' ' S' ' 68' ' ' GLN . 0.9 OUTLIER -98.65 21.69 10.98 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.937 179.949 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 30.9 mt -87.92 -178.65 6.06 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.684 -0.807 . . . . 0.0 110.949 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.5 tttm -116.83 80.34 1.46 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.869 -0.732 . . . . 0.0 110.913 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -81.2 -102.93 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.76 0.79 . . . . 0.0 110.7 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -141.87 -65.63 0.42 Allowed 'General case' 0 C--N 1.279 -2.482 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.505 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 mp -82.42 5.96 18.76 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.684 -0.807 . . . . 0.0 109.162 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 76' ' ' GLY . . . . . 0.504 ' O ' ' HB2' ' S' ' 77' ' ' ALA . . . -68.87 -56.13 9.85 Favored Glycine 0 N--CA 1.488 2.106 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.196 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 77' ' ' ALA . . . . . 0.504 ' HB2' ' O ' ' S' ' 76' ' ' GLY . . . 175.54 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.004 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 175.79 167.89 35.36 Favored Glycine 0 N--CA 1.493 2.443 0 C-N-CA 119.363 -1.399 . . . . 0.0 110.823 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.808 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -62.77 -43.52 98.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.234 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -58.25 -53.83 53.82 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.234 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.406 HG21 ' HB1' ' S' ' 77' ' ' ALA . 0.5 OUTLIER -43.14 -60.49 1.64 Allowed 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.786 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 82' ' ' ILE . . . . . 0.417 HG21 HD13 ' S' ' 82' ' ' ILE . 15.8 pt -68.46 10.47 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -106.7 -45.42 4.22 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.982 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 84' ' ' ARG . . . . . 0.46 ' NH1' ' HB1' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -74.4 -32.79 62.82 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.785 -1.166 . . . . 0.0 111.489 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.27 -45.59 90.41 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 119.242 -1.456 . . . . 0.0 110.23 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.45 -29.48 69.62 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.169 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 87' ' ' ASN . . . . . 0.523 ' O ' ' N ' ' S' ' 89' ' ' LEU . 1.2 m-20 -100.8 15.91 26.83 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.6 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 88' ' ' SER . . . . . 0.406 ' C ' ' O ' ' S' ' 87' ' ' ASN . 0.5 OUTLIER -37.85 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 120.249 -0.581 . . . . 0.0 112.004 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 89' ' ' LEU . . . . . 0.523 ' N ' ' O ' ' S' ' 87' ' ' ASN . 11.8 mt -57.38 -54.65 44.42 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.392 -0.923 . . . . 0.0 111.298 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -94.83 -35.27 12.14 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.689 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.01 -49.12 72.31 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.602 -1.181 . . . . 0.0 112.498 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 92' ' ' ALA . . . . . 0.77 ' HB3' HH22 ' S' ' 97' ' ' ARG . . . -86.53 163.74 40.54 Favored Pre-proline 0 N--CA 1.489 1.516 0 C-N-CA 119.164 -1.014 . . . . 0.0 111.598 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 93' ' ' PRO . . . . . 0.596 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 3.0 Cg_exo -53.67 175.96 0.1 Allowed 'Trans proline' 0 C--N 1.324 -0.732 0 C-N-CA 121.546 1.497 . . . . 0.0 111.429 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -108.55 -33.67 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.291 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.65 3.29 29.5 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.186 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -31.25 24.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.798 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 97' ' ' ARG . . . . . 0.77 HH22 ' HB3' ' S' ' 92' ' ' ALA . 0.0 OUTLIER -63.8 -23.05 67.21 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.014 -1.074 . . . . 0.0 110.259 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -78.07 -14.34 59.53 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.033 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.747 ' CH2' HG21 ' S' ' 103' ' ' VAL . 21.4 t90 -107.36 -59.09 1.87 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.019 0.914 . . . . 0.0 111.513 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.524 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.7 OUTLIER -58.61 -34.04 70.69 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.517 ' C ' ' O ' ' S' ' 100' ' ' LEU . 5.0 mt-10 -43.3 -32.2 0.76 Allowed 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 117.29 -1.764 . . . . 0.0 106.571 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 102' ' ' GLU . . . . . 0.524 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.7 mt-10 -89.97 -23.78 21.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 112.637 -2.074 . . . . 0.0 112.437 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.747 HG21 ' CH2' ' S' ' 99' ' ' TRP . 21.9 t -88.17 -22.73 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 C-N-CA 116.255 -2.178 . . . . 0.0 109.975 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 104' ' ' LEU . . . . . 0.563 HD21 HD11 ' S' ' 62' ' ' LEU . 21.6 tp -81.29 -55.23 4.86 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.032 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mt -57.87 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 118.325 -1.35 . . . . 0.0 110.274 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' S' S ' 106' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' S' ' 102' ' ' GLU . 0.4 OUTLIER -112.07 -177.83 3.27 Favored 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.512 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 116.417 -1.754 . . . . 0.0 110.838 179.955 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.456 ' N ' ' OD1' ' S' ' 40' ' ' ASN . 1.1 t-105 . . . . . 0 N--CA 1.484 1.258 0 CA-C-O 116.352 -1.785 . . . . 0.0 109.96 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.486 ' CZ3' ' CG ' ' S' ' 54' ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 116.37 -1.776 . . . . 0.0 110.012 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 121.001 0.429 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' R' R ' 5' ' ' SER . . . . . 0.534 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.0 OUTLIER -84.73 -45.48 0.69 Allowed Pre-proline 0 C--N 1.305 -1.355 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.83 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 6' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.2 Cg_endo -70.18 149.43 64.17 Favored 'Trans proline' 0 C--N 1.321 -0.898 0 C-N-CA 120.969 1.112 . . . . 0.0 110.929 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -89.74 176.76 6.72 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.115 -1.034 . . . . 0.0 110.388 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.1 131.0 20.36 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.48 -0.888 . . . . 0.0 110.597 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.52 165.1 13.19 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.084 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -88.89 117.33 27.81 Favored 'General case' 0 C--N 1.305 -1.335 0 C-N-CA 119.516 -0.874 . . . . 0.0 110.65 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 6.9 mtp -64.79 -160.22 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.161 -1.016 . . . . 0.0 110.175 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.75 -178.83 4.01 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.863 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 13' ' ' GLU . . . . . 0.429 ' O ' ' O ' ' R' ' 14' ' ' GLN . 3.2 tt0 -167.69 -5.77 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.469 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 14' ' ' GLN . . . . . 0.429 ' O ' ' O ' ' R' ' 13' ' ' GLU . 31.8 mt-30 45.77 94.86 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.468 -0.893 . . . . 0.0 110.738 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -82.06 157.78 24.0 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.371 -0.932 . . . . 0.0 111.056 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -71.13 63.29 0.33 Allowed 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.057 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.51 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.2 mt-30 -115.12 -76.86 0.57 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -55.4 -17.93 5.88 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 123.55 1.643 . . . . 0.0 106.666 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 19' ' ' TRP . . . . . 0.51 ' N ' ' C ' ' R' ' 17' ' ' GLN . 63.0 t-105 -57.22 -61.67 2.3 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 111.421 -2.627 . . . . 0.0 109.666 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tp -50.04 -38.4 37.71 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.558 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.553 ' O ' ' N ' ' R' ' 24' ' ' ASP . 11.7 mtt-85 -54.28 -69.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.273 -1.371 . . . . 0.0 110.121 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.526 ' CG ' HD22 ' S' ' 51' ' ' LEU . 0.1 OUTLIER -35.39 -43.1 0.23 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 119.046 -1.061 . . . . 0.0 110.705 179.616 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 85.2 t -68.58 -38.44 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.437 -0.905 . . . . 0.0 110.093 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' R' ' 21' ' ' ARG . 27.6 t70 -48.55 -75.57 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.096 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.419 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.2 OUTLIER -44.6 -45.21 9.39 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.857 179.877 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 26' ' ' LEU . . . . . 0.418 HD12 ' CE1' ' R' ' 22' ' ' PHE . 1.4 tt -42.39 -58.17 2.32 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.472 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 27' ' ' LYS . . . . . 0.536 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.5 OUTLIER -69.49 -61.66 1.7 Allowed 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.763 -0.775 . . . . 0.0 112.319 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -46.11 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.536 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -114.16 -29.19 7.04 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 119.302 -0.959 . . . . 0.0 113.127 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -48.54 -41.6 30.85 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 118.875 -1.13 . . . . 0.0 111.31 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.29 -22.54 66.3 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.113 -1.035 . . . . 0.0 111.495 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 32' ' ' ASN . . . . . 0.529 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 22.1 t-20 -102.16 -10.98 19.15 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.83 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 33' ' ' ASP . . . . . 0.529 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 81.66 13.2 0.63 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 121.643 0.735 . . . . 0.0 110.195 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -86.91 -15.76 37.99 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.267 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -52.25 -30.45 27.69 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 113.881 -1.508 . . . . 0.0 113.439 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.465 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 3.3 mt -66.64 -63.46 2.96 Favored Pre-proline 0 C--N 1.304 -1.401 0 C-N-CA 117.92 -1.512 . . . . 0.0 110.557 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.465 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.5 Cg_exo -52.75 -27.79 35.44 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 C-N-CA 120.536 0.824 . . . . 0.0 110.556 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 38' ' ' LEU . . . . . 0.447 HD11 ' CZ3' ' S' ' 99' ' ' TRP . 15.1 mt -84.49 -36.43 22.26 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.778 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.466 ' C ' ' H ' ' R' ' 41' ' ' LEU . 0.0 OUTLIER -51.47 -57.45 9.0 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.761 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -64.13 2.51 0.55 Allowed 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.049 -1.06 . . . . 0.0 111.113 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 41' ' ' LEU . . . . . 0.466 ' H ' ' C ' ' R' ' 39' ' ' LEU . 3.7 tp -93.32 -64.11 1.13 Allowed 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.509 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 42' ' ' MET . . . . . 0.463 ' O ' HD23 ' S' ' 51' ' ' LEU . 0.0 OUTLIER -79.53 12.57 2.43 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 117.431 -1.708 . . . . 0.0 109.406 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 43' ' ' LEU . . . . . 0.519 HD21 ' CE1' ' R' ' 22' ' ' PHE . 19.6 mt -132.34 169.96 15.76 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.608 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.29 0.2 OUTLIER -132.24 -135.52 0.0 OUTLIER Pre-proline 0 CA--C 1.57 1.735 0 CA-C-O 116.957 -1.497 . . . . 0.0 109.725 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.608 ' HD3' HG22 ' R' ' 44' ' ' THR . 18.8 Cg_endo -100.45 -49.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.483 0.874 0 CA-C-N 123.127 2.152 . . . . 0.0 112.051 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.43 -22.05 4.32 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.549 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.31 -52.8 11.19 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.89 -13.14 21.97 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.318 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -88.42 -65.09 1.05 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.144 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.588 ' HB1' HH11 ' R' ' 54' ' ' ARG . . . -61.63 -44.18 97.47 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.077 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.45 -60.63 2.39 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.665 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -44.76 42.1 Favored Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.297 -1.43 . . . . 0.0 109.973 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.496 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.2 OUTLIER -48.21 -79.93 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.092 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.588 HH11 ' HB1' ' R' ' 50' ' ' ALA . 0.1 OUTLIER -39.91 -37.77 0.61 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.199 -179.818 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 55' ' ' VAL . . . . . 0.595 HG22 ' HB3' ' S' ' 42' ' ' MET . 93.5 t -72.64 -35.27 50.06 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.726 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.9 OUTLIER -77.21 -39.45 48.64 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.151 -1.02 . . . . 0.0 111.821 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 0.794 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -73.38 -36.14 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 117.713 -1.595 . . . . 0.0 108.383 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 0.794 ' N ' HD13 ' R' ' 57' ' ' ILE . 3.1 t -56.28 -65.24 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 C-N-CA 118.07 -1.452 . . . . 0.0 109.39 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.507 ' N ' HG12 ' R' ' 58' ' ' VAL . 63.3 mt-10 -47.61 -44.55 26.76 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.88 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -46.15 -44.36 15.78 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.874 -0.731 . . . . 0.0 111.758 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 9.8 mt -99.15 -0.1 42.31 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.291 -0.964 . . . . 0.0 111.668 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.6 tp -96.98 13.13 30.0 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 119.194 -1.002 . . . . 0.0 111.448 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -85.22 -82.22 0.18 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.065 -1.054 . . . . 0.0 110.473 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -126.35 -65.14 0.16 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.023 -1.631 . . . . 0.0 109.023 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.441 ' O ' ' C ' ' R' ' 66' ' ' MET . 0.3 OUTLIER -142.88 -89.64 0.13 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.245 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 66' ' ' MET . . . . . 0.441 ' C ' ' O ' ' R' ' 65' ' ' GLU . 0.0 OUTLIER 29.51 94.61 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.354 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 26.8 m -147.85 58.98 1.12 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.219 -0.993 . . . . 0.0 111.07 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.04 -34.29 0.88 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 119.96 -0.696 . . . . 0.0 110.67 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.62 33.81 0.21 Allowed 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.657 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 70' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -106.48 26.11 10.3 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.85 -0.74 . . . . 0.0 112.011 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 7.9 mt -74.89 143.74 43.67 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 118.675 -1.21 . . . . 0.0 110.547 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 35.9 tttm -67.28 119.21 11.77 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.734 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 68.2 m-20 -96.49 -102.89 0.17 Allowed 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 121.759 0.79 . . . . 0.0 110.387 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -147.02 -59.32 0.28 Allowed 'General case' 0 C--N 1.278 -2.508 0 CA-C-N 114.214 -1.357 . . . . 0.0 109.405 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.504 HD23 ' N ' ' R' ' 75' ' ' LEU . 0.1 OUTLIER -100.81 -8.35 22.74 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.743 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -43.14 -65.03 1.55 Allowed Glycine 0 N--CA 1.488 2.142 0 C-N-CA 119.705 -1.236 . . . . 0.0 110.836 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -168.1 -96.35 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.118 -1.033 . . . . 0.0 111.248 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -161.73 155.27 26.46 Favored Glycine 0 N--CA 1.493 2.446 0 C-N-CA 119.48 -1.343 . . . . 0.0 110.279 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.749 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -54.77 -49.5 68.36 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.785 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.444 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -61.14 -56.51 20.02 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.036 -1.066 . . . . 0.0 111.217 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 4.0 m -38.87 -54.42 1.63 Allowed 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 9.4 pt -64.72 -20.65 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.514 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -75.32 -73.28 0.26 Allowed 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 118.389 -1.324 . . . . 0.0 111.677 -179.915 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -6.24 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.545 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 85' ' ' GLY . . . . . 0.514 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -69.25 -46.03 58.97 Favored Glycine 0 N--CA 1.49 2.287 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.741 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 86' ' ' SER . . . . . 0.493 ' C ' ' H ' ' R' ' 88' ' ' SER . 33.8 t -102.77 -42.14 5.97 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.438 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -67.5 9.42 0.25 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.606 -0.837 . . . . 0.0 111.234 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 88' ' ' SER . . . . . 0.527 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.4 OUTLIER -74.22 -22.91 59.15 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.031 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 89' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' R' ' 88' ' ' SER . 3.8 mt -37.29 -25.31 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.996 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 90' ' ' LYS . . . . . 0.527 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -108.71 -56.66 2.24 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.318 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.84 -6.21 2.57 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.663 -1.153 . . . . 0.0 112.585 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 138.68 97.48 Favored Pre-proline 0 N--CA 1.489 1.505 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.567 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -63.01 128.28 22.56 Favored 'Trans proline' 0 C--O 1.214 -0.705 0 C-N-CA 121.016 1.144 . . . . 0.0 111.582 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 94' ' ' VAL . . . . . 0.581 HG12 ' O ' ' R' ' 94' ' ' VAL . 82.7 t -67.68 -5.5 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.487 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -91.93 7.62 41.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.723 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.1 tp -104.35 -41.93 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.163 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.7 -47.2 67.41 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.286 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -60.04 -17.37 38.57 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.674 -0.81 . . . . 0.0 112.567 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.676 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 3.9 t90 -113.66 -65.26 1.2 Allowed 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.489 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.494 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.3 mm? -39.89 -38.56 0.7 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.494 ' C ' ' O ' ' R' ' 100' ' ' LEU . 11.2 mt-10 -43.79 -33.94 1.43 Allowed 'General case' 0 C--N 1.291 -1.966 0 C-N-CA 117.738 -1.585 . . . . 0.0 107.825 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.441 ' N ' ' C ' ' R' ' 100' ' ' LEU . 6.4 mt-10 -91.75 -31.85 15.62 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.939 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.676 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 3.2 t -82.44 -10.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 117.288 -1.765 . . . . 0.0 110.287 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 104' ' ' LEU . . . . . 0.422 ' HA ' HD12 ' R' ' 104' ' ' LEU . 34.0 tp -92.95 -50.44 5.55 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.631 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' R' R ' 105' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' R' ' 107' ' ' SER . 1.0 OUTLIER -52.5 -66.44 0.38 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 119.16 -1.016 . . . . 0.0 110.252 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -49.41 -11.35 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.681 -0.807 . . . . 0.0 111.179 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 107' ' ' SER . . . . . 0.47 ' N ' ' O ' ' R' ' 105' ' ' LEU . 10.4 m . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 116.324 -1.798 . . . . 0.0 110.788 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.776 0.322 . . . . 0.0 110.294 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.98 160.71 42.56 Favored Pre-proline 0 N--CA 1.487 1.415 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.181 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -55.5 -33.35 85.98 Favored 'Trans proline' 0 C--N 1.318 -1.054 0 C-N-CA 121.311 1.341 . . . . 0.0 111.444 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.44 138.3 57.46 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.17 -1.012 . . . . 0.0 110.537 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 47.3 p -81.28 -179.37 7.33 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.255 -0.978 . . . . 0.0 110.502 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -164.65 -31.53 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.881 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.28 -176.51 3.98 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.812 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -126.19 121.34 32.5 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.614 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.0 40.87 0.97 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.362 -0.935 . . . . 0.0 110.907 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -138.77 131.59 29.31 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.859 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 17.0 mp0 -85.26 177.79 7.72 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.375 -0.93 . . . . 0.0 111.175 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 15' ' ' ARG . . . . . 0.49 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.2 OUTLIER -87.25 18.21 3.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.847 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -66.11 7.73 0.27 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.757 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.495 ' O ' ' N ' ' S' ' 20' ' ' LEU . 1.2 mp0 -92.65 -85.51 0.26 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.76 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.6 mt-10 -42.93 -29.93 0.37 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 122.966 1.365 . . . . 0.0 108.276 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 19' ' ' TRP . . . . . 0.466 ' N ' ' C ' ' S' ' 17' ' ' GLN . 22.8 t-105 -56.45 -54.43 45.73 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 112.729 -2.032 . . . . 0.0 107.927 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 20' ' ' LEU . . . . . 0.495 ' N ' ' O ' ' S' ' 17' ' ' GLN . 0.5 OUTLIER -57.64 -36.55 72.0 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 113.573 -1.648 . . . . 0.0 111.455 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -54.82 -74.41 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 118.595 -1.242 . . . . 0.0 110.027 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.547 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.7 OUTLIER -27.13 -48.26 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 119.234 -0.986 . . . . 0.0 111.472 179.626 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' S' ' 21' ' ' ARG . 62.2 t -66.82 -49.75 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.439 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' S' ' 21' ' ' ARG . 15.6 t70 -41.07 -56.25 2.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.583 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.56 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.2 OUTLIER -60.61 -45.32 94.45 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.272 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' S' ' 26' ' ' LEU . 0.2 OUTLIER -48.31 -43.71 33.27 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.389 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.05 -41.04 33.73 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.84 -9.86 18.67 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 119.305 -0.958 . . . . 0.0 113.329 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -46.69 15.02 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.774 -1.171 . . . . 0.0 112.096 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 30' ' ' TYR . . . . . 0.408 ' C ' ' N ' ' S' ' 32' ' ' ASN . 17.7 t80 -49.93 -46.34 51.98 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.687 -0.805 . . . . 0.0 112.015 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -47.4 -19.68 0.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.138 -1.025 . . . . 0.0 111.212 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.494 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 79.4 m-20 -110.67 -68.58 0.92 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.213 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.494 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.1 OUTLIER 160.17 -13.42 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.53 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 34' ' ' LEU . . . . . 0.435 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 1.4 mm? -54.94 -17.81 4.19 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.941 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 35' ' ' HIS . . . . . 0.434 ' ND1' ' O ' ' S' ' 33' ' ' ASP . 19.4 p-80 -50.17 -21.12 1.19 Allowed 'General case' 0 C--N 1.292 -1.904 0 C-N-CA 119.486 -0.886 . . . . 0.0 112.338 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.459 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -77.94 -64.1 0.42 Allowed Pre-proline 0 N--CA 1.484 1.239 0 C-N-CA 118.481 -1.288 . . . . 0.0 111.173 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -51.4 -42.31 55.52 Favored 'Trans proline' 0 C--N 1.319 -0.993 0 C-N-CA 120.526 0.817 . . . . 0.0 110.495 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.98 -54.6 44.82 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.589 -0.844 . . . . 0.0 110.416 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.4 OUTLIER -46.22 -53.21 11.0 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.816 179.864 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -52.36 -10.67 0.15 Allowed 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -107.14 -60.37 1.69 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.726 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 42' ' ' MET . . . . . 0.595 ' HB3' HG22 ' R' ' 55' ' ' VAL . 0.0 OUTLIER -89.62 28.51 1.29 Allowed 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.462 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 43' ' ' LEU . . . . . 0.715 ' C ' HD23 ' S' ' 43' ' ' LEU . 5.3 tt -178.13 127.95 0.13 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.506 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -178.98 -42.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.484 0 C-N-CA 116.514 -2.074 . . . . 0.0 116.276 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.506 ' HD2' ' H ' ' S' ' 44' ' ' THR . 19.1 Cg_endo -78.72 -107.17 0.01 OUTLIER 'Trans proline' 0 CA--C 1.553 1.464 0 C-N-CA 121.251 1.301 . . . . 0.0 114.12 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -47.52 -16.85 0.07 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.118 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 47' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' S' ' 49' ' ' GLU . 22.0 mm-40 -69.42 -76.9 0.09 Allowed 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.149 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 48' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' S' ' 47' ' ' GLU . 11.0 ttp85 -38.32 -27.13 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.245 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 49' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' S' ' 47' ' ' GLU . 3.3 tt0 -77.47 -62.32 1.7 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 118.239 -1.385 . . . . 0.0 110.821 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 50' ' ' ALA . . . . . 0.463 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -59.47 -35.64 74.47 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.774 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 51' ' ' LEU . . . . . 0.526 HD22 ' CG ' ' R' ' 22' ' ' PHE . 95.2 mt -55.41 -72.48 0.07 Allowed 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.419 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.78 -40.32 5.23 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.456 -1.354 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.473 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -50.79 -80.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.616 -0.833 . . . . 0.0 112.496 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.628 HH21 HG11 ' S' ' 58' ' ' VAL . 0.0 OUTLIER -39.42 -35.34 0.27 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.401 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.3 t -74.66 -31.0 25.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 C-N-CA 118.452 -1.299 . . . . 0.0 111.013 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.473 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.5 -36.89 32.67 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.818 -1.153 . . . . 0.0 111.421 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 0.852 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -72.91 -40.11 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 118.078 -1.449 . . . . 0.0 108.604 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 58' ' ' VAL . . . . . 0.852 ' N ' HD13 ' S' ' 57' ' ' ILE . 19.3 t -59.46 -59.25 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 C-N-CA 117.463 -1.695 . . . . 0.0 108.837 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.1 -23.52 5.48 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.544 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.04 -58.09 5.07 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.631 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 61' ' ' LEU . . . . . 0.582 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -64.85 -9.96 24.75 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 118.564 -1.254 . . . . 0.0 110.737 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 62' ' ' LEU . . . . . 0.612 ' O ' ' N ' ' S' ' 64' ' ' GLY . 12.6 tp -72.65 28.62 0.06 Allowed 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 119.552 -0.859 . . . . 0.0 109.814 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 63' ' ' ARG . . . . . 0.582 ' H ' ' C ' ' S' ' 61' ' ' LEU . 47.7 mtt-85 21.07 38.18 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.612 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -97.53 -31.17 6.89 Favored Glycine 0 N--CA 1.493 2.479 0 C-N-CA 119.695 -1.241 . . . . 0.0 110.567 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -142.17 -86.21 0.16 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.491 -0.883 . . . . 0.0 111.104 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 42.9 mtt -82.54 166.72 19.03 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.166 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 67' ' ' SER . . . . . 0.562 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.1 OUTLIER -165.32 -78.75 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.588 -0.845 . . . . 0.0 109.163 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.502 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.5 OUTLIER -38.67 -22.24 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.662 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 69' ' ' ARG . . . . . 0.562 ' N ' ' O ' ' S' ' 67' ' ' SER . 0.4 OUTLIER -65.79 31.7 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.945 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.502 ' H ' ' C ' ' S' ' 68' ' ' GLN . 26.6 mt-10 -99.25 13.91 31.38 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.705 -0.798 . . . . 0.0 110.788 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 mt -61.71 148.35 43.06 Favored 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.049 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -97.96 85.96 3.63 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 119.852 -0.739 . . . . 0.0 110.758 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -92.01 -103.4 0.11 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.305 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -140.95 -56.65 0.5 Allowed 'General case' 0 C--N 1.279 -2.491 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.884 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.11 5.21 40.29 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.4 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.92 -58.61 12.86 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 119.551 -1.309 . . . . 0.0 110.907 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.85 -82.02 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.126 -1.03 . . . . 0.0 111.003 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 157.23 132.3 1.44 Allowed Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.249 -1.453 . . . . 0.0 110.664 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.801 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -42.26 -45.6 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.127 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.45 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -62.83 -57.33 11.25 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.167 -1.013 . . . . 0.0 111.622 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.531 ' CG2' HG21 ' S' ' 57' ' ' ILE . 23.6 m -47.24 -47.42 24.7 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.764 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 82' ' ' ILE . . . . . 0.415 HG21 HD13 ' S' ' 82' ' ' ILE . 22.1 pt -75.14 -0.61 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.662 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -90.6 -60.84 1.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 118.583 -1.247 . . . . 0.0 111.699 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -13.27 34.64 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.251 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.53 -48.57 83.95 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.373 -1.394 . . . . 0.0 110.699 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -88.46 -25.26 22.71 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.161 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -94.54 8.75 41.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.757 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.07 -28.13 16.38 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.753 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 89' ' ' LEU . . . . . 0.532 ' H ' HD12 ' S' ' 89' ' ' LEU . 9.4 mp -42.42 -64.3 0.63 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.864 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 90' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' S' ' 91' ' ' ALA . 0.0 OUTLIER -95.77 -51.44 4.49 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.778 -179.869 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 91' ' ' ALA . . . . . 0.44 ' C ' ' O ' ' S' ' 90' ' ' LYS . . . -34.26 -51.87 0.46 Allowed 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.889 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 92' ' ' ALA . . . . . 0.567 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -82.83 162.71 54.31 Favored Pre-proline 0 C--N 1.303 -1.432 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.464 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 93' ' ' PRO . . . . . 0.567 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 4.4 Cg_exo -56.39 144.67 82.28 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 121.475 1.45 . . . . 0.0 111.222 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 94' ' ' VAL . . . . . 0.421 ' C ' ' H ' ' S' ' 96' ' ' LEU . 6.0 t -85.15 -6.82 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 119.286 -0.965 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.22 4.48 1.64 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.655 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 96' ' ' LEU . . . . . 0.421 ' H ' ' C ' ' S' ' 94' ' ' VAL . 8.0 mp -97.02 -19.16 18.94 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.498 -0.881 . . . . 0.0 111.011 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 97' ' ' ARG . . . . . 0.438 ' N ' ' CD ' ' S' ' 97' ' ' ARG . 3.5 mpt_? -64.2 -42.75 96.51 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.438 -0.905 . . . . 0.0 111.003 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -86.51 -1.78 57.9 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.705 ' CH2' HG21 ' S' ' 103' ' ' VAL . 10.7 t90 -115.63 -66.14 1.12 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.573 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.6 OUTLIER -52.67 -38.06 59.83 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.514 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.3 mm-40 -41.95 -26.95 0.1 Allowed 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 117.573 -1.651 . . . . 0.0 107.285 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 102' ' ' GLU . . . . . 0.573 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -95.57 -25.61 16.1 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 113.462 -1.699 . . . . 0.0 112.127 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.705 HG21 ' CH2' ' S' ' 99' ' ' TRP . 8.2 t -84.22 -20.32 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 116.148 -2.221 . . . . 0.0 108.119 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 104' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' S' ' 104' ' ' LEU . 19.3 tp -81.43 -57.4 3.49 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.857 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 1.1 mt -49.06 -61.89 1.83 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 118.672 -1.211 . . . . 0.0 109.446 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -74.24 170.21 16.02 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.683 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' S' S ' 107' ' ' SER . . . . . 0.413 ' O ' ' OG ' ' S' ' 107' ' ' SER . 29.5 t . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 116.247 -1.835 . . . . 0.0 110.703 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 1' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.234 0 CA-C-O 116.391 -1.766 . . . . 0.0 110.523 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.417 ' CZ3' ' CG ' ' S' ' 54' ' ' ARG . 1.1 m-90 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 116.386 -1.769 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.931 0.396 . . . . 0.0 110.039 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' R' R ' 5' ' ' SER . . . . . 0.539 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.3 OUTLIER -63.97 -44.78 79.51 Favored Pre-proline 0 C--N 1.306 -1.292 0 C-N-CA 119.515 -0.874 . . . . 0.0 112.473 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 6' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' R' ' 5' ' ' SER . 4.4 Cg_exo -66.12 139.96 57.74 Favored 'Trans proline' 0 C--N 1.322 -0.846 0 C-N-CA 120.952 1.102 . . . . 0.0 111.601 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -115.91 179.31 4.02 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.89 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 83.2 p -65.77 130.08 42.01 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.69 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -87.84 -134.92 0.09 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.092 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.56 102.01 9.5 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.635 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 1.6 ttm -86.91 159.46 19.03 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.372 -0.931 . . . . 0.0 111.14 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.64 108.38 0.13 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 119.223 -0.991 . . . . 0.0 110.509 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 13' ' ' GLU . . . . . 0.434 ' CG ' ' O ' ' R' ' 13' ' ' GLU . 1.2 pt-20 -112.79 69.37 0.69 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.161 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 14' ' ' GLN . . . . . 0.42 ' O ' ' O ' ' R' ' 13' ' ' GLU . 1.2 mt-30 45.02 91.14 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.971 -1.092 . . . . 0.0 110.136 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 15' ' ' ARG . . . . . 0.51 ' C ' ' H ' ' R' ' 17' ' ' GLN . 4.5 mmt85 -101.09 -176.47 3.17 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.577 -0.849 . . . . 0.0 112.326 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 16' ' ' HIS . . . . . 0.714 ' NE2' HD21 ' S' ' 36' ' ' LEU . 10.1 t-80 -69.17 24.81 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.151 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.537 ' O ' ' N ' ' R' ' 19' ' ' TRP . 4.3 mt-30 -85.59 -98.47 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.488 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 18' ' ' GLU . . . . . 0.496 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.7 mt-10 -32.0 -37.08 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-O 123.259 1.504 . . . . 0.0 108.989 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 19' ' ' TRP . . . . . 0.633 ' CD1' ' CD2' ' R' ' 16' ' ' HIS . 57.3 t-105 -50.09 -57.96 6.54 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 112.553 -2.112 . . . . 0.0 109.604 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 20' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' R' ' 17' ' ' GLN . 7.9 tp -54.64 -46.01 73.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.014 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -45.39 -68.4 0.2 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.456 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.448 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.1 OUTLIER -36.8 -38.81 0.19 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.82 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 97.3 t -73.5 -50.06 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.741 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -41.5 -64.65 0.53 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.877 -0.729 . . . . 0.0 111.24 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.453 ' HG ' ' H ' ' R' ' 25' ' ' LEU . 0.8 OUTLIER -54.4 -48.42 71.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.9 -0.72 . . . . 0.0 110.979 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 26' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' R' ' 25' ' ' LEU . 1.1 tt -35.31 -62.42 0.39 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.535 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 27' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.6 OUTLIER -57.5 -68.03 0.27 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.059 -1.056 . . . . 0.0 112.02 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 11.5 m120 -44.57 -17.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.514 ' HB1' ' N ' ' R' ' 35' ' ' HIS . . . -95.93 -31.27 13.18 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.521 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 30' ' ' TYR . . . . . 0.508 ' CE1' ' NZ ' ' S' ' 27' ' ' LYS . 15.1 t80 -55.86 -40.33 72.74 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.716 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -71.1 -21.97 62.15 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.805 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 32' ' ' ASN . . . . . 0.527 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 26.5 m120 -100.07 -16.1 17.99 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 33' ' ' ASP . . . . . 0.527 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 5.3 t70 83.73 23.56 0.13 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 123.671 0.607 . . . . 0.0 110.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -98.58 -14.79 19.76 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.769 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 35' ' ' HIS . . . . . 0.514 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 1.9 p-80 -48.11 -35.12 10.84 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.294 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.458 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 6.0 mt -64.82 -63.07 3.99 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 118.024 -1.47 . . . . 0.0 111.697 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -48.63 -35.03 28.59 Favored 'Trans proline' 0 C--N 1.315 -1.219 0 C-N-CA 120.917 1.078 . . . . 0.0 111.894 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 38' ' ' LEU . . . . . 0.405 HD11 ' CZ3' ' S' ' 99' ' ' TRP . 72.8 mt -76.81 -40.65 47.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.637 -0.825 . . . . 0.0 110.246 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.465 HD13 ' O ' ' R' ' 35' ' ' HIS . 0.3 OUTLIER -56.81 -22.17 34.32 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.681 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -89.44 6.64 39.86 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.176 -1.009 . . . . 0.0 111.117 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 41' ' ' LEU . . . . . 0.477 ' C ' ' H ' ' R' ' 43' ' ' LEU . 67.3 mt -114.54 -60.88 1.83 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.227 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 42' ' ' MET . . . . . 0.403 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -71.12 16.24 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.348 -1.341 . . . . 0.0 111.535 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 43' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' R' ' 41' ' ' LEU . 4.8 mp -141.67 159.18 42.76 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.131 -0.627 . . . . 0.0 109.374 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.699 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.288 0.3 OUTLIER -107.67 -148.94 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.623 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.453 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.699 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.4 Cg_endo -98.12 -39.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.474 0.357 0 CA-C-N 119.945 1.016 . . . . 0.0 110.524 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.379 -0.928 . . . . 0.0 110.165 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.9 -41.77 95.33 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.91 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.03 -34.8 73.73 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.57 -0.852 . . . . 0.0 111.245 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.14 -64.42 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.74 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.433 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -53.95 -39.71 66.18 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.181 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -48.61 -67.6 0.26 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.612 -0.835 . . . . 0.0 110.862 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 52' ' ' GLY . . . . . 0.408 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -45.32 -52.82 8.35 Favored Glycine 0 N--CA 1.486 2.002 0 C-N-CA 119.283 -1.437 . . . . 0.0 110.644 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' R' ' 50' ' ' ALA . 0.2 OUTLIER -37.7 -78.58 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.276 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 9.6 mtt85 -40.94 -51.89 3.16 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.294 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 59.1 t -64.36 -26.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 C-N-CA 118.344 -1.343 . . . . 0.0 111.34 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.411 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -81.23 -39.28 25.62 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.826 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 0.92 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -74.33 -34.78 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 117.718 -1.593 . . . . 0.0 108.465 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 0.92 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.3 t -61.43 -65.27 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 118.004 -1.478 . . . . 0.0 109.414 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.482 ' N ' HG12 ' R' ' 58' ' ' VAL . 5.3 mm-40 -41.28 -50.73 3.67 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.882 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.64 -47.32 82.56 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.823 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 80.9 mt -83.09 6.09 20.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.538 -0.865 . . . . 0.0 112.241 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 tp -128.12 26.63 5.75 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.365 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -115.08 -61.26 1.77 Allowed 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.021 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -126.84 -94.56 0.89 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.529 ' O ' ' C ' ' R' ' 66' ' ' MET . 9.7 mm-40 -136.49 -61.56 0.68 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.363 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 66' ' ' MET . . . . . 0.529 ' C ' ' O ' ' R' ' 65' ' ' GLU . 1.0 OUTLIER 3.2 101.75 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 124.608 1.192 . . . . 0.0 113.129 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 90.7 p -160.6 67.66 0.34 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.112 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 68' ' ' GLN . . . . . 0.499 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.9 OUTLIER -125.36 -56.5 1.52 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.382 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.63 31.63 0.11 Allowed 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 120.039 -0.664 . . . . 0.0 111.059 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 70' ' ' GLU . . . . . 0.499 ' H ' ' C ' ' R' ' 68' ' ' GLN . 0.0 OUTLIER -92.27 24.56 3.31 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.636 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mp -78.99 178.24 8.17 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.988 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -102.39 114.89 29.46 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.453 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -103.5 -107.02 0.27 Allowed 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.61 0.719 . . . . 0.0 111.128 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -146.51 -21.69 0.43 Allowed 'General case' 0 C--N 1.281 -2.395 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.603 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 75' ' ' LEU . . . . . . . . . . . . . 4.6 mt -123.62 -10.5 7.86 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.467 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -54.96 -67.42 2.21 Favored Glycine 0 N--CA 1.487 2.089 0 C-N-CA 119.628 -1.273 . . . . 0.0 110.944 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -171.6 -74.54 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.109 -1.036 . . . . 0.0 111.002 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.45 138.36 2.69 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.491 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.879 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.28 -38.99 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.221 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.93 -61.62 1.95 Allowed 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.891 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 48.9 m -38.75 -38.87 0.45 Allowed 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 13.4 pt -82.27 -22.64 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.45 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 83' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.85 -55.19 21.0 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 118.693 -1.203 . . . . 0.0 111.663 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.465 ' NE ' ' CD1' ' R' ' 1' ' ' TRP . 0.0 OUTLIER -72.91 -9.71 58.99 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.171 -1.012 . . . . 0.0 111.484 -179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.01 -32.79 52.01 Favored Glycine 0 N--CA 1.49 2.274 0 C-N-CA 119.089 -1.529 . . . . 0.0 110.775 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 86' ' ' SER . . . . . 0.483 ' C ' ' H ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -84.88 -55.82 3.89 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.213 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 87' ' ' ASN . . . . . 0.402 ' O ' ' C ' ' R' ' 88' ' ' SER . 25.1 m-80 -69.06 11.61 0.2 Allowed 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.324 -0.951 . . . . 0.0 111.264 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 88' ' ' SER . . . . . 0.483 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.3 OUTLIER -42.61 -31.27 0.43 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 1.5 mt -50.22 -45.1 53.54 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.875 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 90' ' ' LYS . . . . . 0.533 ' O ' ' N ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -107.47 -54.57 2.46 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.772 -0.771 . . . . 0.0 111.112 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.68 -27.78 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.237 -1.347 . . . . 0.0 112.643 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.533 ' N ' ' O ' ' R' ' 90' ' ' LYS . . . -88.0 156.12 52.26 Favored Pre-proline 0 N--CA 1.49 1.535 0 C-N-CA 118.674 -1.21 . . . . 0.0 110.698 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -51.84 129.58 30.86 Favored 'Trans proline' 0 C--N 1.325 -0.7 0 C-N-CA 121.445 1.43 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 94' ' ' VAL . . . . . 0.416 ' H ' HG23 ' R' ' 94' ' ' VAL . 4.7 t -62.14 -12.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.992 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -91.45 4.62 52.06 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.514 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -90.24 -49.86 6.31 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.1 -38.8 3.84 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.798 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -58.7 -41.18 85.68 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.516 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.668 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.3 t90 -84.85 -63.16 1.38 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.281 -0.967 . . . . 0.0 112.323 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.6 mm? -41.06 -38.2 0.98 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 118.952 -1.099 . . . . 0.0 113.96 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.474 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.6 mm-40 -44.99 -29.65 0.87 Allowed 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 117.851 -1.54 . . . . 0.0 107.856 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.465 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.6 mt-10 -94.58 -30.94 14.11 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 113.304 -1.771 . . . . 0.0 111.818 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.668 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.6 t -89.67 -6.64 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 117.466 -1.694 . . . . 0.0 110.503 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 13.7 tp -104.02 -49.35 3.64 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.25 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.67 -68.5 0.64 Allowed 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.755 -0.778 . . . . 0.0 112.255 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 45.1 tttp -57.33 -11.71 1.99 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 119.955 -0.698 . . . . 0.0 111.821 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--N 1.303 -1.455 0 CA-C-O 116.326 -1.797 . . . . 0.0 110.964 179.919 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 N--CA 1.487 1.412 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.55 164.24 16.61 Favored Pre-proline 0 N--CA 1.489 1.478 0 C-N-CA 119.665 -0.814 . . . . 0.0 110.829 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -59.09 -63.63 0.13 Allowed 'Trans proline' 0 C--N 1.322 -0.828 0 C-N-CA 121.472 1.448 . . . . 0.0 111.401 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -94.14 74.94 4.04 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.751 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 83.1 p -158.17 34.94 0.24 Allowed 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.186 -1.006 . . . . 0.0 111.203 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -96.32 -8.84 31.59 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.408 -0.917 . . . . 0.0 111.159 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.91 140.41 29.97 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.554 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 11' ' ' MET . . . . . 0.444 ' N ' ' SD ' ' S' ' 11' ' ' MET . 0.7 OUTLIER -116.58 81.96 1.71 Allowed 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.333 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.15 109.3 3.98 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.113 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -115.43 124.51 51.34 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.909 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 14' ' ' GLN . . . . . 0.476 ' O ' ' N ' ' S' ' 17' ' ' GLN . 2.0 mt-30 -73.21 108.82 6.31 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 119.199 -1.0 . . . . 0.0 109.556 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 15' ' ' ARG . . . . . 0.492 ' C ' ' H ' ' S' ' 17' ' ' GLN . 6.1 mtp180 -38.01 -32.41 0.06 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.815 -0.754 . . . . 0.0 111.325 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 16' ' ' HIS . . . . . 0.548 ' CG ' ' O ' ' S' ' 16' ' ' HIS . 43.6 t-80 -69.15 13.55 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.451 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.492 ' H ' ' C ' ' S' ' 15' ' ' ARG . 1.5 tp60 -91.26 -97.19 0.12 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.416 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.403 ' C ' ' O ' ' S' ' 17' ' ' GLN . 0.6 OUTLIER -44.36 -27.99 0.49 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.537 1.161 . . . . 0.0 108.638 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 19' ' ' TRP . . . . . 0.451 ' N ' ' C ' ' S' ' 17' ' ' GLN . 11.2 t-105 -48.87 -63.92 0.95 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.782 -1.554 . . . . 0.0 108.444 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -44.51 -39.07 4.56 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.266 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.525 ' O ' ' N ' ' S' ' 24' ' ' ASP . 5.8 mmp_? -51.63 -71.12 0.07 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.181 -1.408 . . . . 0.0 109.344 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.522 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -28.92 -44.7 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.797 -0.761 . . . . 0.0 111.202 179.656 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.424 ' N ' ' O ' ' S' ' 21' ' ' ARG . 99.1 t -70.32 -48.78 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.709 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.525 ' N ' ' O ' ' S' ' 21' ' ' ARG . 63.5 t0 -42.94 -72.83 0.05 Allowed 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.636 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.415 ' HG ' ' H ' ' S' ' 25' ' ' LEU . 0.2 OUTLIER -43.26 -45.97 6.03 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.711 -0.796 . . . . 0.0 109.952 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -40.82 -59.71 1.35 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.941 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 27' ' ' LYS . . . . . 0.508 ' NZ ' ' CE1' ' R' ' 30' ' ' TYR . 0.1 OUTLIER -50.36 -70.35 0.09 Allowed 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.682 -0.807 . . . . 0.0 112.461 -179.84 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 77.0 m-20 -49.16 -24.72 1.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.73 -56.03 3.46 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 118.898 -1.121 . . . . 0.0 112.262 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -47.86 -33.41 7.42 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 119.657 -0.817 . . . . 0.0 111.157 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.37 -28.9 21.37 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 118.881 -1.128 . . . . 0.0 110.229 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.492 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 7.4 m120 -111.45 -65.44 1.17 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.492 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.0 OUTLIER 164.24 -11.54 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.751 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 34' ' ' LEU . . . . . 0.514 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 3.7 mm? -59.11 -16.7 20.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.177 -0.609 . . . . 0.0 111.821 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 35' ' ' HIS . . . . . 0.444 ' ND1' ' O ' ' S' ' 33' ' ' ASP . 11.4 p-80 -48.43 -18.15 0.21 Allowed 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 119.356 -0.938 . . . . 0.0 112.134 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.714 HD21 ' NE2' ' R' ' 16' ' ' HIS . 6.2 mt -80.92 -65.63 0.26 Allowed Pre-proline 0 C--N 1.308 -1.219 0 C-N-CA 117.995 -1.482 . . . . 0.0 110.931 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.2 Cg_exo -50.31 -28.79 21.51 Favored 'Trans proline' 0 C--N 1.319 -0.987 0 C-N-CA 120.624 0.882 . . . . 0.0 110.975 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.36 -41.54 39.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.326 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.493 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.3 OUTLIER -52.29 -43.34 64.42 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.376 -0.93 . . . . 0.0 109.756 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 40' ' ' ASN . . . . . 0.416 ' O ' ' OXT' ' R' ' 1' ' ' TRP . 3.5 m-80 -71.39 13.12 0.26 Allowed 'General case' 0 C--N 1.297 -1.684 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.83 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 41' ' ' LEU . . . . . 0.493 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.1 tp -113.71 -54.38 2.61 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 120.044 -0.662 . . . . 0.0 112.344 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.22 7.12 17.16 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 118.665 -1.214 . . . . 0.0 112.725 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 2.1 pp -177.03 153.35 0.98 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.305 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.577 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.7 OUTLIER -179.05 -42.38 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.175 0 C-N-CA 117.783 -1.567 . . . . 0.0 114.762 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.577 ' HD2' ' H ' ' S' ' 44' ' ' THR . 14.4 Cg_endo -77.15 -105.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 121.037 1.158 . . . . 0.0 112.88 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 46' ' ' ASP . . . . . 0.4 ' OD1' ' O ' ' S' ' 46' ' ' ASP . 34.8 t0 -55.25 -6.18 0.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.693 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 47' ' ' GLU . . . . . 0.502 ' H ' ' C ' ' S' ' 45' ' ' PRO . 8.4 mm-40 -82.92 -59.45 2.49 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 119.723 -0.791 . . . . 0.0 109.972 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 48' ' ' ARG . . . . . 0.621 ' NH1' ' CE3' ' R' ' 19' ' ' TRP . 19.4 tpt180 -54.83 -24.88 24.97 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.918 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 49' ' ' GLU . . . . . 0.422 ' O ' ' OG1' ' S' ' 53' ' ' THR . 31.8 mt-10 -82.24 -71.13 0.5 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.745 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.53 -51.13 68.07 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.048 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.26 -61.84 0.84 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.899 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.38 -40.99 78.83 Favored Glycine 0 N--CA 1.489 2.177 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.596 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.551 ' O ' HG22 ' S' ' 57' ' ' ILE . 0.2 OUTLIER -48.9 -77.27 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.221 179.954 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.78 ' HE ' ' N ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -44.15 -29.49 0.63 Allowed 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.805 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 96.8 t -81.52 -28.57 10.32 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.527 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.65 -36.03 33.07 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.843 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 0.784 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -74.6 -38.94 46.55 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 58' ' ' VAL . . . . . 0.784 ' N ' HD13 ' S' ' 57' ' ' ILE . 3.1 t -55.81 -68.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 118.635 -1.226 . . . . 0.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 59' ' ' GLU . . . . . 0.553 ' N ' HG12 ' S' ' 58' ' ' VAL . 11.8 tt0 -48.11 -33.24 7.92 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.886 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -67.78 -48.41 66.4 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.078 -1.049 . . . . 0.0 112.18 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 61' ' ' LEU . . . . . 0.755 HD12 ' O ' ' S' ' 61' ' ' LEU . 0.5 OUTLIER -61.58 -18.92 61.39 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 118.131 -1.428 . . . . 0.0 108.698 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 62' ' ' LEU . . . . . 0.614 ' O ' ' N ' ' S' ' 64' ' ' GLY . 1.7 tp -77.92 26.06 0.2 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.858 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 63' ' ' ARG . . . . . 0.504 ' H ' ' C ' ' S' ' 61' ' ' LEU . 61.5 mtt180 19.34 38.67 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.095 0 O-C-N 124.398 1.061 . . . . 0.0 113.832 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.614 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -70.59 -31.16 68.1 Favored Glycine 0 N--CA 1.49 2.288 0 C-N-CA 119.251 -1.452 . . . . 0.0 109.72 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -116.44 -68.08 0.95 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.335 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 84.1 mtp -125.44 -133.51 0.26 Allowed 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.069 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 67' ' ' SER . . . . . 0.569 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.3 OUTLIER 173.04 -71.78 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 118.903 -1.119 . . . . 0.0 110.544 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.486 ' C ' ' H ' ' S' ' 70' ' ' GLU . 1.1 pt20 -22.99 -39.91 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 124.395 1.059 . . . . 0.0 113.405 179.947 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 69' ' ' ARG . . . . . 0.569 ' N ' ' O ' ' S' ' 67' ' ' SER . 6.4 tpt180 -71.96 32.43 0.06 Allowed 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.914 -0.714 . . . . 0.0 112.333 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.486 ' H ' ' C ' ' S' ' 68' ' ' GLN . 0.0 OUTLIER -111.68 6.95 20.2 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.755 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 10.9 mt -83.42 145.83 28.77 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.349 -0.94 . . . . 0.0 111.514 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -69.6 93.18 0.68 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.911 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 6.8 m-80 -84.59 -101.71 0.05 Allowed 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.782 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -141.12 -26.25 0.72 Allowed 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.834 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 tp -126.68 7.85 6.88 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.027 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -54.39 -71.11 0.76 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 119.577 -1.296 . . . . 0.0 110.897 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.74 -86.14 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.305 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.69 128.02 1.65 Allowed Glycine 0 N--CA 1.49 2.288 0 C-N-CA 118.913 -1.613 . . . . 0.0 111.367 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.84 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -38.71 -41.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.307 0 CA-C-N 115.393 -0.403 . . . . 0.0 111.099 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.447 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.62 -42.72 86.36 Favored 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 118.807 -1.157 . . . . 0.0 110.835 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 19.1 m -53.17 -49.58 66.36 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 24.8 pt -72.8 11.13 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.447 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -105.96 -63.55 1.24 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.881 -1.128 . . . . 0.0 111.965 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 84' ' ' ARG . . . . . 0.448 ' H ' ' HD2' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -58.29 -21.57 49.38 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 118.459 -1.297 . . . . 0.0 110.876 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.39 -29.96 72.93 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.345 -1.407 . . . . 0.0 110.714 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -27.32 13.48 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.266 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -101.79 10.29 40.07 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.578 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 88' ' ' SER . . . . . 0.423 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.3 OUTLIER -46.48 -21.99 0.23 Allowed 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.265 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 89' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' S' ' 88' ' ' SER . 75.8 mt -37.69 -72.05 0.07 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 90' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' S' ' 92' ' ' ALA . 0.0 OUTLIER -58.93 -55.68 32.0 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.803 -1.159 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.84 -24.17 0.02 OUTLIER 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.87 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 92' ' ' ALA . . . . . 0.518 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -120.37 162.34 34.52 Favored Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.618 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 93' ' ' PRO . . . . . 0.518 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 1.2 Cg_endo -61.6 -178.33 0.28 Allowed 'Trans proline' 0 C--N 1.319 -0.98 0 C-N-CA 121.236 1.291 . . . . 0.0 111.394 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 24.5 t -100.5 -16.48 7.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.116 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -70.41 -6.07 33.0 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.588 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.3 -24.91 62.23 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.993 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 13.7 mtt85 -78.22 -14.39 59.47 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.58 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -104.77 -10.48 17.39 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.979 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.794 ' CH2' HG21 ' S' ' 103' ' ' VAL . 22.7 t90 -107.02 -58.14 1.98 Allowed 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 122.201 1.0 . . . . 0.0 112.459 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.575 HD21 HD13 ' S' ' 104' ' ' LEU . 0.6 OUTLIER -53.64 -37.56 63.22 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -179.585 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.53 ' C ' ' O ' ' S' ' 100' ' ' LEU . 8.1 mt-10 -43.81 -32.14 0.99 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 116.939 -1.904 . . . . 0.0 106.215 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 102' ' ' GLU . . . . . 0.534 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 tt0 -83.79 -27.48 28.79 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 112.683 -2.053 . . . . 0.0 112.054 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.794 HG21 ' CH2' ' S' ' 99' ' ' TRP . 45.0 t -85.74 -32.12 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 C-N-CA 116.01 -2.276 . . . . 0.0 111.304 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 104' ' ' LEU . . . . . 0.575 HD13 HD21 ' S' ' 100' ' ' LEU . 2.1 mp -97.14 -55.83 2.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.417 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 15.5 mt -75.79 -81.27 0.08 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 118.703 -1.199 . . . . 0.0 113.416 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' S' S ' 106' ' ' LYS . . . . . 0.42 ' O ' ' O ' ' S' ' 102' ' ' GLU . 7.2 tttm -86.61 108.25 18.52 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 119.024 -1.07 . . . . 0.0 112.124 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 116.328 -1.796 . . . . 0.0 110.832 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.465 ' CD1' ' NE ' ' R' ' 84' ' ' ARG . 29.9 m-90 . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 116.312 -1.804 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' R' R ' 109' ' ' TRP . . . . . . . . . . . . . 12.1 m-90 . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 116.477 -1.725 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.793 0.33 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 3.2 m -172.08 67.99 0.42 Allowed Pre-proline 0 C--N 1.305 -1.357 0 C-N-CA 119.059 -1.057 . . . . 0.0 111.661 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -65.8 -55.09 0.45 Allowed 'Trans proline' 0 C--N 1.313 -1.299 0 C-N-CA 121.373 1.382 . . . . 0.0 110.359 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -138.73 24.27 2.63 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.701 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -39.35 108.28 0.08 Allowed 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.722 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -99.99 -0.38 39.4 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.319 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.6 -88.2 0.5 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.715 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 18.2 mmt -71.18 132.7 45.39 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.445 -0.902 . . . . 0.0 110.833 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -165.25 -29.38 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.588 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -131.88 63.25 1.62 Allowed 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.027 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -89.17 -6.38 56.99 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.106 -1.037 . . . . 0.0 110.786 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -133.7 108.05 8.3 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.763 -0.775 . . . . 0.0 111.19 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -163.58 -13.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.459 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.424 ' C ' ' N ' ' R' ' 19' ' ' TRP . 4.6 tt0 -88.78 -79.25 0.32 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.626 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 18' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.2 mp0 -41.9 -34.57 0.69 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 123.339 1.542 . . . . 0.0 108.3 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CZ3' ' CD ' ' S' ' 48' ' ' ARG . 21.9 t-105 -57.19 -55.66 31.86 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 112.381 -2.19 . . . . 0.0 110.038 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 20' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' R' ' 17' ' ' GLN . 6.6 tp -56.55 -27.62 58.12 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.788 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' R' ' 24' ' ' ASP . 0.0 OUTLIER -65.33 -62.71 1.37 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.558 -1.257 . . . . 0.0 109.578 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.499 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.2 OUTLIER -33.85 -43.93 0.15 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.305 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 19.7 t -73.27 -35.57 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 119.549 -0.861 . . . . 0.0 110.2 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.592 ' N ' ' O ' ' R' ' 21' ' ' ARG . 34.7 t0 -59.56 -69.79 0.19 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.645 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.24 -41.29 5.75 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.246 -0.981 . . . . 0.0 109.689 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mt -48.86 -62.39 1.55 Allowed 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.225 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -59.94 -38.21 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.528 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -61.52 -35.33 77.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.502 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.605 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -94.31 -39.73 10.34 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.355 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -47.74 -29.48 3.13 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.474 -0.89 . . . . 0.0 112.035 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -52.32 -30.92 30.67 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.375 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -109.11 -79.68 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.234 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 p30 173.51 31.07 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.097 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 34' ' ' LEU . . . . . 0.605 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 1.3 mm? -94.64 -21.95 18.47 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.862 0.839 . . . . 0.0 110.202 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 35' ' ' HIS . . . . . 0.475 ' O ' HD22 ' R' ' 39' ' ' LEU . 13.8 p-80 -49.61 -23.49 1.71 Allowed 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 114.296 -1.32 . . . . 0.0 113.962 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.3 mt -74.08 -66.02 0.54 Allowed Pre-proline 0 N--CA 1.487 1.412 0 C-N-CA 118.164 -1.414 . . . . 0.0 111.316 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 1.4 Cg_endo -52.74 -29.54 42.62 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 120.619 0.879 . . . . 0.0 110.301 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 38' ' ' LEU . . . . . 0.446 HD11 HD21 ' S' ' 96' ' ' LEU . 9.0 mp -82.04 -29.27 32.02 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.845 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.475 HD22 ' O ' ' R' ' 35' ' ' HIS . 0.0 OUTLIER -59.34 -30.66 68.53 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.78 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 40' ' ' ASN . . . . . 0.453 ' CG ' HH12 ' R' ' 48' ' ' ARG . 0.8 OUTLIER -77.06 11.46 1.8 Allowed 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 118.716 -1.194 . . . . 0.0 109.199 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 41' ' ' LEU . . . . . 0.458 ' H ' ' C ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -111.28 -69.0 0.89 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.335 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 42' ' ' MET . . . . . 0.413 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -90.35 41.47 1.05 Allowed 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 118.437 -1.305 . . . . 0.0 108.878 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 43' ' ' LEU . . . . . 0.421 ' O ' ' O ' ' R' ' 39' ' ' LEU . 4.5 tt 173.89 135.02 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.511 -1.662 . . . . 0.0 106.511 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.5 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -171.25 -38.31 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.892 0 C-N-CA 114.799 -2.76 . . . . 0.0 117.47 -179.437 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.5 ' CD ' ' H ' ' R' ' 44' ' ' THR . 71.7 Cg_endo -98.69 -105.31 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 121.564 1.509 . . . . 0.0 114.869 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -45.1 -28.84 0.78 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.058 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.765 ' OE1' HD11 ' S' ' 43' ' ' LEU . 7.7 mm-40 -57.66 -67.18 0.36 Allowed 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 118.348 -1.341 . . . . 0.0 109.409 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 48' ' ' ARG . . . . . 0.453 HH12 ' CG ' ' R' ' 40' ' ' ASN . 1.9 tpp180 -42.92 -24.68 0.07 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.063 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 49' ' ' GLU . . . . . 0.468 ' N ' ' O ' ' R' ' 47' ' ' GLU . 11.9 mt-10 -96.03 -69.41 0.76 Allowed 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.125 -1.03 . . . . 0.0 113.509 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.832 ' HB1' ' HE ' ' R' ' 54' ' ' ARG . . . -58.8 -27.27 64.89 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 51' ' ' LEU . . . . . 1.027 HD23 ' N ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -71.71 -37.92 70.59 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.039 -1.464 . . . . 0.0 112.306 -179.671 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 52' ' ' GLY . . . . . 1.027 ' N ' HD23 ' R' ' 51' ' ' LEU . . . -71.21 -36.25 63.79 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 108.556 -1.817 . . . . 0.0 108.556 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.533 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -64.25 -79.65 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.341 -0.929 . . . . 0.0 109.997 179.922 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.832 ' HE ' ' HB1' ' R' ' 50' ' ' ALA . 17.1 mtt-85 -32.44 -55.59 0.34 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.213 -1.358 . . . . 0.0 112.977 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 2.1 p -62.89 -30.31 49.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 117.439 -1.704 . . . . 0.0 111.486 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.639 ' NH1' ' HE ' ' S' ' 21' ' ' ARG . 11.1 mmt180 -76.69 -45.29 30.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.297 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -65.61 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 C-N-CA 118.044 -1.462 . . . . 0.0 110.292 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 0.717 HG13 ' N ' ' R' ' 59' ' ' GLU . 9.4 p -45.71 -58.12 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 C-N-CA 117.963 -1.495 . . . . 0.0 111.203 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.717 ' N ' HG13 ' R' ' 58' ' ' VAL . 78.6 mt-10 -54.64 -28.19 45.18 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.723 -1.191 . . . . 0.0 112.706 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -79.38 -51.73 9.02 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.937 -1.105 . . . . 0.0 112.98 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 13.3 mt -67.88 -9.82 48.02 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.655 -1.218 . . . . 0.0 111.532 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.55 -37.06 65.7 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.762 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 31.9 ttm-85 -111.19 -45.4 3.43 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.955 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 64' ' ' GLY . . . . . 0.545 ' C ' ' H ' ' R' ' 66' ' ' MET . . . -58.35 -27.22 60.32 Favored Glycine 0 N--CA 1.492 2.378 0 C-N-CA 119.454 -1.355 . . . . 0.0 110.511 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 61.23 -25.22 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 66' ' ' MET . . . . . 0.545 ' H ' ' C ' ' R' ' 64' ' ' GLY . 30.5 mmm -140.22 109.03 5.97 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.588 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 17.5 p -173.67 76.73 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 119.653 -0.819 . . . . 0.0 109.875 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 68' ' ' GLN . . . . . 0.433 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.0 OUTLIER -125.3 -34.31 2.74 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.244 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.31 27.25 0.2 Allowed 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.521 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 70' ' ' GLU . . . . . 0.5 ' CG ' ' H ' ' R' ' 71' ' ' LEU . 0.9 OUTLIER -43.53 -65.09 0.54 Allowed 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 118.915 -1.114 . . . . 0.0 110.546 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 71' ' ' LEU . . . . . 0.5 ' H ' ' CG ' ' R' ' 70' ' ' GLU . 1.0 OUTLIER 178.61 -11.76 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.465 179.958 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 20.7 tttm 48.44 78.37 0.08 Allowed 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 118.697 -1.201 . . . . 0.0 109.948 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 73' ' ' ASN . . . . . 0.593 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.5 OUTLIER -90.31 12.45 18.22 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.268 -0.973 . . . . 0.0 110.83 -179.904 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 52.62 -74.78 0.01 OUTLIER 'General case' 0 C--N 1.285 -2.23 0 CA-C-N 113.695 -1.593 . . . . 0.0 111.211 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.593 ' N ' ' O ' ' R' ' 73' ' ' ASN . 1.0 OUTLIER -58.31 -28.96 65.52 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.418 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -70.38 -44.81 57.7 Favored Glycine 0 N--CA 1.486 2.011 0 C-N-CA 119.354 -1.403 . . . . 0.0 109.675 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 77' ' ' ALA . . . . . 0.422 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . -167.05 90.53 0.37 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.186 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 78' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' R' ' 77' ' ' ALA . . . -34.65 135.33 0.35 Allowed Glycine 0 N--CA 1.495 2.584 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.974 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.878 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -35.6 -35.98 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.057 -0.571 . . . . 0.0 111.103 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.504 ' HB1' ' NH2' ' R' ' 84' ' ' ARG . . . -58.17 -65.83 0.58 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.826 -1.149 . . . . 0.0 110.366 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 81' ' ' THR . . . . . 0.434 ' HA ' ' HE1' ' R' ' 1' ' ' TRP . 53.2 m -40.42 -42.25 1.56 Allowed 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 82' ' ' ILE . . . . . 0.45 HD13 HG21 ' R' ' 82' ' ' ILE . 2.0 pt -85.71 -6.69 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -179.671 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -78.81 -43.18 25.92 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 118.209 -1.397 . . . . 0.0 111.807 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.504 ' NH2' ' HB1' ' R' ' 80' ' ' ALA . 1.8 ptp180 -67.22 -23.53 65.74 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.653 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.44 3.75 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.229 -1.462 . . . . 0.0 110.194 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 68.0 m -89.4 -32.33 17.32 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.576 -0.85 . . . . 0.0 111.278 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 87' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' R' ' 89' ' ' LEU . 5.2 m-20 -86.27 10.66 14.1 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.291 -0.963 . . . . 0.0 110.88 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -40.68 -21.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.698 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 89' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' R' ' 87' ' ' ASN . 72.1 mt -58.19 -67.23 0.37 Allowed 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.94 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 90' ' ' LYS . . . . . 0.406 ' HG3' ' H ' ' R' ' 90' ' ' LYS . 0.0 OUTLIER -91.8 -27.09 18.21 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.136 -1.026 . . . . 0.0 113.466 -179.812 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -50.84 72.08 Favored 'General case' 0 C--N 1.284 -2.271 0 C-N-CA 118.72 -1.192 . . . . 0.0 112.827 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.57 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -91.66 162.46 31.3 Favored Pre-proline 0 N--CA 1.489 1.521 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 93' ' ' PRO . . . . . 0.57 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.8 Cg_exo -51.53 142.13 40.19 Favored 'Trans proline' 0 C--N 1.323 -0.781 0 C-N-CA 121.628 1.552 . . . . 0.0 112.038 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 23.6 t -92.61 -15.63 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.541 -0.864 . . . . 0.0 111.122 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -70.9 -3.8 21.1 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.04 -1.064 . . . . 0.0 110.284 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 96' ' ' LEU . . . . . 0.57 HD11 HD22 ' S' ' 38' ' ' LEU . 1.6 tp -67.6 -44.11 78.9 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.043 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.81 -19.15 0.89 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.382 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -70.59 -34.25 71.97 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.037 -1.065 . . . . 0.0 110.704 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.65 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 15.7 t90 -100.38 -57.46 2.11 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.524 HD13 ' HB ' ' R' ' 103' ' ' VAL . 2.0 mm? -41.54 -34.97 0.63 Allowed 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.556 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' R' ' 100' ' ' LEU . 0.5 OUTLIER -44.48 -31.0 0.96 Allowed 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 117.851 -1.54 . . . . 0.0 108.449 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' C ' ' R' ' 100' ' ' LEU . 1.8 mt-10 -95.53 -29.5 14.33 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 114.081 -1.418 . . . . 0.0 111.803 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.65 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 4.2 t -81.16 -20.92 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 116.792 -1.963 . . . . 0.0 110.678 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.45 -55.35 3.44 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.158 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tp -50.78 -41.91 57.44 Favored 'General case' 0 C--N 1.308 -1.197 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.291 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 tttt -40.53 -73.95 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 119.688 -0.805 . . . . 0.0 111.297 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 116.32 -1.8 . . . . 0.0 110.717 -179.944 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' S' S ' 4' ' ' GLN . . . . . 0.422 ' O ' ' O ' ' S' ' 5' ' ' SER . 4.3 tt0 . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 121.079 0.466 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 5' ' ' SER . . . . . 0.422 ' O ' ' O ' ' S' ' 4' ' ' GLN . 0.0 OUTLIER 57.35 157.11 0.08 OUTLIER Pre-proline 0 N--CA 1.492 1.635 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.641 -179.955 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.05 142.81 99.78 Favored 'Trans proline' 0 C--N 1.324 -0.756 0 C-N-CA 121.574 1.516 . . . . 0.0 111.999 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -108.04 -19.0 13.65 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.513 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 66.2 m -150.73 146.51 26.48 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.753 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -146.34 173.07 12.58 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.734 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.46 -59.25 2.86 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.287 -0.965 . . . . 0.0 111.205 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 11' ' ' MET . . . . . 0.473 ' O ' ' HB3' ' S' ' 12' ' ' ALA . 7.9 tpt -164.43 -16.9 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 118.597 -1.241 . . . . 0.0 111.781 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 12' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' S' ' 11' ' ' MET . . . 61.19 -155.55 0.35 Allowed 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.063 -1.055 . . . . 0.0 110.556 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -139.66 5.81 2.22 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.29 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -83.5 159.74 21.64 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.173 -1.011 . . . . 0.0 110.356 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -93.97 121.47 35.47 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.706 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -129.26 -11.79 4.59 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.321 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.525 ' N ' ' OE1' ' S' ' 17' ' ' GLN . 4.7 mp0 -89.83 -76.94 0.41 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.627 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.5 mt-10 -42.13 -30.99 0.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 122.721 1.248 . . . . 0.0 108.328 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 19' ' ' TRP . . . . . 0.472 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.254 56.0 t-105 -49.76 -56.04 11.75 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.809 179.76 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 5.3 tp -52.43 -40.21 61.93 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 113.841 -1.527 . . . . 0.0 112.045 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.639 ' HE ' ' NH1' ' R' ' 56' ' ' ARG . 4.3 mtt-85 -59.21 -72.64 0.1 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.14 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.552 ' CD2' HD12 ' R' ' 51' ' ' LEU . 0.0 OUTLIER -32.1 -44.47 0.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.17 179.62 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.464 ' O ' ' N ' ' S' ' 26' ' ' LEU . 71.0 t -63.28 -61.9 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.481 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.414 ' C ' ' O ' ' S' ' 23' ' ' VAL . 41.9 t0 -32.55 -55.37 0.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.137 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.479 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.7 OUTLIER -60.78 -42.23 97.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.802 -1.159 . . . . 0.0 110.351 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.464 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -54.2 -56.38 18.86 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 119.668 -0.813 . . . . 0.0 112.06 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -58.46 -56.86 16.7 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 4.6 m120 -60.9 -49.87 75.72 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.269 -0.973 . . . . 0.0 112.385 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 29' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -52.99 -37.93 61.81 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 118.714 -1.194 . . . . 0.0 111.383 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -52.1 -43.42 63.92 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 118.456 -1.297 . . . . 0.0 109.807 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -37.72 74.63 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -89.68 -12.13 40.41 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.366 179.882 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' S' ' 29' ' ' ALA . 3.1 t70 78.57 3.91 2.59 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.3 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.95 -0.06 33.55 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.714 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 35' ' ' HIS . . . . . 0.464 ' N ' ' ND1' ' S' ' 35' ' ' HIS . 0.8 OUTLIER -56.91 -15.77 5.52 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.666 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.454 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 9.0 mt -76.68 -63.88 0.52 Allowed Pre-proline 0 C--N 1.304 -1.373 0 C-N-CA 118.37 -1.332 . . . . 0.0 110.299 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.7 Cg_endo -52.32 -37.71 71.71 Favored 'Trans proline' 0 C--N 1.319 -0.991 0 N-CA-C 109.716 -0.917 . . . . 0.0 109.716 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 38' ' ' LEU . . . . . 0.57 HD22 HD11 ' R' ' 96' ' ' LEU . 3.8 mm? -66.65 -41.76 87.71 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.405 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.514 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -59.08 -14.37 9.7 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 40' ' ' ASN . . . . . 0.411 ' HA ' ' HG1' ' S' ' 44' ' ' THR . 0.6 OUTLIER -91.21 -11.51 38.07 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 114.886 -1.052 . . . . 0.0 112.423 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -101.61 -65.82 0.96 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 119.563 -0.855 . . . . 0.0 112.668 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.16 37.54 0.73 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.38 -1.328 . . . . 0.0 110.29 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 43' ' ' LEU . . . . . 0.765 HD11 ' OE1' ' R' ' 47' ' ' GLU . 1.9 tp 172.5 132.51 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 CA-C-N 114.614 -1.175 . . . . 0.0 107.995 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.437 ' CB ' ' O ' ' S' ' 43' ' ' LEU . 0.7 OUTLIER -176.47 -48.13 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.335 0 C-N-CA 114.927 -2.709 . . . . 0.0 117.569 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.2 -101.81 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.223 0 N-CA-C 115.284 1.225 . . . . 0.0 115.284 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -52.79 -23.36 6.73 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.837 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 47' ' ' GLU . . . . . 0.554 ' N ' ' CD ' ' S' ' 47' ' ' GLU . 0.0 OUTLIER -62.78 -55.23 28.34 Favored 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.815 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 48' ' ' ARG . . . . . 0.441 ' CD ' ' CZ3' ' R' ' 19' ' ' TRP . 14.7 mmm-85 -52.47 -39.78 61.55 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.505 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -71.75 0.23 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.422 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.31 -25.53 1.61 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.557 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.14 -63.95 1.05 Allowed 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 119.383 -0.927 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.26 -40.91 11.04 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.632 -1.747 . . . . 0.0 109.153 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.444 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -54.38 -82.2 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.831 -0.748 . . . . 0.0 112.943 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.511 ' HB3' ' CE3' ' R' ' 109' ' ' TRP . 5.3 ptt180 -43.46 -40.79 3.99 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.668 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.61 -34.07 67.34 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.267 0 C-N-CA 117.73 -1.588 . . . . 0.0 110.588 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.6 OUTLIER -82.98 -36.03 25.41 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 118.023 -1.471 . . . . 0.0 112.578 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 0.702 ' C ' HD12 ' S' ' 57' ' ' ILE . 0.3 OUTLIER -64.67 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 115.861 -2.336 . . . . 0.0 106.597 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 38.5 t -62.63 -67.76 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 118.512 -1.275 . . . . 0.0 109.218 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 59' ' ' GLU . . . . . 0.452 ' O ' ' OE1' ' S' ' 59' ' ' GLU . 0.0 OUTLIER -45.34 -41.89 9.39 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.287 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 60' ' ' GLU . . . . . 0.425 ' O ' ' N ' ' S' ' 63' ' ' ARG . 16.6 mm-40 -58.75 -45.52 89.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.931 -1.108 . . . . 0.0 111.074 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 16.2 mt -51.31 -47.63 62.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 118.273 -1.371 . . . . 0.0 108.83 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.52 -23.56 58.46 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.653 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 63' ' ' ARG . . . . . 0.45 ' C ' ' H ' ' S' ' 65' ' ' GLU . 4.3 tpt180 -91.74 22.7 3.98 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.941 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 64' ' ' GLY . . . . . . . . . . . . . . . -52.25 -8.84 0.52 Allowed Glycine 0 N--CA 1.492 2.432 0 C-N-CA 119.773 -1.203 . . . . 0.0 111.064 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 65' ' ' GLU . . . . . 0.45 ' H ' ' C ' ' S' ' 63' ' ' ARG . 4.5 mt-10 -47.71 -30.54 3.92 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.116 -1.034 . . . . 0.0 110.54 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.48 127.14 25.29 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.594 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 36.6 t -171.54 73.74 0.05 Allowed 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 118.844 -1.143 . . . . 0.0 111.376 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -117.86 -50.09 2.51 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.616 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -97.56 27.17 4.46 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.115 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 70' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -125.56 -13.22 6.57 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.923 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 71' ' ' LEU . . . . . 0.423 ' O ' ' C ' ' S' ' 72' ' ' LYS . 0.5 OUTLIER -48.83 155.68 0.56 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 118.279 -1.369 . . . . 0.0 111.186 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 72' ' ' LYS . . . . . 0.423 ' C ' ' O ' ' S' ' 71' ' ' LEU . 0.9 OUTLIER -23.87 109.98 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.919 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 73' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' S' ' 75' ' ' LEU . 29.2 t30 -93.97 18.29 10.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 122.231 1.015 . . . . 0.0 108.866 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 43.04 8.47 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 112.382 -2.19 . . . . 0.0 113.449 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 75' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' S' ' 73' ' ' ASN . 8.8 mt -128.99 -46.29 1.25 Allowed 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.284 -0.967 . . . . 0.0 111.465 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -66.62 -31.41 78.49 Favored Glycine 0 N--CA 1.492 2.43 0 C-N-CA 119.7 -1.238 . . . . 0.0 112.451 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 77' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' S' ' 78' ' ' GLY . . . -176.74 99.75 0.05 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 118.64 -1.224 . . . . 0.0 111.033 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 78' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -36.35 142.05 0.18 Allowed Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.427 -0.892 . . . . 0.0 111.791 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.76 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -36.75 -30.77 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -45.98 -66.9 0.33 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.74 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 1.5 m -40.11 -69.53 0.13 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 82' ' ' ILE . . . . . 0.578 ' HA ' HD13 ' S' ' 57' ' ' ILE . 19.4 pt -52.62 -14.23 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -179.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.537 ' O ' ' N ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -94.28 -60.39 1.74 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.367 -1.333 . . . . 0.0 112.792 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -50.16 -5.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.014 -1.074 . . . . 0.0 111.55 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 85' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' S' ' 83' ' ' THR . . . -48.6 -58.05 7.83 Favored Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.584 -1.293 . . . . 0.0 110.845 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 86' ' ' SER . . . . . 0.424 ' O ' ' OG ' ' S' ' 86' ' ' SER . 17.3 p -174.25 46.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.063 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -98.56 -27.17 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.267 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 88' ' ' SER . . . . . 0.463 ' C ' ' H ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -129.79 -38.35 1.49 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.877 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.0 -2.42 1.22 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.306 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 90' ' ' LYS . . . . . 0.463 ' H ' ' C ' ' S' ' 88' ' ' SER . 0.8 OUTLIER -68.89 -40.68 79.05 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.017 -0.992 . . . . 0.0 113.026 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.69 -22.66 24.53 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 92' ' ' ALA . . . . . 0.755 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . -52.02 -56.39 22.16 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 117.836 -1.546 . . . . 0.0 112.084 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 93' ' ' PRO . . . . . 0.755 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 31.4 Cg_endo -83.05 126.41 4.37 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 120.802 1.001 . . . . 0.0 110.03 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 94' ' ' VAL . . . . . 0.534 ' C ' ' H ' ' S' ' 96' ' ' LEU . 15.4 t -86.44 -37.3 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 118.594 -1.242 . . . . 0.0 111.829 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -3.14 0.27 Allowed 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.901 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 96' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' S' ' 94' ' ' VAL . 0.2 OUTLIER -85.83 -29.84 23.44 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.486 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -8.43 25.25 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -103.79 -6.12 21.76 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.336 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -113.22 -64.43 1.31 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 1.048 HD22 ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -9.2 -84.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 120.865 3.654 . . . . 0.0 120.865 -179.581 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 1.048 ' H ' HD22 ' S' ' 100' ' ' LEU . 3.5 mm-40 -92.71 -37.52 12.33 Favored 'General case' 0 C--N 1.278 -2.507 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.462 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 102' ' ' GLU . . . . . 0.419 ' C ' ' O ' ' S' ' 101' ' ' GLU . 2.0 tt0 -53.57 -19.06 3.39 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.591 ' N ' ' C ' ' S' ' 101' ' ' GLU . 95.2 t -108.15 -67.13 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.161 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 9.7 mt -43.93 -55.52 4.54 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 117.936 -1.506 . . . . 0.0 111.331 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 105' ' ' LEU . . . . . 0.408 ' HA ' HD12 ' S' ' 105' ' ' LEU . 12.9 tp -56.85 -71.05 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.836 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 mmtt -48.45 -38.12 19.0 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.97 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 116.398 -1.763 . . . . 0.0 110.851 179.929 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.554 ' CD1' ' NH1' ' R' ' 54' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 116.31 -1.805 . . . . 0.0 110.031 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.511 ' CE3' ' HB3' ' S' ' 54' ' ' ARG . 2.8 p90 . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 116.114 -1.898 . . . . 0.0 108.777 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 . . . . . 0 N--CA 1.485 1.307 0 CA-C-O 120.9 0.381 . . . . 0.0 110.033 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 84.2 p -165.03 68.47 1.31 Allowed Pre-proline 0 N--CA 1.487 1.377 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.082 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.27 -36.48 35.78 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 121.65 1.567 . . . . 0.0 111.454 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 t80 67.07 37.14 3.87 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.768 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 14.7 t -150.93 9.72 0.59 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.814 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . 48.73 70.9 0.41 Allowed 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.819 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -174.58 176.43 2.32 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.782 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 4.5 ptt? -165.81 -19.96 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.907 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 12' ' ' ALA . . . . . 0.476 ' C ' ' H ' ' R' ' 14' ' ' GLN . . . -70.05 -78.6 0.07 Allowed 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.751 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -76.09 30.68 0.12 Allowed 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.329 -0.949 . . . . 0.0 110.58 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 14' ' ' GLN . . . . . 0.476 ' H ' ' C ' ' R' ' 12' ' ' ALA . 4.8 tt0 -58.31 137.27 57.28 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.809 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 60.0 mtt85 -74.6 105.15 5.57 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.306 -0.957 . . . . 0.0 110.961 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -147.25 -6.04 0.49 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.572 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' R' ' 20' ' ' LEU . 1.5 mt-30 -97.61 -79.59 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.648 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 18' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' R' ' 18' ' ' GLU . 1.9 mp0 -47.21 -28.69 1.98 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 19' ' ' TRP . . . . . 0.48 ' N ' ' C ' ' R' ' 17' ' ' GLN . 10.9 t-105 -62.56 -53.23 57.78 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.308 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 20' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' R' ' 17' ' ' GLN . 0.8 OUTLIER -56.77 -38.06 71.94 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.249 179.708 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.518 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mtt180 -52.59 -70.07 0.1 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 118.352 -1.339 . . . . 0.0 108.625 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.518 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -28.55 -47.65 0.05 Allowed 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.552 0.532 . . . . 0.0 110.698 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 22.6 t -68.94 -49.18 65.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.675 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' R' ' 21' ' ' ARG . 21.6 t70 -46.45 -76.45 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.83 -0.748 . . . . 0.0 110.94 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.618 HD12 ' SD ' ' R' ' 42' ' ' MET . 0.4 OUTLIER -41.49 -41.53 2.11 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.828 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.35 -59.25 4.17 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.052 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -71.5 -38.21 71.17 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.693 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -15.22 23.01 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.997 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.73 -43.35 5.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.463 -0.895 . . . . 0.0 112.013 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -43.35 -27.76 0.28 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.207 -0.997 . . . . 0.0 110.906 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -51.54 -42.96 62.16 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.524 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 32' ' ' ASN . . . . . 0.41 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 9.7 m-80 -102.18 -72.14 0.7 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.494 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 33' ' ' ASP . . . . . 0.718 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.5 OUTLIER 169.77 18.12 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.39 -0.924 . . . . 0.0 112.425 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 34' ' ' LEU . . . . . 1.023 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.1 OUTLIER -92.29 -7.97 46.48 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.126 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -51.72 -13.21 0.24 Allowed 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 119.385 -0.926 . . . . 0.0 111.981 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.5 mt -81.41 -65.55 0.25 Allowed Pre-proline 0 N--CA 1.482 1.131 0 C-N-CA 118.141 -1.424 . . . . 0.0 110.1 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -49.51 -27.62 14.62 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 N-CA-C 109.968 -0.82 . . . . 0.0 109.968 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 38' ' ' LEU . . . . . 0.538 HD21 ' CZ3' ' S' ' 99' ' ' TRP . 8.0 mp -76.41 -41.87 46.21 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.796 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' R' ' 39' ' ' LEU . 1.3 tp -50.17 -47.68 54.33 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.464 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 40' ' ' ASN . . . . . 0.572 ' O ' ' N ' ' R' ' 109' ' ' TRP . 1.1 m120 -70.78 3.13 3.44 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.056 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 mt -110.76 -62.08 1.59 Allowed 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.764 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 42' ' ' MET . . . . . 0.618 ' SD ' HD12 ' R' ' 25' ' ' LEU . 0.1 OUTLIER -82.57 29.79 0.43 Allowed 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.08 -179.856 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 43' ' ' LEU . . . . . 0.465 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.8 OUTLIER 163.39 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.537 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.638 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.6 OUTLIER -176.82 -41.22 0.0 OUTLIER Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 117.937 -1.505 . . . . 0.0 114.026 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.638 ' HD2' ' H ' ' R' ' 44' ' ' THR . 14.6 Cg_endo -78.85 -102.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.826 1.017 . . . . 0.0 112.337 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.05 -14.21 2.46 Favored 'General case' 0 C--N 1.308 -1.224 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.172 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.624 ' O ' HD13 ' R' ' 51' ' ' LEU . 0.7 OUTLIER -77.64 -55.65 5.17 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.127 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -49.06 -37.83 22.32 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.253 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 49' ' ' GLU . . . . . 0.401 ' O ' ' OG1' ' R' ' 53' ' ' THR . 6.5 mt-10 -65.52 -67.74 0.42 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.614 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.45 -34.06 15.79 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.036 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 51' ' ' LEU . . . . . 0.624 HD13 ' O ' ' R' ' 47' ' ' GLU . 4.2 mp -53.71 -77.65 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.46 -0.896 . . . . 0.0 111.54 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.16 -51.25 11.66 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.784 -1.198 . . . . 0.0 111.548 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' R' ' 50' ' ' ALA . 0.1 OUTLIER -42.08 -81.23 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 121.754 0.788 . . . . 0.0 111.458 -179.955 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.449 ' CD ' ' C ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -34.36 -52.1 0.47 Allowed 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.036 -1.438 . . . . 0.0 112.823 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.7 t -60.62 -32.91 52.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 C-N-CA 119.191 -1.004 . . . . 0.0 112.519 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.35 -33.09 32.64 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.899 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 0.743 ' O ' HD12 ' R' ' 57' ' ' ILE . 0.0 OUTLIER -78.06 -47.59 24.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 C-N-CA 118.67 -1.212 . . . . 0.0 107.763 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 58' ' ' VAL . . . . . . . . . . . . . 42.9 t -53.77 -63.26 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 119.077 -1.049 . . . . 0.0 110.325 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.13 -38.31 57.09 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 119.581 -0.847 . . . . 0.0 111.875 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -63.24 -30.57 71.68 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.481 -0.887 . . . . 0.0 112.979 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 61' ' ' LEU . . . . . 0.65 HD12 ' C ' ' R' ' 61' ' ' LEU . 0.4 OUTLIER -85.14 -27.55 26.14 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.413 -1.315 . . . . 0.0 111.451 -179.841 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -48.67 64.67 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.184 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 6.3 ptt180 -106.84 1.1 24.49 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.856 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.68 24.92 23.75 Favored Glycine 0 N--CA 1.49 2.295 0 C-N-CA 119.319 -1.42 . . . . 0.0 110.896 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 65' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -46.28 -31.69 2.67 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.237 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.1 50.75 0.76 Allowed 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.193 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 67' ' ' SER . . . . . 0.436 ' O ' ' OG ' ' R' ' 67' ' ' SER . 1.4 t 171.89 84.12 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.32 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.021 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 68' ' ' GLN . . . . . 0.484 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.5 OUTLIER -125.19 -30.57 3.17 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.019 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 69' ' ' ARG . . . . . 0.45 ' CG ' ' O ' ' R' ' 69' ' ' ARG . 0.0 OUTLIER -80.45 25.2 0.42 Allowed 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 122.467 1.127 . . . . 0.0 109.743 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 70' ' ' GLU . . . . . 0.484 ' H ' ' C ' ' R' ' 68' ' ' GLN . 0.0 OUTLIER -126.06 -12.54 6.38 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.293 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 71' ' ' LEU . . . . . 0.409 ' O ' ' N ' ' R' ' 73' ' ' ASN . 4.2 mt -74.57 -24.9 58.99 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.639 -0.824 . . . . 0.0 111.037 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -66.88 75.13 0.11 Allowed 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.253 -0.979 . . . . 0.0 111.169 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 73' ' ' ASN . . . . . 0.615 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.4 OUTLIER -98.43 10.06 41.69 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.466 -0.894 . . . . 0.0 109.386 179.876 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 48.71 -76.16 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 112.948 -1.933 . . . . 0.0 111.361 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.615 ' N ' ' O ' ' R' ' 73' ' ' ASN . 1.4 tp -56.51 -11.87 1.48 Allowed 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.912 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -102.25 -37.06 3.42 Favored Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.604 -1.284 . . . . 0.0 110.861 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 77' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . -169.89 92.97 0.23 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 119.505 -0.878 . . . . 0.0 110.404 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 78' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . -34.71 129.33 0.59 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.439 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.913 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -35.91 -29.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-N 115.391 -0.404 . . . . 0.0 111.289 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -52.83 -1.17 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.328 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 81' ' ' THR . . . . . 0.567 ' CB ' ' HE1' ' R' ' 1' ' ' TRP . 2.2 t -101.11 -36.68 8.88 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.665 -0.814 . . . . 0.0 112.583 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 82' ' ' ILE . . . . . 0.424 HD13 HG21 ' R' ' 82' ' ' ILE . 12.7 pt -79.99 3.77 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.711 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.527 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.2 OUTLIER -77.25 -51.5 10.8 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.051 -1.06 . . . . 0.0 110.148 179.865 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.401 ' N ' ' OG1' ' R' ' 83' ' ' THR . 3.6 ptm180 -81.33 -12.09 59.13 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.477 -0.889 . . . . 0.0 110.685 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.28 -42.66 4.23 Favored Glycine 0 N--CA 1.488 2.158 0 C-N-CA 119.46 -1.352 . . . . 0.0 110.161 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 10.1 t -54.59 -50.81 67.15 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.468 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 87' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.1 OUTLIER -93.18 -78.72 0.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.42 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 88' ' ' SER . . . . . 0.479 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.2 OUTLIER 73.57 -40.57 0.47 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.409 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' R' R ' 89' ' ' LEU . . . . . 0.462 ' H ' ' C ' ' R' ' 87' ' ' ASN . 8.4 mt -49.64 -21.23 0.96 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.141 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 90' ' ' LYS . . . . . 0.404 ' N ' ' C ' ' R' ' 88' ' ' SER . 4.5 mmtp -45.09 -62.56 1.19 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.894 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.36 -26.99 65.86 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.037 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' R' ' 89' ' ' LEU . . . 41.57 65.54 4.55 Favored Pre-proline 0 C--N 1.302 -1.459 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.324 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 93' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' R' ' 95' ' ' GLU . 11.9 Cg_endo -78.67 100.24 1.34 Allowed 'Trans proline' 0 C--N 1.314 -1.259 0 C-N-CA 121.591 1.528 . . . . 0.0 110.33 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 94' ' ' VAL . . . . . 0.423 ' H ' HG23 ' R' ' 94' ' ' VAL . 2.9 t -67.17 10.69 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.63 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 95' ' ' GLU . . . . . 0.484 ' H ' ' C ' ' R' ' 93' ' ' PRO . 6.6 mt-10 -89.08 -37.64 14.95 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.749 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.12 -56.11 11.37 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.563 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -50.06 -18.0 0.49 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.425 -0.91 . . . . 0.0 111.086 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -93.12 -26.61 17.37 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.574 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.68 ' CE3' HG21 ' R' ' 103' ' ' VAL . 4.9 t90 -110.62 -62.43 1.53 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.643 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.472 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.98 -30.3 0.26 Allowed 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.46 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' R' ' 100' ' ' LEU . 18.9 pt-20 -47.08 -36.65 8.43 Favored 'General case' 0 C--N 1.293 -1.861 0 C-N-CA 117.468 -1.693 . . . . 0.0 106.978 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.472 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 4.5 mt-10 -92.04 -28.7 17.01 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.385 -1.734 . . . . 0.0 112.533 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.68 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.2 t -89.74 -7.21 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 C-N-CA 117.423 -1.711 . . . . 0.0 110.417 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 104' ' ' LEU . . . . . 0.43 ' HA ' HD12 ' R' ' 104' ' ' LEU . 21.1 tp -99.19 -53.18 3.31 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.907 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 105' ' ' LEU . . . . . 0.47 HD22 ' N ' ' R' ' 105' ' ' LEU . 4.0 mm? -71.22 -66.16 0.65 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.874 -1.13 . . . . 0.0 110.207 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 24.6 tttt -47.08 -34.6 6.07 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.538 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 116.397 -1.763 . . . . 0.0 110.74 179.978 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' S' S ' 4' ' ' GLN . . . . . 0.509 ' N ' ' CD ' ' S' ' 4' ' ' GLN . 2.0 mm-40 . . . . . 0 N--CA 1.501 2.117 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 8.0 t -163.17 69.82 1.89 Allowed Pre-proline 0 C--N 1.297 -1.689 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 6' ' ' PRO . . . . . 0.425 ' O ' ' N ' ' S' ' 8' ' ' SER . 32.4 Cg_exo -29.81 145.54 0.02 OUTLIER 'Trans proline' 0 C--O 1.214 -0.686 0 C-N-CA 122.924 2.416 . . . . 0.0 116.113 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 7' ' ' TYR . . . . . 0.468 ' O ' ' O ' ' S' ' 8' ' ' SER . 0.1 OUTLIER -31.15 -37.39 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 113.228 -1.806 . . . . 0.0 112.767 -179.869 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 8' ' ' SER . . . . . 0.468 ' O ' ' O ' ' S' ' 7' ' ' TYR . 24.6 p 33.95 99.7 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.975 0 CA-C-O 121.674 0.749 . . . . 0.0 112.646 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 9' ' ' ALA . . . . . 0.511 ' O ' ' HB2' ' S' ' 10' ' ' ALA . . . -65.51 101.63 0.62 Allowed 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.786 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 10' ' ' ALA . . . . . 0.511 ' HB2' ' O ' ' S' ' 9' ' ' ALA . . . 168.55 1.8 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 11' ' ' MET . . . . . 0.509 ' O ' ' C ' ' S' ' 12' ' ' ALA . 0.1 OUTLIER -64.15 100.55 0.34 Allowed 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.433 -1.258 . . . . 0.0 112.624 179.961 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 12' ' ' ALA . . . . . 0.509 ' C ' ' O ' ' S' ' 11' ' ' MET . . . 12.65 88.57 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -83.64 -1.44 53.95 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 118.835 -1.146 . . . . 0.0 111.265 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -145.99 75.51 1.42 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.541 -0.864 . . . . 0.0 112.283 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 15' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 16' ' ' HIS . 14.5 ttm-85 -160.54 134.12 6.88 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.007 -1.077 . . . . 0.0 111.255 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 16' ' ' HIS . . . . . 0.419 ' C ' ' O ' ' S' ' 15' ' ' ARG . 1.1 t60 33.75 66.57 0.24 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.654 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 17' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -117.56 -85.09 0.64 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.042 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' S' ' 21' ' ' ARG . 47.4 mt-10 -75.13 -21.4 58.87 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 122.852 1.311 . . . . 0.0 107.639 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.281 32.0 t-105 -42.19 -43.94 3.55 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 112.803 -1.999 . . . . 0.0 108.294 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.43 -44.98 92.81 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 112.213 -2.267 . . . . 0.0 109.6 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' S' ' 23' ' ' VAL . 3.1 mmm180 -49.96 -69.11 0.12 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 118.393 -1.323 . . . . 0.0 109.925 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.488 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.48 -36.2 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.82 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.496 ' N ' ' O ' ' S' ' 21' ' ' ARG . 31.3 t -78.99 -64.99 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.852 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.412 ' C ' ' O ' ' S' ' 23' ' ' VAL . 25.2 t0 -34.29 -48.08 0.32 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.665 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.408 ' N ' HD23 ' S' ' 25' ' ' LEU . 3.3 mt -74.69 -49.11 22.48 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.951 -1.1 . . . . 0.0 110.237 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.428 HD12 HD11 ' S' ' 39' ' ' LEU . 4.2 tt -44.83 -28.59 0.66 Allowed 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.248 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -90.11 -68.94 0.75 Allowed 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.913 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 9.8 m-20 -41.38 -29.03 0.13 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.75 -179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 29' ' ' ALA . . . . . 0.464 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -86.11 -31.98 21.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.675 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -43.73 -44.86 6.84 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 119.085 -1.046 . . . . 0.0 110.566 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -32.48 63.11 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.464 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.426 ' OD1' ' NE1' ' R' ' 99' ' ' TRP . 0.8 OUTLIER -79.05 -10.33 59.8 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.937 179.869 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.4 m-20 72.95 9.92 5.39 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.383 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -0.62 57.78 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 118.933 -1.107 . . . . 0.0 109.977 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 35' ' ' HIS . . . . . 0.459 ' O ' HD13 ' S' ' 39' ' ' LEU . 3.8 p-80 -57.23 -23.96 51.48 Favored 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.755 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.463 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.6 mt -70.44 -63.51 1.67 Allowed Pre-proline 0 C--N 1.306 -1.297 0 C-N-CA 118.534 -1.266 . . . . 0.0 110.608 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -51.3 -31.29 36.85 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 120.951 1.101 . . . . 0.0 110.63 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 38' ' ' LEU . . . . . 0.435 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.4 mp -78.44 -36.89 44.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.432 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.459 HD13 ' O ' ' S' ' 35' ' ' HIS . 0.3 OUTLIER -62.25 -20.92 64.74 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.241 179.842 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -2.94 49.68 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.224 -0.991 . . . . 0.0 109.591 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 41' ' ' LEU . . . . . 0.509 ' C ' ' H ' ' S' ' 43' ' ' LEU . 7.4 mp -106.78 -70.94 0.77 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.854 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 42' ' ' MET . . . . . 0.435 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.0 OUTLIER -78.87 43.68 0.51 Allowed 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.832 -1.147 . . . . 0.0 108.843 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 43' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' S' ' 41' ' ' LEU . 0.1 OUTLIER 177.38 124.01 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 105.334 -2.098 . . . . 0.0 105.334 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.581 ' HB ' ' CD ' ' S' ' 45' ' ' PRO 0.316 13.7 m -121.29 -96.15 0.0 OUTLIER Pre-proline 0 CA--C 1.587 2.368 0 CA-C-O 115.731 -2.08 . . . . 0.0 113.485 -179.426 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.581 ' CD ' ' HB ' ' S' ' 44' ' ' THR . 57.3 Cg_endo -107.3 -64.78 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.485 0 CA-C-N 125.235 2.905 . . . . 0.0 111.766 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 46' ' ' ASP . . . . . 0.511 ' H ' ' CG ' ' S' ' 45' ' ' PRO . 0.1 OUTLIER -50.7 -27.66 7.49 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.037 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 47' ' ' GLU . . . . . 0.662 ' O ' HD13 ' S' ' 51' ' ' LEU . 21.0 mp0 -66.79 -45.83 77.21 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.41 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -71.19 -37.32 72.13 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.202 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.12 -68.94 0.22 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.573 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -46.6 -38.62 9.83 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.266 -0.973 . . . . 0.0 110.518 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 51' ' ' LEU . . . . . 0.662 HD13 ' O ' ' S' ' 47' ' ' GLU . 1.7 mp -53.54 -51.56 62.49 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.433 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -46.27 93.82 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 118.842 -1.647 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -44.89 -79.82 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.544 0.688 . . . . 0.0 111.113 179.893 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.678 ' HE ' ' N ' ' S' ' 55' ' ' VAL . 0.1 OUTLIER -44.8 -47.18 10.94 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 115.133 -0.939 . . . . 0.0 112.182 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 55' ' ' VAL . . . . . 0.678 ' N ' ' HE ' ' S' ' 54' ' ' ARG . 54.7 t -56.5 -28.87 27.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 C-N-CA 117.76 -1.576 . . . . 0.0 109.281 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' S' ' 53' ' ' THR . 36.1 mtp85 -84.51 -36.48 22.18 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.805 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 1.018 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -70.57 -32.28 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 C-N-CA 116.032 -2.267 . . . . 0.0 106.695 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 58' ' ' VAL . . . . . 1.018 ' N ' HD13 ' S' ' 57' ' ' ILE . 7.1 t -59.95 -63.36 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 118.982 -1.087 . . . . 0.0 108.521 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 59' ' ' GLU . . . . . 0.471 ' OE2' ' CZ ' ' R' ' 21' ' ' ARG . 23.1 mt-10 -49.07 -29.56 5.26 Favored 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.294 -0.963 . . . . 0.0 110.215 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -34.68 44.36 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.472 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 61' ' ' LEU . . . . . 0.516 ' C ' ' H ' ' S' ' 63' ' ' ARG . 17.3 mt -57.4 -33.31 67.72 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.221 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 62' ' ' LEU . . . . . 0.796 ' O ' ' N ' ' S' ' 64' ' ' GLY . 49.3 tp -60.95 -7.92 2.8 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 119.289 -0.964 . . . . 0.0 108.468 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 63' ' ' ARG . . . . . 0.516 ' H ' ' C ' ' S' ' 61' ' ' LEU . 4.0 ptt180 4.59 32.49 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.413 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.796 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -49.0 -19.93 1.68 Allowed Glycine 0 N--CA 1.487 2.038 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 65' ' ' GLU . . . . . 0.455 ' N ' ' C ' ' S' ' 63' ' ' ARG . 39.8 mt-10 -108.28 -66.69 1.02 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.458 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 66' ' ' MET . . . . . 0.46 ' O ' ' CB ' ' S' ' 67' ' ' SER . 1.7 tpt -169.96 164.4 9.55 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.602 -0.839 . . . . 0.0 110.734 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 67' ' ' SER . . . . . 0.559 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.4 OUTLIER 166.42 -65.49 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.522 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.548 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.7 OUTLIER -26.46 -36.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 124.222 0.951 . . . . 0.0 112.908 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 69' ' ' ARG . . . . . 0.559 ' N ' ' O ' ' S' ' 67' ' ' SER . 2.8 tpt180 -69.98 27.67 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.957 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.548 ' H ' ' C ' ' S' ' 68' ' ' GLN . 4.2 tt0 -107.41 -63.94 1.25 Allowed 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.866 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 tp 61.48 155.09 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.5 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 72' ' ' LYS . . . . . 0.463 ' O ' ' CG ' ' S' ' 72' ' ' LYS . 6.7 ptmm? -58.1 123.51 16.18 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.206 -0.997 . . . . 0.0 111.033 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 73' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' S' ' 74' ' ' GLU . 38.0 t-20 -125.62 -99.71 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.896 0.855 . . . . 0.0 110.885 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 74' ' ' GLU . . . . . 0.455 ' N ' ' OD1' ' S' ' 73' ' ' ASN . 0.0 OUTLIER -140.04 -23.35 0.84 Allowed 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.008 -1.451 . . . . 0.0 110.98 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 tp -111.12 -14.51 13.87 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.317 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -53.91 -80.73 0.07 OUTLIER Glycine 0 N--CA 1.49 2.269 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.47 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -178.35 -91.31 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.386 -0.925 . . . . 0.0 111.003 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 78' ' ' GLY . . . . . 0.481 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -167.94 136.11 3.95 Favored Glycine 0 N--CA 1.491 2.316 0 C-N-CA 119.196 -1.478 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.903 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.43 -28.35 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.434 -0.383 . . . . 0.0 111.289 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -67.46 -65.82 0.64 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.701 -0.8 . . . . 0.0 112.588 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.487 HG22 HG23 ' S' ' 82' ' ' ILE . 0.6 OUTLIER -48.13 -27.56 2.42 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 82' ' ' ILE . . . . . 0.487 HG23 HG22 ' S' ' 81' ' ' THR . 15.7 pt -92.48 -21.61 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 C-N-CA 118.701 -1.199 . . . . 0.0 112.706 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.418 ' O ' ' OD1' ' S' ' 87' ' ' ASN . 0.0 OUTLIER -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.479 -1.288 . . . . 0.0 110.584 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 84' ' ' ARG . . . . . 0.772 ' H ' ' HE ' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -76.34 -28.46 56.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.64 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.66 -4.5 4.15 Favored Glycine 0 N--CA 1.485 1.922 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 86' ' ' SER . . . . . 0.469 ' H ' ' C ' ' S' ' 84' ' ' ARG . 0.4 OUTLIER -138.38 -63.33 0.55 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.759 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 87' ' ' ASN . . . . . 0.521 ' O ' ' N ' ' S' ' 89' ' ' LEU . 32.5 m120 -48.04 -16.66 0.09 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.345 -0.942 . . . . 0.0 110.756 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 88' ' ' SER . . . . . 0.543 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -41.07 -21.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.991 -0.684 . . . . 0.0 111.372 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 89' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' S' ' 87' ' ' ASN . 5.4 mt -39.56 -21.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.713 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 90' ' ' LYS . . . . . 0.543 ' N ' ' O ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -75.36 -61.76 1.79 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.812 -1.155 . . . . 0.0 110.51 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -46.69 -62.1 1.53 Allowed 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.689 -1.142 . . . . 0.0 110.752 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 46.03 68.18 3.63 Favored Pre-proline 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.266 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 93' ' ' PRO . . . . . 0.4 ' HB2' HD12 ' S' ' 96' ' ' LEU . 1.9 Cg_endo -66.01 107.16 1.08 Allowed 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 121.532 1.488 . . . . 0.0 111.267 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 94' ' ' VAL . . . . . 0.4 ' C ' ' N ' ' S' ' 96' ' ' LEU . 57.4 t -77.45 -35.76 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -54.84 -10.22 0.44 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.904 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 96' ' ' LEU . . . . . 0.498 ' HB3' HD23 ' S' ' 100' ' ' LEU . 79.3 mt -103.46 -21.9 13.72 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.205 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.06 -29.04 27.76 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.254 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -94.74 -16.68 22.85 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.674 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 10.6 t90 -91.41 -58.87 2.3 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.827 -0.749 . . . . 0.0 111.143 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.536 HD12 HD13 ' S' ' 104' ' ' LEU . 1.8 mm? -38.41 -34.07 0.12 Allowed 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.467 ' C ' ' O ' ' S' ' 100' ' ' LEU . 31.2 mt-10 -45.43 -38.66 6.26 Favored 'General case' 0 C--N 1.297 -1.713 0 C-N-CA 117.661 -1.616 . . . . 0.0 107.177 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -86.29 -29.43 23.06 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.506 -1.679 . . . . 0.0 112.579 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.674 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 4.0 t -83.31 -18.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 116.787 -1.965 . . . . 0.0 111.862 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 104' ' ' LEU . . . . . 0.536 HD13 HD12 ' S' ' 100' ' ' LEU . 1.4 tp -101.09 -61.67 1.34 Allowed 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.314 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 34.9 mt -57.58 -74.57 0.05 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.111 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 40.5 tttt -42.0 -50.66 4.59 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.904 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 43.6 t . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 116.375 -1.774 . . . . 0.0 110.704 179.968 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.567 ' HE1' ' CB ' ' R' ' 81' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 116.306 -1.807 . . . . 0.0 110.47 . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.572 ' N ' ' O ' ' R' ' 40' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 116.362 -1.78 . . . . 0.0 110.25 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.878 0.371 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' R' R ' 5' ' ' SER . . . . . 0.556 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.0 OUTLIER -87.44 -43.99 0.51 Allowed Pre-proline 0 C--N 1.305 -1.339 0 C-N-CA 119.288 -0.965 . . . . 0.0 112.021 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 6' ' ' PRO . . . . . 0.556 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.9 Cg_endo -72.59 151.4 52.59 Favored 'Trans proline' 0 C--N 1.321 -0.904 0 C-N-CA 121.238 1.292 . . . . 0.0 111.189 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -79.3 104.69 10.09 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.251 -0.979 . . . . 0.0 110.711 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 36.3 t -159.05 -45.02 0.06 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 119.361 -0.935 . . . . 0.0 111.011 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -163.54 140.05 6.96 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.09 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -158.39 -36.06 0.07 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.62 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -148.55 -11.92 0.34 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.562 -0.855 . . . . 0.0 110.677 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -170.47 153.42 4.27 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.799 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -79.42 115.06 18.83 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.36 -0.936 . . . . 0.0 110.737 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -75.7 121.79 23.04 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.83 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 -85.83 76.1 9.94 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.06 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 16' ' ' HIS . . . . . 0.411 ' H ' ' H ' ' R' ' 17' ' ' GLN . 0.4 OUTLIER -159.08 -15.89 0.06 Allowed 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.565 179.973 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.411 ' H ' ' H ' ' R' ' 16' ' ' HIS . 9.7 tt0 -86.23 -85.7 0.15 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.879 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 18' ' ' GLU . . . . . 0.407 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.4 OUTLIER -45.27 -34.32 2.82 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.628 1.204 . . . . 0.0 108.122 179.762 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CH2' ' CD ' ' S' ' 47' ' ' GLU . 22.7 t-105 -55.04 -55.13 34.36 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.151 -1.84 . . . . 0.0 108.59 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 20' ' ' LEU . . . . . 0.733 HD13 ' C ' ' R' ' 20' ' ' LEU . 2.4 tm? -57.25 -38.68 74.21 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.432 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.512 ' O ' ' C ' ' R' ' 22' ' ' PHE . 17.7 mmt180 -50.42 -73.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.416 -1.314 . . . . 0.0 110.553 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.512 ' C ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t80 -31.02 -41.91 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.087 -1.045 . . . . 0.0 111.842 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' R' ' 21' ' ' ARG . 10.9 t -69.76 -57.91 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.403 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.477 ' OD2' HD23 ' R' ' 25' ' ' LEU . 1.4 t70 -39.71 -60.21 1.02 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.633 -0.827 . . . . 0.0 111.522 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.687 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -52.72 -53.01 53.68 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.234 -1.386 . . . . 0.0 109.585 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 26' ' ' LEU . . . . . 0.436 ' C ' HD23 ' R' ' 26' ' ' LEU . 1.2 tt -39.83 -64.43 0.49 Allowed 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.351 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 27' ' ' LYS . . . . . 0.575 ' NZ ' ' CD1' ' S' ' 30' ' ' TYR . 0.4 OUTLIER -53.44 -76.11 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.868 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -34.85 -49.33 0.43 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.436 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -63.48 -55.35 24.78 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.409 -0.916 . . . . 0.0 113.078 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 30' ' ' TYR . . . . . 0.465 ' CE2' HG11 ' S' ' 23' ' ' VAL . 4.9 t80 -40.7 -37.62 0.77 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.774 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -47.37 -43.8 23.55 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.792 -1.163 . . . . 0.0 109.951 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -95.62 -78.25 0.46 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.9 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 169.81 24.71 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.965 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 34' ' ' LEU . . . . . 0.574 ' N ' ' CD2' ' R' ' 34' ' ' LEU . 1.0 OUTLIER -95.85 -9.66 30.92 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.074 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 35' ' ' HIS . . . . . 0.491 ' O ' HD22 ' R' ' 39' ' ' LEU . 11.1 p-80 -54.02 -30.85 49.27 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.476 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.476 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 9.0 mt -68.28 -58.69 7.08 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 117.878 -1.529 . . . . 0.0 110.318 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.6 Cg_exo -55.18 -43.28 60.54 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 120.563 0.842 . . . . 0.0 110.685 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 38' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' R' ' 38' ' ' LEU . 0.6 OUTLIER -61.49 -43.45 98.84 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.651 0.739 . . . . 0.0 110.387 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.527 HD23 ' HZ2' ' S' ' 19' ' ' TRP . 0.1 OUTLIER -52.3 -48.43 65.37 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.141 179.787 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.57 -5.85 0.25 Allowed 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.656 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 7.9 mp -102.58 -60.18 1.58 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.726 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.14 50.98 1.19 Allowed 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 118.715 -1.194 . . . . 0.0 109.399 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 43' ' ' LEU . . . . . 0.422 ' C ' HD23 ' R' ' 43' ' ' LEU . 0.2 OUTLIER 173.22 144.89 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.561 -1.199 . . . . 0.0 108.057 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -169.21 -43.42 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 115.396 -2.522 . . . . 0.0 117.051 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 45' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -104.2 -98.19 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 115.338 1.246 . . . . 0.0 115.338 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.84 -26.19 2.28 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.833 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.787 ' O ' HD13 ' R' ' 51' ' ' LEU . 6.6 mm-40 -51.8 -66.18 0.43 Allowed 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.858 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mmm-85 -58.19 -38.45 76.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.79 -0.764 . . . . 0.0 112.009 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -71.6 -67.18 0.54 Allowed 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.928 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.606 ' HB1' ' NH1' ' R' ' 54' ' ' ARG . . . -47.9 -30.28 4.03 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.994 -0.683 . . . . 0.0 112.731 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 51' ' ' LEU . . . . . 0.787 HD13 ' O ' ' R' ' 47' ' ' GLU . 4.6 mp -63.88 -67.43 0.43 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 119.237 -0.985 . . . . 0.0 111.65 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.74 -29.55 4.3 Favored Glycine 0 N--CA 1.487 2.089 0 C-N-CA 118.982 -1.58 . . . . 0.0 110.233 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.462 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -65.1 -81.69 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.803 -179.986 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.606 ' NH1' ' HB1' ' R' ' 50' ' ' ALA . 10.7 ptp180 -43.31 -43.9 5.21 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.733 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.2 t -62.8 -30.43 49.42 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 C-N-CA 118.341 -1.344 . . . . 0.0 110.296 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' R' ' 53' ' ' THR . 21.1 mtp85 -79.53 -39.62 31.52 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.08 -1.048 . . . . 0.0 111.357 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 1.03 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.47 -32.77 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 117.008 -1.877 . . . . 0.0 108.289 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 1.03 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.7 t -59.23 -61.21 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 118.75 -1.18 . . . . 0.0 108.484 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.437 ' N ' HG12 ' R' ' 58' ' ' VAL . 28.5 mt-10 -52.12 -30.93 28.61 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.962 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.18 -33.08 75.15 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.416 -0.913 . . . . 0.0 111.471 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 61' ' ' LEU . . . . . 0.654 HD12 ' C ' ' R' ' 61' ' ' LEU . 0.4 OUTLIER -75.1 -28.93 60.47 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.731 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.67 -18.27 58.9 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.677 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 63' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' R' ' 65' ' ' GLU . 10.0 ttt180 -117.92 25.97 9.99 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.113 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 64' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' R' ' 65' ' ' GLU . . . -40.6 -20.91 0.03 OUTLIER Glycine 0 N--CA 1.493 2.443 0 C-N-CA 120.067 -1.063 . . . . 0.0 111.115 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.535 ' N ' ' O ' ' R' ' 63' ' ' ARG . 4.8 mt-10 -42.09 -30.36 0.28 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.508 -0.877 . . . . 0.0 110.715 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 19.6 mtp -142.29 80.9 1.72 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.696 -0.802 . . . . 0.0 110.582 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 172.72 82.2 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.789 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 68' ' ' GLN . . . . . 0.511 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.4 OUTLIER -121.82 -38.51 2.73 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.509 179.997 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -75.29 26.89 0.1 Allowed 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 120.209 -0.596 . . . . 0.0 110.943 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 70' ' ' GLU . . . . . 0.511 ' H ' ' C ' ' R' ' 68' ' ' GLN . 7.7 pt-20 -83.55 25.79 0.73 Allowed 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.02 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -43.14 161.0 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.276 -0.969 . . . . 0.0 110.633 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 4.6 pttp -69.18 130.11 41.74 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.399 -0.92 . . . . 0.0 111.699 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 73' ' ' ASN . . . . . 0.562 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.2 OUTLIER -90.25 17.85 6.67 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 122.1 0.952 . . . . 0.0 109.337 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 38.91 17.37 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.997 -1.91 . . . . 0.0 112.256 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.562 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.3 tp -126.98 -14.1 5.61 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.595 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -100.41 -65.79 0.81 Allowed Glycine 0 N--CA 1.492 2.392 0 C-N-CA 119.764 -1.208 . . . . 0.0 110.959 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.53 -103.91 0.26 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.869 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 78' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 172.73 158.54 17.27 Favored Glycine 0 N--CA 1.492 2.407 0 C-N-CA 118.994 -1.574 . . . . 0.0 111.069 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.907 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -36.59 -27.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 CA-C-N 115.345 -0.428 . . . . 0.0 111.753 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.518 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -65.35 -78.39 0.05 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.401 -0.92 . . . . 0.0 112.683 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 81' ' ' THR . . . . . 0.444 HG22 HG23 ' R' ' 82' ' ' ILE . 0.5 OUTLIER -37.47 -31.31 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -179.724 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 82' ' ' ILE . . . . . 0.489 HD11 ' HA ' ' R' ' 79' ' ' ILE . 22.1 pt -87.06 -28.91 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 C-N-CA 118.418 -1.313 . . . . 0.0 112.85 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.464 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -54.63 -63.69 1.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 118.343 -1.343 . . . . 0.0 110.605 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.77 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -62.58 -24.86 67.77 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 119.323 -0.951 . . . . 0.0 110.312 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.05 4.3 3.43 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.331 -1.414 . . . . 0.0 109.76 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 86' ' ' SER . . . . . 0.486 ' H ' ' C ' ' R' ' 84' ' ' ARG . 33.9 t -138.77 -43.54 0.48 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.618 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -92.96 10.33 31.75 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -42.21 -40.15 2.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.297 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.13 -74.85 0.06 Allowed 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.664 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 90' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' R' ' 91' ' ' ALA . 10.9 tptm -41.1 -50.07 3.43 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.525 0.678 . . . . 0.0 111.761 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 91' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.64 -62.32 0.36 Allowed 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 113.911 -1.495 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.688 ' HB3' ' HD3' ' R' ' 93' ' ' PRO . . . -174.34 -54.21 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 118.514 -1.274 . . . . 0.0 113.241 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 93' ' ' PRO . . . . . 0.688 ' HD3' ' HB3' ' R' ' 92' ' ' ALA . 5.4 Cg_exo -57.25 89.38 0.05 OUTLIER 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 120.196 0.597 . . . . 0.0 111.0 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 94' ' ' VAL . . . . . 0.595 HG23 ' O ' ' R' ' 92' ' ' ALA . 61.8 t -110.65 -45.59 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.442 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -67.73 -18.1 64.78 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.291 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.15 -43.45 61.24 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.943 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -35.57 59.62 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.296 -0.961 . . . . 0.0 110.707 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -52.47 -23.18 5.71 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.503 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.655 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.8 t90 -106.29 -62.19 1.42 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.179 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.471 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -40.74 -30.85 0.13 Allowed 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.104 -1.038 . . . . 0.0 113.704 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.503 ' O ' HD22 ' R' ' 105' ' ' LEU . 11.0 pt-20 -46.46 -36.32 6.5 Favored 'General case' 0 C--N 1.297 -1.712 0 C-N-CA 117.529 -1.669 . . . . 0.0 107.121 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.476 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 3.6 mt-10 -91.37 -28.45 17.69 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-N 113.235 -1.802 . . . . 0.0 112.282 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.655 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.1 t -93.15 -1.34 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 117.601 -1.64 . . . . 0.0 110.67 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 104' ' ' LEU . . . . . 0.467 ' N ' ' O ' ' R' ' 100' ' ' LEU . 26.4 tp -105.6 -51.55 2.98 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.757 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 105' ' ' LEU . . . . . 0.85 HD23 ' N ' ' R' ' 106' ' ' LYS . 0.1 OUTLIER -72.79 -10.15 59.47 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 119.285 -0.966 . . . . 0.0 111.18 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 106' ' ' LYS . . . . . 0.85 ' N ' HD23 ' R' ' 105' ' ' LEU . 0.0 OUTLIER -53.27 -19.74 3.51 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.015 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' R' R ' 107' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' R' ' 106' ' ' LYS . 91.8 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 116.379 -1.772 . . . . 0.0 111.027 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.916 0.389 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 38.7 t -171.45 67.61 0.45 Allowed Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.146 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -66.23 164.65 27.18 Favored 'Trans proline' 0 C--N 1.314 -1.282 0 C-N-CA 121.612 1.542 . . . . 0.0 111.343 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -166.82 -8.4 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.689 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 9.8 t -83.35 84.68 7.42 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.711 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.2 173.18 5.9 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.909 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.91 121.48 9.39 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.834 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 8.5 mmt -92.31 -17.66 24.43 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.1 130.88 37.72 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.929 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -88.17 -177.49 5.72 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.49 -0.884 . . . . 0.0 110.759 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -161.17 75.14 0.5 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.298 -0.961 . . . . 0.0 111.112 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 15' ' ' ARG . . . . . 0.405 ' H ' ' H ' ' S' ' 16' ' ' HIS . 11.3 ptt180 -164.98 -1.37 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.589 -0.844 . . . . 0.0 110.442 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 16' ' ' HIS . . . . . 0.405 ' H ' ' H ' ' S' ' 15' ' ' ARG . 0.0 OUTLIER -146.82 -20.21 0.41 Allowed 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.043 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.453 ' C ' ' N ' ' S' ' 19' ' ' TRP . 0.9 OUTLIER -92.51 -82.99 0.31 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.389 179.808 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -45.4 -29.32 1.05 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.822 1.296 . . . . 0.0 108.194 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 19' ' ' TRP . . . . . 0.527 ' HZ2' HD23 ' R' ' 39' ' ' LEU . 24.4 t-105 -58.62 -59.87 4.72 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 112.862 -1.972 . . . . 0.0 109.911 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 20' ' ' LEU . . . . . 0.848 HD12 ' O ' ' S' ' 20' ' ' LEU . 0.3 OUTLIER -58.99 -19.03 39.7 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.968 -1.469 . . . . 0.0 111.081 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' S' ' 22' ' ' PHE . 12.1 mmt180 -67.82 -65.14 0.73 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.003 -1.479 . . . . 0.0 108.974 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.438 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.6 t80 -39.5 -41.69 1.03 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.303 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.465 HG11 ' CE2' ' R' ' 30' ' ' TYR . 85.5 t -71.09 -48.36 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.794 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 24' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -40.28 -64.44 0.51 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.492 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.52 HD23 ' N ' ' S' ' 25' ' ' LEU . 1.9 mt -53.02 -53.4 50.64 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 118.73 -1.188 . . . . 0.0 109.184 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.68 -1.08 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.297 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 27' ' ' LYS . . . . . 0.468 ' H ' ' C ' ' S' ' 25' ' ' LEU . 25.0 tttm -88.05 -68.48 0.76 Allowed 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.389 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.88 -3.2 50.46 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.363 -0.935 . . . . 0.0 112.139 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 29' ' ' ALA . . . . . 0.466 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -74.32 -53.27 10.01 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.919 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 30' ' ' TYR . . . . . 0.575 ' CD1' ' NZ ' ' R' ' 27' ' ' LYS . 14.6 t80 -41.65 -42.14 2.42 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.25 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -45.58 -42.3 10.96 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.57 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.414 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 0.0 OUTLIER -97.37 -77.65 0.49 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.177 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' S' ' 32' ' ' ASN . 0.5 OUTLIER 169.66 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 34' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 0.8 OUTLIER -92.82 -15.35 26.61 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.062 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -51.15 -20.75 1.63 Allowed 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.186 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.466 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.0 mt -80.21 -65.03 0.29 Allowed Pre-proline 0 C--N 1.306 -1.302 0 C-N-CA 118.335 -1.346 . . . . 0.0 110.647 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.526 ' O ' ' ND2' ' S' ' 40' ' ' ASN . 2.6 Cg_endo -51.88 -21.32 11.64 Favored 'Trans proline' 0 C--N 1.32 -0.938 0 N-CA-C 109.775 -0.894 . . . . 0.0 109.775 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 49.1 mt -79.87 -38.7 32.13 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.609 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.3 OUTLIER -59.7 -24.75 64.23 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.758 179.696 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 40' ' ' ASN . . . . . 0.526 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.0 OUTLIER -97.06 10.37 39.49 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.744 179.747 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tp -108.47 -67.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -99.33 36.79 1.67 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 119.019 -1.073 . . . . 0.0 112.143 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 43' ' ' LEU . . . . . 0.612 HD21 ' HG3' ' S' ' 47' ' ' GLU . 24.1 tp 172.74 146.04 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.52 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.7 OUTLIER 177.98 -46.94 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 117.169 -1.812 . . . . 0.0 114.921 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.52 ' HD2' ' H ' ' S' ' 44' ' ' THR . 6.0 Cg_endo -68.42 -83.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 120.361 0.707 . . . . 0.0 111.584 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 46' ' ' ASP . . . . . 0.701 ' O ' ' HB3' ' S' ' 50' ' ' ALA . 3.0 p-10 -49.73 -14.42 0.13 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 119.005 -1.078 . . . . 0.0 109.715 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 47' ' ' GLU . . . . . 0.612 ' HG3' HD21 ' S' ' 43' ' ' LEU . 10.5 tt0 -71.77 -74.94 0.14 Allowed 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.281 -0.967 . . . . 0.0 111.284 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.77 -25.03 0.15 Allowed 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 119.592 -0.843 . . . . 0.0 110.945 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' O ' ' S' ' 47' ' ' GLU . 4.2 mm-40 -100.51 -65.03 0.99 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.978 -1.089 . . . . 0.0 112.786 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 50' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' S' ' 46' ' ' ASP . . . -61.82 -42.19 98.71 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.075 -1.05 . . . . 0.0 112.985 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 51' ' ' LEU . . . . . 0.487 HD12 HH21 ' S' ' 54' ' ' ARG . 1.8 tp -54.45 -49.73 69.36 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.761 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.82 -35.76 83.9 Favored Glycine 0 N--CA 1.492 2.373 0 C-N-CA 118.797 -1.668 . . . . 0.0 109.744 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.467 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -64.83 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 115.006 -0.597 . . . . 0.0 112.563 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.501 ' O ' HG23 ' S' ' 58' ' ' VAL . 4.5 ptt180 -42.41 -29.4 0.27 Allowed 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.834 -0.746 . . . . 0.0 112.393 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 55' ' ' VAL . . . . . 0.407 HG23 ' O ' ' S' ' 51' ' ' LEU . 71.7 t -76.47 -31.78 20.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 117.817 -1.553 . . . . 0.0 109.407 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' S' ' 53' ' ' THR . 10.8 mtp180 -63.6 -46.7 84.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 118.894 -1.123 . . . . 0.0 109.825 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 0.42 ' N ' HD13 ' S' ' 57' ' ' ILE . 0.0 OUTLIER -71.68 -57.33 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 C-N-CA 118.024 -1.47 . . . . 0.0 110.219 179.918 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 58' ' ' VAL . . . . . 0.501 HG23 ' O ' ' S' ' 54' ' ' ARG . 84.8 t -47.26 -64.58 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 C-N-CA 118.288 -1.365 . . . . 0.0 111.459 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.63 -28.72 22.6 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.48 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -80.94 -47.24 13.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 118.474 -1.29 . . . . 0.0 112.789 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 61' ' ' LEU . . . . . 0.454 HD22 ' O ' ' S' ' 85' ' ' GLY . 2.1 pp -70.09 -5.23 25.42 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 117.859 -1.536 . . . . 0.0 110.613 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 62' ' ' LEU . . . . . 0.423 ' HA ' HD22 ' S' ' 62' ' ' LEU . 0.2 OUTLIER -71.06 -61.97 1.57 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.429 179.748 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -118.61 -22.62 7.41 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.508 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.605 ' O ' ' N ' ' S' ' 66' ' ' MET . . . -91.25 28.42 8.13 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 65' ' ' GLU . . . . . 0.446 ' C ' ' O ' ' S' ' 64' ' ' GLY . 2.2 mt-10 -24.58 -35.84 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 O-C-N 124.62 0.835 . . . . 0.0 112.187 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 66' ' ' MET . . . . . 0.605 ' N ' ' O ' ' S' ' 64' ' ' GLY . 13.5 mmt -56.72 147.15 23.6 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.771 179.778 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -173.31 83.14 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 118.263 -1.375 . . . . 0.0 110.949 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 68' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -125.76 -32.42 2.84 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.649 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.61 18.83 3.7 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.663 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.433 ' O ' ' C ' ' S' ' 71' ' ' LEU . 2.8 mm-40 -125.91 -74.0 0.61 Allowed 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.15 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 71' ' ' LEU . . . . . 0.433 ' C ' ' O ' ' S' ' 70' ' ' GLU . 2.9 tp 38.79 -149.73 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.439 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.33 149.87 24.97 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.495 -0.882 . . . . 0.0 109.304 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 73' ' ' ASN . . . . . 0.484 ' CG ' ' N ' ' S' ' 74' ' ' GLU . 17.6 t30 -97.25 -95.7 0.21 Allowed 'General case' 0 C--N 1.297 -1.701 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.551 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 74' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' S' ' 73' ' ' ASN . 18.2 mt-10 -163.31 -43.1 0.03 OUTLIER 'General case' 0 C--N 1.278 -2.538 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.36 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 75' ' ' LEU . . . . . 0.458 HD13 ' HA ' ' S' ' 75' ' ' LEU . 0.1 OUTLIER -114.72 -30.74 6.38 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.56 -1.655 . . . . 0.0 111.181 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -36.79 -73.59 0.12 Allowed Glycine 0 N--CA 1.497 2.745 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.208 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 77' ' ' ALA . . . . . 0.542 ' O ' ' O ' ' S' ' 78' ' ' GLY . . . -166.69 64.8 0.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.075 -1.05 . . . . 0.0 111.429 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 78' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' S' ' 77' ' ' ALA . . . 29.96 -162.89 0.0 OUTLIER Glycine 0 N--CA 1.5 2.928 0 CA-C-N 114.933 -1.031 . . . . 0.0 112.628 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.709 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.2 OUTLIER -110.63 -18.92 7.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-N 114.679 -0.761 . . . . 0.0 111.96 179.873 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.28 86.27 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.338 -1.345 . . . . 0.0 111.135 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.816 HG23 ' NE1' ' R' ' 109' ' ' TRP . 47.1 m -46.68 -61.94 1.61 Allowed 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 8.0 pt -64.75 -2.58 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.27 -41.62 8.57 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.398 -1.321 . . . . 0.0 113.511 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -62.95 -12.98 29.2 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 85' ' ' GLY . . . . . 0.454 ' O ' HD22 ' S' ' 61' ' ' LEU . . . -99.75 25.52 27.94 Favored Glycine 0 N--CA 1.5 2.921 0 C-N-CA 119.148 -1.501 . . . . 0.0 111.023 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -119.44 -31.34 4.64 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.432 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 87' ' ' ASN . . . . . 0.433 ' ND2' ' N ' ' S' ' 87' ' ' ASN . 0.0 OUTLIER -100.08 -21.01 15.75 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.689 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.35 -23.59 0.97 Allowed 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.683 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 34.9 mt -63.65 -39.01 93.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.361 -0.935 . . . . 0.0 112.113 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.76 -28.32 17.46 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 118.666 -1.214 . . . . 0.0 111.282 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -43.47 -57.77 2.93 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 114.972 -1.013 . . . . 0.0 112.888 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 92' ' ' ALA . . . . . 0.672 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . -158.8 -58.79 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.766 0 C-N-CA 118.556 -1.258 . . . . 0.0 114.014 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 93' ' ' PRO . . . . . 0.672 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 6.5 Cg_exo -45.98 89.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.325 -0.684 0 C-N-CA 120.607 0.871 . . . . 0.0 112.224 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 94' ' ' VAL . . . . . 0.519 ' N ' ' O ' ' S' ' 92' ' ' ALA . 2.4 t -111.2 -28.83 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.479 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.19 -25.31 68.28 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.91 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 96' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' S' ' 97' ' ' ARG . 8.7 mp -45.91 -48.78 16.12 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.746 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 97' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' S' ' 96' ' ' LEU . 0.3 OUTLIER -42.64 -47.14 5.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.57 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -61.28 -46.11 91.71 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.915 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.654 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 9.6 t90 -74.42 -62.04 1.66 Allowed 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.925 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.473 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -34.64 -39.67 0.09 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' S' ' 100' ' ' LEU . 2.0 mm-40 -42.27 -42.87 3.23 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.048 -1.461 . . . . 0.0 107.135 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -82.86 -27.06 31.03 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.894 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.654 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 8.0 t -83.4 -39.14 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 C-N-CA 116.66 -2.016 . . . . 0.0 112.962 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.55 -50.17 7.03 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 118.743 -1.183 . . . . 0.0 111.35 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 105' ' ' LEU . . . . . 0.58 HD22 ' H ' ' S' ' 105' ' ' LEU . 1.0 OUTLIER -87.15 11.74 13.25 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.913 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' S' S ' 106' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' S' ' 105' ' ' LEU . 21.2 tttm -32.3 -41.87 0.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.598 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.873 -179.977 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.501 ' N ' ' O ' ' S' ' 40' ' ' ASN . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 116.285 -1.817 . . . . 0.0 110.247 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.816 ' NE1' HG23 ' S' ' 81' ' ' THR . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 116.459 -1.734 . . . . 0.0 109.438 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.802 0.334 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.88 165.45 14.58 Favored Pre-proline 0 N--CA 1.489 1.487 0 C-N-CA 119.752 -0.779 . . . . 0.0 110.836 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 6' ' ' PRO . . . . . 0.49 ' O ' ' N ' ' R' ' 8' ' ' SER . 3.0 Cg_exo -54.75 124.56 16.51 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 121.477 1.452 . . . . 0.0 112.453 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 58.27 -76.02 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.788 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 8' ' ' SER . . . . . 0.49 ' N ' ' O ' ' R' ' 6' ' ' PRO . 0.7 OUTLIER -166.7 -59.23 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 118.242 -1.383 . . . . 0.0 112.481 -179.967 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -127.35 111.11 13.51 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.96 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -83.15 -172.98 4.44 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.301 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 32.3 mmm -59.81 -108.27 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.582 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -171.11 -102.65 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.508 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -128.13 -81.22 0.59 Allowed 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.296 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -66.32 165.24 14.41 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.319 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -176.08 -32.73 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 119.196 -1.002 . . . . 0.0 110.825 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 9.75 10.39 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.125 -1.03 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.425 ' C ' ' N ' ' R' ' 19' ' ' TRP . 6.2 tt0 -85.7 -84.36 0.16 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.66 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 18' ' ' GLU . . . . . 0.4 ' H ' ' HB3' ' R' ' 17' ' ' GLN . 0.8 OUTLIER -44.63 -30.84 0.99 Allowed 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 122.897 1.332 . . . . 0.0 109.008 179.791 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 19' ' ' TRP . . . . . 0.425 ' N ' ' C ' ' R' ' 17' ' ' GLN . 54.3 t-105 -55.12 -56.75 16.33 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.804 -1.998 . . . . 0.0 109.059 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.3 tp -51.85 -38.16 54.87 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.898 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' R' ' 22' ' ' PHE . 21.9 mtp180 -56.82 -64.34 0.91 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.781 -1.168 . . . . 0.0 111.195 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.474 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -35.82 -48.12 0.54 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 118.813 -1.155 . . . . 0.0 111.435 179.71 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 23' ' ' VAL . . . . . 0.471 ' O ' ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -76.61 -68.44 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.975 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 9.0 t70 -39.84 -28.49 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.112 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.471 ' N ' ' O ' ' R' ' 23' ' ' VAL . 10.2 tp -77.73 -56.77 4.24 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.347 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 tt -41.09 -59.43 1.49 Allowed 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 27' ' ' LYS . . . . . 0.426 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.1 OUTLIER -54.45 -60.9 2.72 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.287 -0.965 . . . . 0.0 111.088 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -43.21 -24.29 0.08 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.401 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -97.9 -31.89 11.96 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.197 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -50.73 -38.08 45.45 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 118.794 -1.163 . . . . 0.0 110.105 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -27.37 69.09 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.082 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 32' ' ' ASN . . . . . 0.437 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.4 m120 -101.61 -10.15 20.32 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.087 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 33' ' ' ASP . . . . . 0.437 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.5 m-20 75.71 17.32 2.35 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.413 0.625 . . . . 0.0 110.291 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -85.27 -15.33 43.81 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.621 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 35' ' ' HIS . . . . . 0.416 ' O ' HD13 ' R' ' 39' ' ' LEU . 9.5 p-80 -52.24 -13.94 0.39 Allowed 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.797 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 8.2 mt -79.27 -66.01 0.28 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 117.504 -1.679 . . . . 0.0 110.147 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.2 Cg_endo -53.98 -26.97 42.92 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 N-CA-C 109.501 -1.0 . . . . 0.0 109.501 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 1.5 tp -77.48 -35.53 53.6 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.947 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.424 ' HA ' HD12 ' R' ' 39' ' ' LEU . 0.3 OUTLIER -55.68 -33.74 64.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.602 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -74.64 5.18 5.12 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.256 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mt -113.23 -58.08 2.2 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 119.817 -0.753 . . . . 0.0 112.812 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.91 36.29 0.72 Allowed 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 118.381 -1.328 . . . . 0.0 112.876 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 165.24 140.64 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 114.719 -1.128 . . . . 0.0 108.591 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.649 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -33.35 0.0 OUTLIER Pre-proline 0 N--CA 1.496 1.838 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.649 ' CD ' ' H ' ' R' ' 44' ' ' THR . 34.9 Cg_endo -88.99 -103.16 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.146 0 C-N-CA 121.054 1.169 . . . . 0.0 112.16 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 46' ' ' ASP . . . . . 0.709 ' O ' ' HB3' ' R' ' 50' ' ' ALA . 0.6 OUTLIER -52.21 -13.56 0.34 Allowed 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.411 -179.883 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.475 ' N ' ' C ' ' R' ' 45' ' ' PRO . 7.1 mm-40 -69.79 -61.67 1.69 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.079 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -21.92 13.14 Favored 'General case' 0 C--N 1.299 -1.604 0 C-N-CA 118.94 -1.104 . . . . 0.0 110.39 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -108.08 -71.68 0.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.595 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' R' ' 46' ' ' ASP . . . -48.86 -36.99 18.25 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 51' ' ' LEU . . . . . 0.443 ' HG ' ' N ' ' R' ' 52' ' ' GLY . 0.2 OUTLIER -69.57 -38.67 77.48 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.932 -179.892 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 52' ' ' GLY . . . . . 0.443 ' N ' ' HG ' ' R' ' 51' ' ' LEU . . . -65.99 -28.14 73.42 Favored Glycine 0 N--CA 1.485 1.901 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.552 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -63.61 -79.45 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.54 -0.83 . . . . 0.0 110.594 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.45 ' HA ' HG23 ' R' ' 57' ' ' ILE . 1.2 ptp180 -36.02 -50.5 0.69 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 123.796 0.685 . . . . 0.0 111.286 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.69 -36.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 118.04 -1.464 . . . . 0.0 110.314 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' R' ' 53' ' ' THR . 2.8 mtm180 -75.37 -40.44 58.04 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.533 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 1.045 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -70.34 -38.99 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 116.869 -1.933 . . . . 0.0 109.532 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 1.045 ' N ' HD13 ' R' ' 57' ' ' ILE . 54.3 t -59.82 -59.28 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 117.73 -1.588 . . . . 0.0 109.33 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.59 -24.73 5.78 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.781 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.77 -50.73 16.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.942 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.89 -31.6 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.368 -0.933 . . . . 0.0 112.562 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tp -43.26 -53.57 5.08 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.327 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -125.21 26.59 6.86 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.51 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 64' ' ' GLY . . . . . 0.598 ' O ' ' N ' ' R' ' 66' ' ' MET . . . -116.54 29.31 7.01 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.531 ' C ' ' O ' ' R' ' 64' ' ' GLY . 1.7 mt-10 -18.15 -46.24 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 124.244 0.614 . . . . 0.0 111.935 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 66' ' ' MET . . . . . 0.598 ' N ' ' O ' ' R' ' 64' ' ' GLY . 0.6 OUTLIER -67.91 131.96 46.46 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.149 -1.02 . . . . 0.0 108.608 179.798 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 8.0 t -154.12 70.02 0.8 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 117.672 -1.611 . . . . 0.0 111.654 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 68' ' ' GLN . . . . . 0.436 ' OE1' ' CA ' ' R' ' 68' ' ' GLN . 0.5 OUTLIER -114.64 -44.22 3.09 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.787 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -76.24 27.31 0.12 Allowed 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.641 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.96 -23.73 66.56 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 118.265 -1.374 . . . . 0.0 109.179 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 58.89 109.4 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.35 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 72' ' ' LYS . . . . . 0.537 ' C ' ' H ' ' R' ' 74' ' ' GLU . 15.6 tttm -98.41 66.82 1.76 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.834 -0.746 . . . . 0.0 110.103 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 73' ' ' ASN . . . . . 0.619 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.8 OUTLIER -71.81 16.61 0.11 Allowed 'General case' 0 N--CA 1.491 1.592 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.661 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 74' ' ' GLU . . . . . 0.537 ' H ' ' C ' ' R' ' 72' ' ' LYS . 22.6 mt-10 49.95 -78.58 0.01 OUTLIER 'General case' 0 C--N 1.286 -2.189 0 CA-C-N 114.418 -1.264 . . . . 0.0 111.098 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.619 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.5 mt -56.05 -15.93 4.27 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.417 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 76' ' ' GLY . . . . . 0.402 ' N ' ' C ' ' R' ' 74' ' ' GLU . . . -60.52 -65.17 3.52 Favored Glycine 0 N--CA 1.49 2.246 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.935 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -134.65 -18.63 1.89 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 119.128 -1.029 . . . . 0.0 112.226 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 78' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 87.56 97.34 0.9 Allowed Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.047 -1.549 . . . . 0.0 109.927 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.574 HD12 ' OG1' ' R' ' 83' ' ' THR . 0.1 OUTLIER -20.71 -44.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.969 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.499 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -50.01 -12.83 0.09 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.285 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 81' ' ' THR . . . . . 0.524 ' HA ' ' HE1' ' R' ' 1' ' ' TRP . 17.0 m -88.95 -51.13 5.78 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 82' ' ' ILE . . . . . 0.424 ' H ' HG23 ' R' ' 82' ' ' ILE . 0.8 OUTLIER -80.5 6.83 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.574 ' OG1' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -105.34 -13.55 15.62 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.649 -1.22 . . . . 0.0 112.737 -179.92 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.619 ' NE ' ' CE3' ' R' ' 1' ' ' TRP . 0.2 OUTLIER -96.73 -33.52 11.68 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.408 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.35 -29.34 2.51 Favored Glycine 0 N--CA 1.484 1.89 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.729 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.41 -50.69 4.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 118.629 -1.229 . . . . 0.0 112.219 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 87' ' ' ASN . . . . . 0.539 ' N ' ' OD1' ' R' ' 87' ' ' ASN . 0.7 OUTLIER -68.14 5.83 0.87 Allowed 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.651 -0.82 . . . . 0.0 112.489 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 42.5 m -116.45 -46.9 2.76 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.401 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.2 tt -46.65 -36.4 6.98 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.199 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -66.14 -70.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 122.062 0.935 . . . . 0.0 112.393 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 91' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 92' ' ' ALA . . . -58.86 -82.52 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 113.813 -1.54 . . . . 0.0 112.781 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 91' ' ' ALA . . . 58.1 150.27 0.07 OUTLIER Pre-proline 0 N--CA 1.492 1.634 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.037 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -54.3 152.88 23.99 Favored 'Trans proline' 0 C--O 1.214 -0.701 0 C-N-CA 121.079 1.186 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 33.5 t -74.51 -61.49 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 C-N-CA 119.36 -0.936 . . . . 0.0 112.992 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.46 -16.98 41.85 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.466 -0.893 . . . . 0.0 112.997 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 96' ' ' LEU . . . . . 0.525 HD13 ' C ' ' R' ' 96' ' ' LEU . 3.1 tm? -79.6 -35.72 39.15 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 118.775 -1.17 . . . . 0.0 111.308 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.85 -24.97 55.8 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 118.892 -1.123 . . . . 0.0 109.918 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -65.69 -19.3 65.85 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.053 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.652 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 21.0 t90 -97.16 -55.02 2.98 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.99 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.581 HD13 ' HB ' ' R' ' 103' ' ' VAL . 2.0 mm? -39.59 -28.84 0.05 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.02 -1.072 . . . . 0.0 113.542 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' R' ' 100' ' ' LEU . 10.2 mm-40 -47.1 -39.02 12.41 Favored 'General case' 0 C--N 1.292 -1.93 0 C-N-CA 117.717 -1.593 . . . . 0.0 107.519 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -89.47 -28.55 19.61 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 113.936 -1.483 . . . . 0.0 112.415 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.652 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 10.4 t -78.82 -34.0 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.16 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.0 -48.86 16.78 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.315 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 105' ' ' LEU . . . . . 0.739 HD13 ' C ' ' R' ' 105' ' ' LEU . 2.4 tm? -58.05 -44.04 87.22 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.837 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -41.92 -20.18 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.3 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 107' ' ' SER . . . . . 0.529 ' N ' ' O ' ' R' ' 105' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 116.398 -1.763 . . . . 0.0 110.86 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.917 0.389 . . . . 0.0 109.977 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' S' S ' 5' ' ' SER . . . . . 0.574 ' N ' ' CD ' ' S' ' 6' ' ' PRO . 0.0 OUTLIER -93.42 -43.09 0.32 Allowed Pre-proline 0 C--N 1.305 -1.327 0 C-N-CA 119.562 -0.855 . . . . 0.0 112.311 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 6' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' S' ' 5' ' ' SER . 4.6 Cg_endo -73.21 -52.99 0.14 Allowed 'Trans proline' 0 C--N 1.32 -0.956 0 C-N-CA 121.038 1.159 . . . . 0.0 111.544 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -54.57 -6.13 0.1 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.993 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 8' ' ' SER . . . . . 0.423 ' H ' ' C ' ' S' ' 6' ' ' PRO . 3.5 m -86.4 105.01 16.43 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 118.989 -1.084 . . . . 0.0 110.895 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . 50.78 93.74 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.78 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.44 110.98 1.6 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.03 -1.068 . . . . 0.0 111.265 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -125.71 -6.79 6.82 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.405 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.7 -3.64 51.45 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.424 -0.91 . . . . 0.0 110.48 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.99 151.57 47.4 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.009 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -63.2 146.21 53.86 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.641 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.9 73.67 0.43 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 119.192 -1.003 . . . . 0.0 110.684 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -117.46 12.6 14.23 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.447 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.478 ' C ' ' N ' ' S' ' 19' ' ' TRP . 1.2 mt-30 -89.62 -81.41 0.28 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.115 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 3.1 mp0 -42.12 -30.61 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 122.942 1.353 . . . . 0.0 108.158 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 19' ' ' TRP . . . . . 0.478 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.26 72.2 t-105 -56.44 -56.09 25.5 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.269 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 20' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' S' ' 17' ' ' GLN . 5.9 tp -58.87 -27.34 65.08 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.845 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.457 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.9 mtt85 -66.49 -74.42 0.11 Allowed 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.48 -1.288 . . . . 0.0 109.65 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.457 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -36.34 -42.45 0.32 Allowed 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.172 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.416 ' O ' ' C ' ' S' ' 24' ' ' ASP . 3.0 t -69.79 -56.03 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.7 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' S' ' 23' ' ' VAL . 22.6 t0 -35.94 -73.31 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.725 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.527 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.1 OUTLIER -49.97 -46.16 52.15 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.584 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.709 HD11 ' CD1' ' S' ' 39' ' ' LEU . 2.1 tp -45.18 -30.5 1.19 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.057 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.25 -71.77 0.34 Allowed 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.464 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -50.62 -27.04 6.11 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 29' ' ' ALA . . . . . 0.506 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -78.59 -50.1 12.1 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.94 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 30' ' ' TYR . . . . . 0.443 ' CD1' ' C ' ' S' ' 30' ' ' TYR . 11.2 t80 -44.55 -38.24 4.07 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.247 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -46.38 -37.23 7.29 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.711 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.65 -79.34 0.54 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.788 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 172.73 35.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.953 0.882 . . . . 0.0 109.322 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 34' ' ' LEU . . . . . 0.527 HD23 ' CD2' ' R' ' 99' ' ' TRP . 0.3 OUTLIER -100.95 -19.37 15.9 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.767 -179.942 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -57.08 -17.98 12.58 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.544 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.2 mt -76.84 -63.33 0.54 Allowed Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 118.263 -1.375 . . . . 0.0 110.304 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 5.4 Cg_exo -50.98 -32.0 36.66 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 N-CA-C 109.863 -0.861 . . . . 0.0 109.863 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 mt -67.85 -43.54 79.25 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.709 ' CD1' HD11 ' S' ' 26' ' ' LEU . 0.3 OUTLIER -54.78 -34.06 62.17 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.101 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -83.89 10.69 9.1 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.81 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.38 -63.58 1.39 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.929 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mtt -91.39 33.58 0.99 Allowed 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.709 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 43' ' ' LEU . . . . . 0.458 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.6 OUTLIER 164.91 142.23 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 O-C-N 123.439 0.462 . . . . 0.0 110.021 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.603 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.25 -42.41 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.313 0 C-N-CA 117.196 -1.802 . . . . 0.0 115.238 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.603 ' HD2' ' H ' ' S' ' 44' ' ' THR . 16.0 Cg_endo -76.64 -110.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 121.12 1.213 . . . . 0.0 113.403 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 46' ' ' ASP . . . . . 0.426 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 1.0 OUTLIER -51.28 -16.95 0.6 Allowed 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.49 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 47' ' ' GLU . . . . . 0.401 ' N ' ' C ' ' S' ' 45' ' ' PRO . 5.9 mm-40 -65.76 -66.99 0.48 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.016 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -51.82 -42.2 62.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.113 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.08 -68.9 0.31 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.051 -1.06 . . . . 0.0 112.208 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 50' ' ' ALA . . . . . 0.51 ' HB1' ' N ' ' R' ' 109' ' ' TRP . . . -55.44 -22.57 21.01 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.191 -1.004 . . . . 0.0 111.257 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 51' ' ' LEU . . . . . 0.436 HD11 ' CG ' ' R' ' 22' ' ' PHE . 5.7 tt -67.68 -53.27 29.08 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.87 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.69 -52.1 52.67 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.684 -1.766 . . . . 0.0 108.684 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.551 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.1 OUTLIER -39.83 -74.46 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.982 0.896 . . . . 0.0 111.071 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.57 ' HB2' ' CZ3' ' R' ' 109' ' ' TRP . 0.0 OUTLIER -41.76 -39.03 1.61 Allowed 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 113.868 -1.514 . . . . 0.0 112.638 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 55' ' ' VAL . . . . . 0.569 ' CG2' ' HE ' ' S' ' 54' ' ' ARG . 13.4 t -73.6 -27.68 23.63 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 C-N-CA 117.874 -1.53 . . . . 0.0 108.209 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.1 OUTLIER -80.97 -35.28 32.33 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.91 -1.041 . . . . 0.0 112.306 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 1.009 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -73.08 -35.98 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 116.662 -2.015 . . . . 0.0 106.997 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 58' ' ' VAL . . . . . 1.009 ' N ' HD13 ' S' ' 57' ' ' ILE . 9.9 t -62.25 -63.32 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 C-N-CA 118.68 -1.208 . . . . 0.0 109.536 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -50.57 -32.01 17.41 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.926 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -73.76 -54.17 8.65 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.859 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 15.6 mt -46.68 -26.5 0.93 Allowed 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.934 -1.106 . . . . 0.0 109.903 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.16 -35.62 64.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.841 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 63' ' ' ARG . . . . . 0.485 ' O ' ' N ' ' S' ' 65' ' ' GLU . 7.8 mtt-85 -117.36 25.81 10.19 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.167 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.414 ' O ' ' C ' ' S' ' 65' ' ' GLU . . . -43.84 -18.89 0.09 OUTLIER Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.754 -1.212 . . . . 0.0 111.165 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 65' ' ' GLU . . . . . 0.485 ' N ' ' O ' ' S' ' 63' ' ' ARG . 1.0 OUTLIER -39.79 -42.78 1.33 Allowed 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.767 -0.773 . . . . 0.0 111.277 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 82.3 mmm -57.14 -99.48 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.885 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 4.1 t -178.76 78.97 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.586 -0.846 . . . . 0.0 109.37 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.623 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.0 OUTLIER -112.17 -15.45 13.22 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.922 -179.793 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.08 25.93 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.738 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.623 ' H ' ' C ' ' S' ' 68' ' ' GLN . 49.2 mt-10 -126.29 4.23 7.03 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.698 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mt -79.77 14.39 1.75 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 118.819 -1.152 . . . . 0.0 110.541 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 tttm -69.45 87.84 0.46 Allowed 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 118.289 -1.365 . . . . 0.0 110.561 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 73' ' ' ASN . . . . . 0.533 ' O ' ' N ' ' S' ' 75' ' ' LEU . 1.0 OUTLIER -110.16 21.73 16.4 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.885 0.85 . . . . 0.0 110.088 -179.947 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 58.69 -66.64 0.03 OUTLIER 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 112.901 -1.954 . . . . 0.0 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 75' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' S' ' 73' ' ' ASN . 4.0 mt -75.1 -15.5 60.6 Favored 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.957 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -74.46 -28.54 63.42 Favored Glycine 0 N--CA 1.491 2.317 0 C-N-CA 119.635 -1.269 . . . . 0.0 110.868 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -159.85 -77.65 0.06 Allowed 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.727 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 78' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' S' ' 81' ' ' THR . . . 140.85 109.76 0.8 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.618 -1.793 . . . . 0.0 108.618 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.727 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.0 OUTLIER -29.46 -45.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -179.777 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.42 ' N ' HG13 ' S' ' 79' ' ' ILE . . . -59.54 -46.84 87.7 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.982 -1.087 . . . . 0.0 111.077 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.477 ' HA ' ' HE1' ' R' ' 109' ' ' TRP . 61.0 m -53.57 -45.01 69.78 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 pt -84.74 10.15 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 118.71 -1.196 . . . . 0.0 113.986 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -108.06 -52.71 2.73 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.324 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -63.17 0.38 0.63 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.466 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 85' ' ' GLY . . . . . 0.478 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -70.86 -9.82 66.74 Favored Glycine 0 N--CA 1.487 2.038 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.212 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 86' ' ' SER . . . . . 0.443 ' C ' ' H ' ' S' ' 88' ' ' SER . 9.4 p -126.72 -42.92 1.74 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.028 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 87' ' ' ASN . . . . . 0.436 ' N ' ' OG ' ' S' ' 86' ' ' SER . 0.9 OUTLIER -57.95 -7.19 0.7 Allowed 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.026 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 88' ' ' SER . . . . . 0.443 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -66.29 -31.16 71.8 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.946 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 4.5 mt -45.68 -28.27 0.97 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.018 -1.073 . . . . 0.0 109.758 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 90' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' S' ' 92' ' ' ALA . 60.6 mttt -92.25 -75.73 0.48 Allowed 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.122 0.963 . . . . 0.0 110.385 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -40.21 -27.08 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.921 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 92' ' ' ALA . . . . . 0.444 ' N ' ' O ' ' S' ' 90' ' ' LYS . . . -91.1 149.71 40.41 Favored Pre-proline 0 N--CA 1.489 1.488 0 C-N-CA 118.972 -1.091 . . . . 0.0 111.707 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -54.8 160.68 7.18 Favored 'Trans proline' 0 C--O 1.215 -0.673 0 C-N-CA 121.403 1.402 . . . . 0.0 111.699 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 83.6 t -88.42 -26.57 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 118.774 -1.171 . . . . 0.0 109.63 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -58.87 -8.82 1.5 Allowed 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.732 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 mt -66.1 -51.66 55.95 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.817 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.21 -50.38 3.59 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.041 -0.663 . . . . 0.0 111.911 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -55.98 -30.12 61.31 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.837 -0.745 . . . . 0.0 112.791 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.4 ' CH2' HG11 ' S' ' 103' ' ' VAL . 7.8 t90 -86.07 -54.13 4.66 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.808 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.617 HD13 HG23 ' S' ' 103' ' ' VAL . 2.1 mm? -40.14 -41.49 1.28 Allowed 'General case' 0 C--N 1.293 -1.871 0 C-N-CA 118.802 -1.159 . . . . 0.0 113.663 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' S' ' 100' ' ' LEU . 4.5 mt-10 -46.11 -30.33 1.86 Allowed 'General case' 0 C--N 1.289 -2.064 0 C-N-CA 118.26 -1.376 . . . . 0.0 108.229 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 102' ' ' GLU . . . . . 0.412 ' N ' ' C ' ' S' ' 100' ' ' LEU . 3.9 mm-40 -87.79 -39.25 15.05 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.319 -1.31 . . . . 0.0 114.026 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.617 HG23 HD13 ' S' ' 100' ' ' LEU . 0.2 OUTLIER -82.77 -18.8 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 C-N-CA 114.826 -2.749 . . . . 0.0 111.192 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 104' ' ' LEU . . . . . 0.455 HD23 HD12 ' S' ' 100' ' ' LEU . 0.0 OUTLIER -87.28 -50.92 6.26 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.732 179.866 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.77 -53.26 58.81 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.46 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -56.31 -59.94 4.23 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.976 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 116.431 -1.747 . . . . 0.0 110.344 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.619 ' CE3' ' NE ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 116.343 -1.789 . . . . 0.0 109.898 . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.57 ' CZ3' ' HB2' ' S' ' 54' ' ' ARG . 11.6 m95 . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 116.047 -1.93 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 28.9 m -154.42 68.18 5.75 Favored Pre-proline 0 N--CA 1.486 1.359 0 C-N-CA 119.176 -1.01 . . . . 0.0 111.399 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -67.45 145.78 72.25 Favored 'Trans proline' 0 C--N 1.315 -1.233 0 C-N-CA 121.648 1.565 . . . . 0.0 111.2 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.51 150.0 41.87 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.179 -1.008 . . . . 0.0 110.711 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 95.5 p -145.99 73.87 1.35 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.856 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.36 -44.96 93.3 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.813 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.3 -74.95 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.743 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 10.7 ttm 45.59 92.89 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.916 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -176.38 60.61 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.862 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -51.31 -74.99 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.629 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 45.88 91.03 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.225 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -143.2 -40.08 0.32 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.479 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -158.87 27.11 0.22 Allowed 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.604 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -110.44 -79.15 0.58 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -61.41 -30.69 70.72 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 9.6 t-105 -62.02 -55.0 33.73 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.146 -1.843 . . . . 0.0 107.417 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 20' ' ' LEU . . . . . 0.728 HD13 ' C ' ' R' ' 20' ' ' LEU . 1.9 tm? -56.05 -39.67 72.38 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 112.681 -2.054 . . . . 0.0 109.544 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.479 ' O ' ' C ' ' R' ' 22' ' ' PHE . 4.6 mtt-85 -50.47 -69.68 0.11 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 117.858 -1.537 . . . . 0.0 109.044 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.546 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -32.77 -47.05 0.16 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 119.811 -0.755 . . . . 0.0 111.009 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 23' ' ' VAL . . . . . 0.518 HG21 HD21 ' S' ' 39' ' ' LEU . 77.2 t -66.84 -59.23 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.378 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.534 ' OD2' HD23 ' R' ' 25' ' ' LEU . 1.5 t0 -37.66 -63.47 0.46 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.713 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -65.14 -41.94 94.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.253 -1.379 . . . . 0.0 112.205 -179.838 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 26' ' ' LEU . . . . . 0.709 HD13 ' C ' ' R' ' 26' ' ' LEU . 2.8 tm? -47.41 -54.65 10.75 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.145 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 27' ' ' LYS . . . . . 0.468 ' N ' HD13 ' R' ' 26' ' ' LEU . 0.0 OUTLIER -78.66 -24.35 45.23 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.046 -1.062 . . . . 0.0 112.203 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.71 -14.09 59.0 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.891 -1.124 . . . . 0.0 110.891 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.543 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -98.49 -45.85 5.97 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.462 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -42.69 -27.4 0.17 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.467 -0.893 . . . . 0.0 110.855 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -56.4 -43.58 79.44 Favored 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.037 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -96.4 -79.66 0.44 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.62 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 172.56 27.74 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.693 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 34' ' ' LEU . . . . . 0.564 ' N ' ' CD2' ' R' ' 34' ' ' LEU . 0.8 OUTLIER -95.03 -14.27 24.46 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.816 -179.889 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 35' ' ' HIS . . . . . 0.427 ' O ' HD13 ' R' ' 39' ' ' LEU . 16.7 p-80 -52.14 -24.84 7.63 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.12 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.438 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -74.33 -62.75 0.95 Allowed Pre-proline 0 C--N 1.301 -1.517 0 C-N-CA 117.965 -1.494 . . . . 0.0 110.538 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.0 Cg_endo -54.31 -22.12 25.42 Favored 'Trans proline' 0 C--N 1.32 -0.949 0 C-N-CA 120.544 0.829 . . . . 0.0 110.469 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.41 -30.13 23.83 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.889 -0.724 . . . . 0.0 110.257 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.487 ' O ' ' CD1' ' R' ' 43' ' ' LEU . 0.1 OUTLIER -64.41 -29.36 70.42 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.166 -1.013 . . . . 0.0 108.393 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 40' ' ' ASN . . . . . 0.438 ' OD1' ' O ' ' R' ' 40' ' ' ASN . 0.0 OUTLIER -82.23 6.49 16.54 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.495 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 41' ' ' LEU . . . . . 0.465 HD23 HH12 ' S' ' 84' ' ' ARG . 1.9 mt -106.91 -55.48 2.32 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 119.975 -0.69 . . . . 0.0 112.509 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -96.65 34.2 1.71 Allowed 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.074 -1.051 . . . . 0.0 112.762 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 43' ' ' LEU . . . . . 0.487 ' CD1' ' O ' ' R' ' 39' ' ' LEU . 0.7 OUTLIER 169.21 150.41 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 179.893 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.425 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -166.12 -40.94 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 116.152 -2.219 . . . . 0.0 115.898 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.425 ' CD ' ' H ' ' R' ' 44' ' ' THR . 56.9 Cg_endo -105.99 -98.96 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.121 1.214 . . . . 0.0 113.954 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -50.18 -24.35 2.76 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.08 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.703 ' O ' HD13 ' R' ' 51' ' ' LEU . 1.0 OUTLIER -61.33 -48.71 80.1 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 118.78 -1.168 . . . . 0.0 110.087 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ttp180 -66.11 -38.0 87.14 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.977 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -62.59 -70.73 0.19 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.906 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.27 -31.73 1.67 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.223 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 51' ' ' LEU . . . . . 0.703 HD13 ' O ' ' R' ' 47' ' ' GLU . 1.1 mp -58.72 -69.68 0.18 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.565 -0.854 . . . . 0.0 110.591 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.34 -52.59 6.08 Favored Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.697 -1.239 . . . . 0.0 110.104 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.487 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -43.29 -76.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.022 0.915 . . . . 0.0 111.521 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.486 ' HG3' ' N ' ' R' ' 55' ' ' VAL . 0.0 OUTLIER -37.72 -49.0 1.12 Allowed 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.518 -1.674 . . . . 0.0 114.176 -179.878 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 55' ' ' VAL . . . . . 0.486 ' N ' ' HG3' ' R' ' 54' ' ' ARG . 64.0 t -66.28 -23.12 31.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 C-N-CA 117.561 -1.655 . . . . 0.0 109.489 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' R' ' 53' ' ' THR . 3.0 ptt180 -81.64 -39.57 24.21 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.602 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 0.674 HD12 ' C ' ' R' ' 57' ' ' ILE . 0.4 OUTLIER -71.46 -37.75 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 117.545 -1.662 . . . . 0.0 107.185 179.784 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 0.4 HG12 ' N ' ' R' ' 59' ' ' GLU . 25.6 t -63.15 -69.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 119.111 -1.035 . . . . 0.0 109.905 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.4 ' N ' HG12 ' R' ' 58' ' ' VAL . 9.2 tt0 -48.43 -21.25 0.51 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.389 -0.924 . . . . 0.0 111.363 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 60' ' ' GLU . . . . . 0.433 ' O ' ' N ' ' R' ' 64' ' ' GLY . 33.8 mt-10 -76.29 -53.47 8.17 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.186 -1.006 . . . . 0.0 112.814 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pp -62.43 -24.69 67.56 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 118.228 -1.389 . . . . 0.0 111.204 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mt -52.47 -50.42 62.71 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.763 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -117.27 15.01 14.88 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.814 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 64' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' R' ' 60' ' ' GLU . . . -100.2 25.89 26.59 Favored Glycine 0 N--CA 1.491 2.314 0 C-N-CA 119.893 -1.146 . . . . 0.0 110.405 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' R' ' 64' ' ' GLY . 3.5 mt-10 -38.89 -31.83 0.07 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.913 -0.715 . . . . 0.0 111.18 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 1.2 mtm -90.87 111.53 22.98 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.402 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 67' ' ' SER . . . . . 0.43 ' O ' ' OG ' ' R' ' 67' ' ' SER . 3.4 t 177.49 76.53 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 119.414 -0.914 . . . . 0.0 109.933 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 68' ' ' GLN . . . . . 0.457 ' C ' ' H ' ' R' ' 70' ' ' GLU . 2.4 mm100 -101.82 -65.12 1.0 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.067 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 69' ' ' ARG . . . . . 0.48 ' CD ' ' O ' ' R' ' 69' ' ' ARG . 0.0 OUTLIER -83.36 24.04 0.86 Allowed 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 122.49 1.138 . . . . 0.0 109.392 179.885 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 70' ' ' GLU . . . . . 0.457 ' H ' ' C ' ' R' ' 68' ' ' GLN . 5.4 mt-10 -125.79 25.02 6.98 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.894 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 71' ' ' LEU . . . . . 0.455 ' CD1' ' O ' ' R' ' 68' ' ' GLN . 1.0 OUTLIER -62.92 -139.04 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.973 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -46.99 144.1 2.66 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.754 -0.778 . . . . 0.0 111.204 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 73' ' ' ASN . . . . . 0.574 ' O ' ' N ' ' R' ' 75' ' ' LEU . 1.3 t30 -119.61 14.57 12.7 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 122.073 0.94 . . . . 0.0 109.128 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 39.61 15.16 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.015 0 CA-C-N 112.971 -1.922 . . . . 0.0 112.4 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.574 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.8 mt -127.66 -40.43 1.75 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.715 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -75.3 -69.02 1.45 Allowed Glycine 0 N--CA 1.491 2.339 0 C-N-CA 119.622 -1.275 . . . . 0.0 111.315 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -138.53 -104.98 0.18 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 119.435 -0.906 . . . . 0.0 111.303 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 146.44 9.03 Favored Glycine 0 N--CA 1.488 2.156 0 C-N-CA 119.525 -1.322 . . . . 0.0 110.751 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.87 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -39.84 -36.64 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.642 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.531 ' O ' ' NE ' ' R' ' 84' ' ' ARG . . . -52.75 -37.11 58.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.672 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 81' ' ' THR . . . . . 0.541 ' CG2' ' N ' ' R' ' 82' ' ' ILE . 3.9 t -68.81 -50.9 46.31 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.388 -0.925 . . . . 0.0 113.129 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 82' ' ' ILE . . . . . 0.541 ' N ' ' CG2' ' R' ' 81' ' ' THR . 12.2 pt -73.09 10.69 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.334 -1.346 . . . . 0.0 112.447 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -93.52 -68.25 0.81 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.801 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.779 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.51 -23.57 10.78 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.63 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.72 -50.17 55.02 Favored Glycine 0 N--CA 1.49 2.283 0 C-N-CA 119.422 -1.37 . . . . 0.0 110.331 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 56.1 m -93.65 -26.27 17.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -86.07 3.66 41.48 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.435 -0.906 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -26.04 59.73 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.703 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.77 -30.34 61.11 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.146 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.24 -51.69 3.07 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.306 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.18 0.11 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.537 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.579 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -96.74 163.99 19.06 Favored Pre-proline 0 N--CA 1.489 1.518 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.583 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 93' ' ' PRO . . . . . 0.579 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 13.8 Cg_exo -49.37 152.55 5.66 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 C-N-CA 121.438 1.425 . . . . 0.0 111.507 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.54 10.52 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 119.933 -0.707 . . . . 0.0 111.409 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.62 -11.69 58.74 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.188 -1.005 . . . . 0.0 111.619 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 pp -97.37 -32.9 11.63 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.359 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.39 -29.17 3.74 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.212 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -82.77 -42.03 18.45 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.788 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.632 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 10.0 t90 -62.23 -60.01 4.2 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.602 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.28 -26.5 0.06 Allowed 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.127 -1.029 . . . . 0.0 113.244 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.452 ' C ' ' O ' ' R' ' 100' ' ' LEU . 2.1 mm-40 -48.62 -38.9 22.19 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 117.412 -1.715 . . . . 0.0 106.563 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -88.65 -28.78 20.4 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 113.26 -1.791 . . . . 0.0 112.276 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.632 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.2 t -91.22 -3.45 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 117.489 -1.684 . . . . 0.0 110.813 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 104' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' R' ' 100' ' ' LEU . 29.3 tp -101.33 -51.79 3.4 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.692 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 105' ' ' LEU . . . . . 0.695 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.5 OUTLIER -66.17 -26.57 67.48 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 118.905 -1.118 . . . . 0.0 110.525 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -81.07 -2.21 47.29 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.553 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.304 -1.38 0 CA-C-O 116.319 -1.8 . . . . 0.0 110.644 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.864 0.364 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 4.8 m 46.8 68.9 3.04 Favored Pre-proline 0 N--CA 1.486 1.366 0 C-N-CA 119.405 -0.918 . . . . 0.0 111.285 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 6' ' ' PRO . . . . . 0.491 ' O ' ' N ' ' S' ' 8' ' ' SER . 2.3 Cg_endo -65.55 -24.14 56.48 Favored 'Trans proline' 0 C--N 1.314 -1.263 0 C-N-CA 121.587 1.525 . . . . 0.0 111.366 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 15.6 t80 61.37 -75.22 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.171 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 8' ' ' SER . . . . . 0.491 ' N ' ' O ' ' S' ' 6' ' ' PRO . 10.9 t 51.35 91.48 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.857 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -171.65 -70.31 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.863 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -156.33 129.91 8.29 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.636 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 11' ' ' MET . . . . . 0.446 ' O ' ' HB3' ' S' ' 12' ' ' ALA . 4.1 mmt -85.95 148.77 25.61 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.04 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 12' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' S' ' 11' ' ' MET . . . 60.39 179.86 0.1 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.802 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -48.95 151.27 1.28 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.833 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 14' ' ' GLN . . . . . 0.429 ' O ' ' O ' ' S' ' 15' ' ' ARG . 38.4 mt-30 -65.1 -45.06 86.77 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.41 -0.916 . . . . 0.0 110.711 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 15' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' S' ' 14' ' ' GLN . 9.7 mtt180 50.7 102.54 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.431 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -133.68 -4.28 2.9 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' S' ' 18' ' ' GLU . 5.6 mt-30 -87.78 -84.19 0.2 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.977 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 3.1 mp0 -45.54 -35.26 3.78 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -44.44 -53.93 6.43 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.564 -1.653 . . . . 0.0 108.685 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 20' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' S' ' 20' ' ' LEU . 7.5 tp -59.78 -46.32 89.54 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 113.758 -1.565 . . . . 0.0 111.758 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.474 ' H ' ' HD3' ' S' ' 21' ' ' ARG . 3.4 mpt_? -44.48 -66.17 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.578 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.577 ' CD2' HD21 ' R' ' 51' ' ' LEU . 0.1 OUTLIER -35.59 -51.03 0.63 Allowed 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.862 179.527 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' S' ' 26' ' ' LEU . 30.7 t -67.76 -68.51 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.815 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' S' ' 23' ' ' VAL . 13.2 t0 -20.86 -54.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 124.248 0.968 . . . . 0.0 113.107 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.794 HD12 ' CE ' ' S' ' 42' ' ' MET . 1.7 mt -74.26 -47.58 34.2 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.778 -1.169 . . . . 0.0 109.695 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.677 HD21 HD12 ' S' ' 39' ' ' LEU . 0.2 OUTLIER -47.42 -16.73 0.06 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.409 -0.916 . . . . 0.0 110.974 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 27' ' ' LYS . . . . . 0.529 ' O ' ' N ' ' S' ' 29' ' ' ALA . 5.7 tptm -93.95 -73.53 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.591 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -46.33 -9.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.607 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 29' ' ' ALA . . . . . 0.529 ' N ' ' O ' ' S' ' 27' ' ' LYS . . . -91.72 -42.22 10.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.722 -1.191 . . . . 0.0 112.331 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 30' ' ' TYR . . . . . 0.425 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 28.1 t80 -43.78 -29.82 0.58 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 118.916 -1.114 . . . . 0.0 110.802 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -36.09 66.13 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.196 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 29.9 m120 -92.78 -7.17 47.27 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.656 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.418 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.7 OUTLIER 76.43 29.58 0.7 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.388 0.613 . . . . 0.0 110.249 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 34' ' ' LEU . . . . . 0.514 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.3 mm? -95.71 -14.25 23.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.999 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 35' ' ' HIS . . . . . 0.447 ' O ' HD13 ' S' ' 39' ' ' LEU . 36.8 p-80 -45.56 -33.72 2.93 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 113.813 -1.54 . . . . 0.0 113.334 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.46 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.9 mt -68.24 -64.58 1.77 Allowed Pre-proline 0 C--N 1.304 -1.378 0 C-N-CA 117.442 -1.703 . . . . 0.0 110.12 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.46 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.6 Cg_exo -47.42 -26.83 6.43 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 C-N-CA 120.524 0.816 . . . . 0.0 110.184 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.93 -37.65 34.12 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.429 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.677 HD12 HD21 ' S' ' 26' ' ' LEU . 0.4 OUTLIER -57.38 -27.29 62.18 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.695 179.865 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.4 5.91 39.92 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.45 -63.05 1.46 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 42' ' ' MET . . . . . 0.794 ' CE ' HD12 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -89.04 34.13 0.79 Allowed 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 118.578 -1.249 . . . . 0.0 112.397 -179.713 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 43' ' ' LEU . . . . . 0.482 ' CD1' ' O ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER 170.26 141.54 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.776 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.665 ' H ' ' CD ' ' S' ' 45' ' ' PRO . 0.3 OUTLIER -176.22 -32.19 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 115.972 1.842 . . . . 0.0 115.972 -179.699 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.665 ' CD ' ' H ' ' S' ' 44' ' ' THR . 24.6 Cg_endo -87.64 -102.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 121.609 1.539 . . . . 0.0 112.529 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 46' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' S' ' 50' ' ' ALA . 8.7 m-20 -49.74 -34.93 20.46 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 118.556 -1.258 . . . . 0.0 108.047 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -49.61 -61.63 2.0 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.507 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.63 -47.46 14.79 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.891 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -83.79 -65.83 0.96 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.478 -1.289 . . . . 0.0 113.009 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 50' ' ' ALA . . . . . 0.822 ' HB1' HH11 ' S' ' 54' ' ' ARG . . . -44.57 -46.5 9.98 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.417 -0.913 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 44.3 mt -45.98 -58.04 3.9 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 118.844 -1.142 . . . . 0.0 110.832 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.63 -54.15 18.28 Favored Glycine 0 N--CA 1.483 1.806 0 C-N-CA 118.84 -1.648 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.45 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.1 OUTLIER -43.14 -83.32 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -179.84 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.822 HH11 ' HB1' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -43.76 -63.7 0.8 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 58.8 t -45.13 -29.42 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.968 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.525 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -92.2 -36.9 13.01 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 118.18 -1.408 . . . . 0.0 112.21 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 0.965 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -62.99 -31.35 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 C-N-CA 115.419 -2.513 . . . . 0.0 105.064 179.876 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 58' ' ' VAL . . . . . 0.965 ' N ' HD13 ' S' ' 57' ' ' ILE . 31.3 t -62.0 -64.84 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 CA-C-N 114.879 -1.055 . . . . 0.0 108.19 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.8 -33.1 15.58 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.746 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 60' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' S' ' 64' ' ' GLY . 3.5 tt0 -70.43 -54.11 13.7 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.559 -0.857 . . . . 0.0 111.719 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 61' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' S' ' 61' ' ' LEU . 31.5 mt -53.13 -24.18 9.87 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.681 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 tp -57.47 -38.89 75.25 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.045 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -122.42 5.0 9.64 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.972 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' S' ' 60' ' ' GLU . . . -102.5 11.17 56.58 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -43.87 -51.1 7.72 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.547 -0.861 . . . . 0.0 110.44 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -83.02 27.47 0.55 Allowed 'General case' 0 N--CA 1.49 1.55 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.069 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 7.1 t -167.78 70.49 0.09 Allowed 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 118.895 -1.122 . . . . 0.0 110.702 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.08 -11.48 8.05 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 122.077 0.942 . . . . 0.0 109.278 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -87.05 12.03 12.35 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 113.094 -1.866 . . . . 0.0 113.23 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.62 14.26 20.08 Favored 'General case' 0 N--CA 1.504 2.259 0 C-N-CA 119.529 -0.868 . . . . 0.0 113.012 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 71' ' ' LEU . . . . . 0.45 ' O ' ' CB ' ' S' ' 72' ' ' LYS . 1.0 OUTLIER -127.57 96.27 4.49 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.025 -179.884 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 72' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' S' ' 71' ' ' LEU . 5.2 tttm 165.92 98.29 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.673 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 73' ' ' ASN . . . . . 0.408 ' O ' ' CB ' ' S' ' 74' ' ' GLU . 11.2 t-20 -113.99 -31.38 6.4 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.541 0.686 . . . . 0.0 109.638 179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 74' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' S' ' 73' ' ' ASN . 2.9 pt-20 153.76 -58.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.042 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 75' ' ' LEU . . . . . 0.499 ' H ' ' HG ' ' S' ' 75' ' ' LEU . 0.3 OUTLIER -108.93 21.48 17.17 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 119.837 -0.745 . . . . 0.0 109.237 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 76' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' S' ' 77' ' ' ALA . . . -97.6 -49.19 1.85 Allowed Glycine 0 N--CA 1.492 2.396 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.436 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 77' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' S' ' 76' ' ' GLY . . . 175.94 97.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.517 0.675 . . . . 0.0 110.352 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.71 159.97 8.59 Favored Glycine 0 N--CA 1.482 1.713 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.809 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.503 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.6 OUTLIER -49.33 -38.0 11.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 CA-C-N 114.399 -0.901 . . . . 0.0 110.266 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.442 ' N ' HG13 ' S' ' 79' ' ' ILE . . . -38.44 -44.31 0.92 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.226 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.477 ' HA ' ' HE1' ' R' ' 109' ' ' TRP . 24.4 m -71.81 -43.75 65.09 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 122.082 0.944 . . . . 0.0 112.211 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 82' ' ' ILE . . . . . 0.408 HG13 ' H ' ' S' ' 82' ' ' ILE . 0.0 OUTLIER -81.33 12.31 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.26 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.503 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -126.25 -18.91 4.83 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 118.934 -1.106 . . . . 0.0 113.508 179.729 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 84' ' ' ARG . . . . . 0.622 ' CZ ' ' CZ3' ' R' ' 109' ' ' TRP . 0.0 OUTLIER -87.06 -19.99 27.79 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 118.254 -1.378 . . . . 0.0 109.05 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.0 -18.75 49.58 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.274 -1.441 . . . . 0.0 110.102 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t -84.35 -60.34 2.11 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.913 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.49 2.92 20.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.625 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 88' ' ' SER . . . . . 0.457 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.2 OUTLIER -55.79 -48.9 74.55 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.768 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 pp -46.88 -14.48 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.386 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 90' ' ' LYS . . . . . 0.457 ' N ' ' O ' ' S' ' 88' ' ' SER . 17.7 tptt -49.09 -52.89 23.09 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.64 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.49 -38.25 13.5 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.258 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 54.6 60.32 10.44 Favored Pre-proline 0 C--N 1.303 -1.424 0 C-N-CA 119.833 -0.747 . . . . 0.0 111.842 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -63.07 97.49 0.19 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 121.239 1.292 . . . . 0.0 110.667 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 94' ' ' VAL . . . . . 0.448 ' H ' HG23 ' S' ' 94' ' ' VAL . 2.9 t -56.75 -10.42 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.905 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -83.48 -24.09 31.92 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.548 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 96' ' ' LEU . . . . . 0.421 ' O ' ' N ' ' S' ' 99' ' ' TRP . 3.7 mp -84.29 -51.31 7.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.211 -0.996 . . . . 0.0 111.181 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.52 -32.82 3.6 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.95 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -82.13 -24.26 35.19 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.387 -0.925 . . . . 0.0 110.584 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.669 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 4.7 t90 -95.09 -63.54 1.16 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.256 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.511 ' O ' ' C ' ' S' ' 101' ' ' GLU . 2.0 mm? -35.58 -39.57 0.14 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.511 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -40.72 -41.47 1.54 Allowed 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 118.155 -1.418 . . . . 0.0 107.571 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.9 -28.09 23.0 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 113.756 -1.565 . . . . 0.0 112.652 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.669 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 3.3 t -84.03 -15.36 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 116.615 -2.034 . . . . 0.0 111.888 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 4.9 mt -99.8 -61.94 1.3 Allowed 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.826 -0.75 . . . . 0.0 111.913 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 105' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' S' ' 107' ' ' SER . 4.5 mm? -63.86 -75.21 0.08 Allowed 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.231 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -42.17 -23.44 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.731 -0.787 . . . . 0.0 110.841 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' S' S ' 107' ' ' SER . . . . . 0.477 ' N ' ' O ' ' S' ' 105' ' ' LEU . 19.6 p . . . . . 0 C--N 1.304 -1.371 0 CA-C-O 116.253 -1.832 . . . . 0.0 110.83 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.47 ' CZ3' ' HB2' ' R' ' 54' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 116.426 -1.75 . . . . 0.0 109.918 . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.622 ' CZ3' ' CZ ' ' S' ' 84' ' ' ARG . 1.5 p90 . . . . . 0 N--CA 1.484 1.244 0 CA-C-O 117.224 -1.37 . . . . 0.0 108.821 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 . . . . . 0 N--CA 1.486 1.356 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' R' R ' 5' ' ' SER . . . . . 0.43 ' N ' ' HD2' ' R' ' 6' ' ' PRO . 0.5 OUTLIER -85.79 -52.97 0.45 Allowed Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 119.248 -0.981 . . . . 0.0 112.532 179.918 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' R' ' 5' ' ' SER . 2.5 Cg_endo -61.25 161.2 23.98 Favored 'Trans proline' 0 C--O 1.213 -0.752 0 C-N-CA 120.721 0.947 . . . . 0.0 111.575 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 7' ' ' TYR . . . . . 0.402 ' CD1' ' N ' ' R' ' 7' ' ' TYR . 0.0 OUTLIER -128.3 143.95 51.07 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.033 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 5.6 t -167.86 128.71 1.41 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.137 -1.025 . . . . 0.0 111.394 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -84.06 -43.8 14.73 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.472 -0.891 . . . . 0.0 110.734 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . 50.49 57.08 7.0 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.88 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 11' ' ' MET . . . . . 0.432 ' O ' ' O ' ' R' ' 12' ' ' ALA . 22.8 mmm -76.64 65.44 2.43 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.453 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 12' ' ' ALA . . . . . 0.432 ' O ' ' O ' ' R' ' 11' ' ' MET . . . 44.27 -170.01 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.605 -0.838 . . . . 0.0 111.225 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -164.0 -40.95 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.11 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 14' ' ' GLN . . . . . 0.405 ' H ' ' HG2' ' R' ' 14' ' ' GLN . 4.4 pt20 -101.45 119.49 38.85 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.299 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -166.01 -30.51 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.456 -0.897 . . . . 0.0 110.136 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -80.37 7.56 9.41 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.798 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.421 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.1 mp0 -84.97 -75.6 0.35 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.285 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 18' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' R' ' 18' ' ' GLU . 1.5 mp0 -46.16 -30.7 2.05 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 122.804 1.288 . . . . 0.0 108.466 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 19' ' ' TRP . . . . . 0.421 ' N ' ' C ' ' R' ' 17' ' ' GLN . 67.2 t-105 -55.61 -58.51 7.48 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 112.645 -2.07 . . . . 0.0 110.229 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.9 tp -50.06 -23.6 2.18 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.521 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.541 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mmt85 -71.68 -69.7 0.37 Allowed 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.813 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.541 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.41 -37.39 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.19 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 23' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t -74.24 -50.48 27.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.413 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' R' ' 21' ' ' ARG . 38.5 t70 -41.17 -72.87 0.05 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.567 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.445 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.2 OUTLIER -47.5 -44.85 25.81 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.579 -0.848 . . . . 0.0 111.13 -179.995 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.88 -56.91 7.4 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.149 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -62.54 -35.9 80.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -81.24 -7.58 59.59 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.886 -1.126 . . . . 0.0 112.537 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' R' ' 31' ' ' GLN . . . -99.94 -57.98 2.02 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.105 -1.038 . . . . 0.0 112.83 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 30' ' ' TYR . . . . . 0.419 ' C ' ' O ' ' R' ' 29' ' ' ALA . 0.2 OUTLIER -34.53 -27.67 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.859 -179.771 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 31' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' R' ' 29' ' ' ALA . 1.2 tt0 -54.84 -44.54 74.03 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.801 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -103.43 -76.48 0.59 Allowed 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.965 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 33' ' ' ASP . . . . . 0.738 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.8 OUTLIER 178.8 27.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.966 -1.094 . . . . 0.0 112.06 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 34' ' ' LEU . . . . . 0.865 HD22 ' N ' ' R' ' 34' ' ' LEU . 1.0 OUTLIER -99.61 -11.59 20.82 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.249 -0.981 . . . . 0.0 110.869 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 47.0 p-80 -59.25 -24.34 63.13 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.829 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' R' ' 36' ' ' LEU . 8.1 mt -76.13 -59.56 1.09 Allowed Pre-proline 0 C--N 1.303 -1.436 0 C-N-CA 118.018 -1.473 . . . . 0.0 110.81 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.5 Cg_exo -54.88 -36.29 91.2 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 N-CA-C 109.404 -1.037 . . . . 0.0 109.404 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.77 -43.84 95.21 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.619 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.5 OUTLIER -52.55 -34.25 49.37 Favored 'General case' 0 C--O 1.203 -1.344 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.628 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -74.12 5.75 4.09 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.316 -0.953 . . . . 0.0 111.542 179.875 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.01 -56.64 2.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.46 12.33 2.53 Favored 'General case' 0 N--CA 1.501 2.098 0 C-N-CA 117.429 -1.709 . . . . 0.0 112.841 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 43' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' R' ' 39' ' ' LEU . 2.2 pp 179.95 146.58 0.24 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.601 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -175.44 -38.07 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 116.075 -2.25 . . . . 0.0 116.14 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.601 ' HD2' ' H ' ' R' ' 44' ' ' THR . 41.4 Cg_endo -87.26 -109.43 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 121.444 1.429 . . . . 0.0 113.183 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 46' ' ' ASP . . . . . 0.43 ' H ' ' HB2' ' R' ' 45' ' ' PRO . 3.7 p-10 -54.48 -32.75 58.43 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 119.721 -0.791 . . . . 0.0 110.275 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.486 ' OE2' ' OXT' ' R' ' 109' ' ' TRP . 30.6 mt-10 -54.6 -64.6 0.78 Allowed 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.081 -1.047 . . . . 0.0 110.49 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.19 -38.32 11.75 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.171 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.52 -68.02 0.4 Allowed 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.351 -1.34 . . . . 0.0 111.938 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.499 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -65.84 -52.54 49.61 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.205 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 51' ' ' LEU . . . . . 0.499 ' C ' ' O ' ' R' ' 50' ' ' ALA . 3.2 tt -33.77 -48.89 0.3 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.526 -0.87 . . . . 0.0 110.357 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 52' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -64.85 -69.37 1.35 Allowed Glycine 0 N--CA 1.482 1.753 0 C-N-CA 119.564 -1.303 . . . . 0.0 110.104 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.449 ' C ' ' O ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -34.02 -69.14 0.1 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 122.319 1.057 . . . . 0.0 110.748 179.764 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.525 ' CD ' ' H ' ' R' ' 54' ' ' ARG . 0.1 OUTLIER -35.18 -63.82 0.31 Allowed 'General case' 0 C--N 1.286 -2.156 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.908 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 12.0 p -60.52 -19.24 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 C-N-CA 116.739 -1.984 . . . . 0.0 111.947 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.608 HH22 ' CZ ' ' R' ' 69' ' ' ARG . 0.0 OUTLIER -83.62 -38.07 22.06 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.38 -0.928 . . . . 0.0 112.422 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 1.029 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -81.83 -34.58 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.872 -179.639 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 1.029 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.8 p -69.31 -39.92 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 118.045 -1.462 . . . . 0.0 111.37 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.482 ' N ' HG13 ' R' ' 58' ' ' VAL . 3.3 pt-20 -72.2 -30.57 65.07 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 118.383 -1.327 . . . . 0.0 110.584 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -74.63 -47.47 31.91 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.609 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.53 -26.71 67.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.015 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 62' ' ' LEU . . . . . 0.462 ' O ' HD23 ' R' ' 62' ' ' LEU . 0.8 OUTLIER -50.35 -30.4 12.09 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 118.918 -1.113 . . . . 0.0 109.537 179.822 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.69 -2.09 7.89 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.014 -0.993 . . . . 0.0 109.971 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 64' ' ' GLY . . . . . 0.403 ' O ' ' C ' ' R' ' 65' ' ' GLU . . . -113.7 21.15 16.93 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.556 ' O ' ' C ' ' R' ' 66' ' ' MET . 76.5 mt-10 -35.95 -50.6 0.68 Allowed 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.295 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 66' ' ' MET . . . . . 0.556 ' C ' ' O ' ' R' ' 65' ' ' GLU . 34.6 ttm 6.45 -110.21 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 O-C-N 124.854 1.346 . . . . 0.0 112.377 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 38.4 t -175.67 73.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.133 -1.027 . . . . 0.0 110.73 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.56 -42.46 1.8 Allowed 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.343 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 69' ' ' ARG . . . . . 0.608 ' CZ ' HH22 ' R' ' 56' ' ' ARG . 0.7 OUTLIER -92.38 26.93 2.4 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.319 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 70' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -92.02 19.0 7.17 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.639 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 11.8 mt -115.3 133.84 55.67 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.256 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.07 91.37 4.52 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.866 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 73' ' ' ASN . . . . . 0.538 ' O ' ' N ' ' R' ' 75' ' ' LEU . 47.7 t-20 -87.41 11.72 13.88 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 118.541 -1.264 . . . . 0.0 109.945 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 58.89 -67.75 0.03 OUTLIER 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 113.248 -1.796 . . . . 0.0 111.037 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.538 ' N ' ' O ' ' R' ' 73' ' ' ASN . 0.4 OUTLIER -63.03 -31.75 72.95 Favored 'General case' 0 C--N 1.297 -1.675 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.202 179.887 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -53.07 -57.57 14.43 Favored Glycine 0 N--CA 1.489 2.209 0 C-N-CA 119.494 -1.336 . . . . 0.0 110.266 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -153.26 -74.13 0.13 Allowed 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.725 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 78' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 156.29 122.99 0.77 Allowed Glycine 0 N--CA 1.491 2.357 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.647 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.919 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -37.14 -32.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.622 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.446 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.66 -56.02 14.39 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.962 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 19.7 m -42.89 -50.2 5.79 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 82' ' ' ILE . . . . . 0.439 HD13 HG21 ' R' ' 82' ' ' ILE . 12.1 pt -71.0 -28.72 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 C-N-CA 119.0 -1.08 . . . . 0.0 113.02 -179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -61.02 -73.15 0.1 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 118.648 -1.221 . . . . 0.0 110.922 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -11.37 1.4 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.102 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 85' ' ' GLY . . . . . 0.405 ' N ' ' C ' ' R' ' 83' ' ' THR . . . -69.73 -28.76 71.7 Favored Glycine 0 N--CA 1.486 1.999 0 C-N-CA 119.775 -1.203 . . . . 0.0 110.99 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 40.2 t -150.32 57.24 0.95 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 118.603 -1.239 . . . . 0.0 112.197 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 87' ' ' ASN . . . . . 0.464 ' O ' ' CB ' ' R' ' 88' ' ' SER . 32.1 t-20 -94.36 -13.22 26.58 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 88' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER 75.1 -45.36 0.56 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.088 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.73 -25.93 65.89 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.55 -0.86 . . . . 0.0 111.302 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 90' ' ' LYS . . . . . 0.574 ' C ' ' H ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -48.9 -37.65 20.37 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.526 -1.27 . . . . 0.0 110.797 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' R' R ' 91' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' R' ' 92' ' ' ALA . . . -61.03 11.54 0.02 OUTLIER 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.032 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.704 ' HB3' ' HD3' ' R' ' 93' ' ' PRO . . . -31.34 -59.65 0.32 Allowed Pre-proline 0 N--CA 1.493 1.698 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 93' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' R' ' 92' ' ' ALA . 5.2 Cg_exo -51.31 95.28 0.03 OUTLIER 'Trans proline' 0 C--N 1.324 -0.763 0 C-N-CA 120.506 0.804 . . . . 0.0 110.725 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.13 -16.95 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.588 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.82 -28.62 67.73 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.362 -0.935 . . . . 0.0 111.274 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 4.3 mt -61.88 -41.05 97.4 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.481 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -55.86 -37.81 69.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.645 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.55 -29.37 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.6 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.436 ' CE3' HG21 ' R' ' 103' ' ' VAL . 3.0 t90 -99.2 -67.49 0.85 Allowed 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.362 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.704 ' CD1' HD13 ' R' ' 104' ' ' LEU . 1.3 mm? -38.6 -55.46 1.43 Allowed 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.545 ' C ' ' O ' ' R' ' 100' ' ' LEU . 12.7 pt-20 -33.24 -33.11 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.85 -1.14 . . . . 0.0 109.51 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' R' ' 100' ' ' LEU . 1.8 tm-20 -92.54 -32.41 14.85 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.802 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.577 ' N ' ' O ' ' R' ' 100' ' ' LEU . 9.8 t -80.81 -15.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 116.959 -1.896 . . . . 0.0 110.883 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 104' ' ' LEU . . . . . 0.704 HD13 ' CD1' ' R' ' 100' ' ' LEU . 1.8 tp -102.14 -55.25 2.52 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.937 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.16 -66.65 0.35 Allowed 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.983 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 26.2 tttt -58.55 -73.03 0.08 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.503 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.305 -1.349 0 CA-C-O 116.282 -1.818 . . . . 0.0 111.035 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 46.5 t -156.75 77.87 4.06 Favored Pre-proline 0 N--CA 1.487 1.383 0 C-N-CA 119.836 -0.746 . . . . 0.0 110.847 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -62.11 163.87 18.61 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 121.587 1.525 . . . . 0.0 112.185 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -101.38 158.62 15.93 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.773 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 54.5 m -92.03 -165.35 1.33 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.461 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 9' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' S' ' 10' ' ' ALA . . . -81.4 90.78 6.2 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.344 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 10' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' S' ' 9' ' ' ALA . . . 57.46 161.09 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.933 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 4.7 ttp -136.81 -30.07 0.9 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.786 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -171.12 127.99 0.71 Allowed 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.972 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 13' ' ' GLU . . . . . 0.667 ' H ' ' CD ' ' S' ' 13' ' ' GLU . 0.0 OUTLIER -90.11 143.1 27.07 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.177 -1.009 . . . . 0.0 110.892 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -63.97 119.26 9.75 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.233 -0.987 . . . . 0.0 110.103 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 15' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' S' ' 15' ' ' ARG . 0.1 OUTLIER -78.67 63.06 3.36 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 118.813 -1.155 . . . . 0.0 111.221 -179.913 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -84.92 10.86 10.58 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.588 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.417 ' C ' ' N ' ' S' ' 19' ' ' TRP . 20.8 mt-30 -76.99 -92.11 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.047 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.581 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 0.4 OUTLIER -44.25 -27.45 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 122.164 0.983 . . . . 0.0 109.54 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 19' ' ' TRP . . . . . 0.417 ' N ' ' C ' ' S' ' 17' ' ' GLN . 32.8 t-105 -53.6 -48.64 69.07 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.627 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 20' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' S' ' 17' ' ' GLN . 1.2 tt -59.84 -36.1 76.14 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 113.253 -1.794 . . . . 0.0 111.016 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 1.4 mpt_? -58.17 -73.02 0.08 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.28 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.556 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -25.6 -50.67 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.78 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.402 ' N ' ' O ' ' S' ' 21' ' ' ARG . 30.6 t -68.89 -63.05 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.745 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' S' ' 24' ' ' ASP . 21.7 t0 -35.55 -60.65 0.5 Allowed 'General case' 0 N--CA 1.488 1.469 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.838 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.49 HD23 ' N ' ' S' ' 25' ' ' LEU . 2.7 mt -57.24 -57.09 14.16 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.161 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.456 HD11 HD11 ' S' ' 39' ' ' LEU . 0.6 OUTLIER -42.37 -25.05 0.07 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.243 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 27' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' S' ' 25' ' ' LEU . 3.3 mtpm? -82.45 -39.28 22.77 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.716 -1.194 . . . . 0.0 113.005 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -83.23 -20.7 34.08 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.42 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 29' ' ' ALA . . . . . 0.606 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -82.95 -32.78 26.95 Favored 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.703 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 30' ' ' TYR . . . . . 0.498 ' CD1' ' O ' ' S' ' 30' ' ' TYR . 0.0 OUTLIER -56.59 -32.53 65.33 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.004 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -47.67 77.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.878 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.57 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 19.9 m-20 -84.09 -41.96 16.6 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.781 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 22.1 t70 116.56 49.35 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.713 0 O-C-N 125.059 1.474 . . . . 0.0 109.393 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 34' ' ' LEU . . . . . 0.606 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.4 mm? -112.55 -14.0 13.26 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.996 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 35' ' ' HIS . . . . . 0.454 ' O ' HD13 ' S' ' 39' ' ' LEU . 15.6 p-80 -52.22 -13.39 0.33 Allowed 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.528 -1.215 . . . . 0.0 112.89 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.481 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.5 mt -80.87 -66.19 0.25 Allowed Pre-proline 0 N--CA 1.486 1.34 0 C-N-CA 118.217 -1.393 . . . . 0.0 110.093 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.481 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.0 Cg_exo -49.55 -29.04 17.82 Favored 'Trans proline' 0 C--N 1.322 -0.862 0 N-CA-C 109.961 -0.823 . . . . 0.0 109.961 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 38' ' ' LEU . . . . . 0.558 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.2 mp -71.25 -51.49 24.28 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.469 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.456 HD11 HD11 ' S' ' 26' ' ' LEU . 0.4 OUTLIER -44.57 -41.6 6.65 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.678 179.869 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -18.08 33.44 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.275 -0.97 . . . . 0.0 111.921 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 41' ' ' LEU . . . . . 0.475 ' O ' ' O ' ' R' ' 1' ' ' TRP . 16.5 mt -94.25 -62.03 1.41 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.527 -0.869 . . . . 0.0 112.918 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 42' ' ' MET . . . . . 0.558 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.2 OUTLIER -81.46 10.55 5.6 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 117.927 -1.509 . . . . 0.0 111.781 -179.881 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.53 126.7 7.8 Favored 'General case' 0 N--CA 1.509 2.505 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.536 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.465 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -166.53 -42.53 0.0 OUTLIER Pre-proline 0 N--CA 1.499 2.018 0 C-N-CA 116.456 -2.098 . . . . 0.0 116.506 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' S' ' 44' ' ' THR . 43.7 Cg_endo -89.97 -105.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 120.771 0.98 . . . . 0.0 114.577 -179.494 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 46' ' ' ASP . . . . . 0.408 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 0.2 OUTLIER -57.33 -22.79 44.56 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.94 -179.732 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 47' ' ' GLU . . . . . 0.475 ' OE2' HD12 ' R' ' 51' ' ' LEU . 5.0 mm-40 -56.97 -61.3 2.54 Favored 'General case' 0 C--N 1.296 -1.741 0 C-N-CA 118.534 -1.266 . . . . 0.0 109.315 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 4.8 mmt85 -55.2 -33.07 62.73 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.936 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -82.67 -66.67 0.86 Allowed 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 118.405 -1.318 . . . . 0.0 114.365 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 50' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -50.49 -41.15 52.97 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 51' ' ' LEU . . . . . 0.768 HD12 ' N ' ' S' ' 52' ' ' GLY . 3.7 pp -64.52 -42.25 95.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 117.456 -1.697 . . . . 0.0 111.333 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 52' ' ' GLY . . . . . 0.768 ' N ' HD12 ' S' ' 51' ' ' LEU . . . -55.45 -44.53 85.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 107.632 -2.187 . . . . 0.0 107.632 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.2 OUTLIER -46.71 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.921 -1.139 . . . . 0.0 113.096 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.681 ' HA ' HG23 ' S' ' 57' ' ' ILE . 3.9 ppt_? -48.39 -37.48 17.03 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 119.17 -1.012 . . . . 0.0 113.442 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 55' ' ' VAL . . . . . 0.428 HG22 ' NH2' ' S' ' 54' ' ' ARG . 35.2 t -57.6 -28.69 32.46 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.864 0 C-N-CA 117.841 -1.544 . . . . 0.0 109.192 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -83.15 -33.23 26.3 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 1.017 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -82.57 -29.58 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.105 0 C-N-CA 117.489 -1.684 . . . . 0.0 108.041 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 58' ' ' VAL . . . . . 1.017 ' N ' HD13 ' S' ' 57' ' ' ILE . 10.2 t -63.28 -48.99 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.81 -43.04 98.72 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.91 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.35 -45.76 92.32 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.021 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 97.7 mt -74.72 -31.83 61.96 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.15 -1.02 . . . . 0.0 113.131 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 12.8 tp -77.05 -43.08 35.84 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 118.419 -1.313 . . . . 0.0 112.272 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.35 -39.84 67.8 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.297 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.606 ' C ' ' H ' ' S' ' 66' ' ' MET . . . -69.44 -23.03 76.64 Favored Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.483 -1.341 . . . . 0.0 111.106 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 59.35 -23.95 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 66' ' ' MET . . . . . 0.606 ' H ' ' C ' ' S' ' 64' ' ' GLY . 8.6 mtp -79.89 168.45 19.23 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.752 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 1.7 t -162.26 69.21 0.27 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.759 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.426 ' C ' ' H ' ' S' ' 70' ' ' GLU . 1.3 mt-30 -116.88 -24.8 7.5 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.919 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 69' ' ' ARG . . . . . 0.528 ' C ' ' H ' ' S' ' 71' ' ' LEU . 0.2 OUTLIER -78.81 28.45 0.21 Allowed 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.307 179.981 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.447 ' C ' HD12 ' S' ' 71' ' ' LEU . 88.2 mt-10 -67.49 24.93 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.432 -0.803 . . . . 0.0 112.233 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 71' ' ' LEU . . . . . 0.528 ' H ' ' C ' ' S' ' 69' ' ' ARG . 6.7 mp -120.07 133.62 55.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.42 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 72' ' ' LYS . . . . . 0.627 ' CD ' ' H ' ' S' ' 72' ' ' LYS . 0.0 OUTLIER -51.11 96.3 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -179.822 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 73' ' ' ASN . . . . . 0.661 ' O ' ' N ' ' S' ' 75' ' ' LEU . 0.7 OUTLIER -90.5 26.2 2.05 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 122.097 0.951 . . . . 0.0 108.671 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 74' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' S' ' 76' ' ' GLY . 1.0 OUTLIER 39.6 -71.22 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 112.586 -2.097 . . . . 0.0 112.722 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 75' ' ' LEU . . . . . 0.661 ' N ' ' O ' ' S' ' 73' ' ' ASN . 0.8 OUTLIER -40.78 -21.3 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.789 -179.981 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 76' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' S' ' 74' ' ' GLU . . . -84.01 -65.44 1.54 Allowed Glycine 0 N--CA 1.487 2.081 0 C-N-CA 119.678 -1.249 . . . . 0.0 110.348 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.03 -103.11 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.897 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 78' ' ' GLY . . . . . 0.405 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . -164.49 146.49 11.43 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.844 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.0 OUTLIER -37.43 -39.09 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.886 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.9 -84.33 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.447 ' HA ' ' HE1' ' R' ' 109' ' ' TRP . 1.0 OUTLIER -45.11 -19.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -179.625 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 82' ' ' ILE . . . . . 0.432 HD13 HG21 ' S' ' 82' ' ' ILE . 4.1 pt -102.12 6.34 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 C-N-CA 118.38 -1.328 . . . . 0.0 113.523 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 83' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -99.68 -13.41 19.35 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.778 -1.169 . . . . 0.0 112.302 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 84' ' ' ARG . . . . . 0.439 ' NE ' ' CH2' ' R' ' 109' ' ' TRP . 0.0 OUTLIER -101.56 -36.09 8.9 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.704 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.11 71.69 Favored Glycine 0 N--CA 1.49 2.273 0 C-N-CA 119.66 -1.257 . . . . 0.0 110.83 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.1 p -88.79 -50.03 6.47 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.076 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 87' ' ' ASN . . . . . 0.501 ' N ' ' OD1' ' S' ' 87' ' ' ASN . 1.4 p30 -87.63 -80.46 0.26 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.414 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 88' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' S' ' 87' ' ' ASN . 0.2 OUTLIER 73.09 -37.65 0.39 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.338 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 89' ' ' LEU . . . . . 0.484 ' H ' ' C ' ' S' ' 87' ' ' ASN . 4.7 mt -64.32 -10.41 23.97 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.149 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 90' ' ' LYS . . . . . 0.402 ' O ' ' C ' ' S' ' 91' ' ' ALA . 16.3 mmtm -75.0 -58.64 3.16 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.241 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 91' ' ' ALA . . . . . 0.729 ' O ' ' HB2' ' S' ' 92' ' ' ALA . . . -36.14 -78.42 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.181 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.762 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 92' ' ' ALA . . . . . 0.729 ' HB2' ' O ' ' S' ' 91' ' ' ALA . . . 161.15 -33.68 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.71 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 93' ' ' PRO . . . . . 0.617 ' HD2' ' H ' ' S' ' 92' ' ' ALA . 6.2 Cg_exo -58.89 95.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.325 -0.695 0 C-N-CA 120.524 0.816 . . . . 0.0 112.607 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 94' ' ' VAL . . . . . 0.6 HG23 ' O ' ' S' ' 92' ' ' ALA . 58.4 t -95.13 -18.24 6.79 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.423 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.15 -2.99 6.43 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 3.6 tp -82.53 -36.54 26.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.435 -0.906 . . . . 0.0 111.62 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -1.39 7.34 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.93 -0.708 . . . . 0.0 112.771 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -106.06 -0.41 24.85 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.629 ' CE2' HG21 ' S' ' 103' ' ' VAL . 5.7 t90 -112.53 -64.28 1.32 Allowed 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 114.17 -1.377 . . . . 0.0 113.467 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 1.114 HD22 ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -20.75 -82.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 119.058 2.984 . . . . 0.0 119.058 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 1.114 ' H ' HD22 ' S' ' 100' ' ' LEU . 0.0 OUTLIER -58.58 -43.66 89.53 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 119.15 -1.02 . . . . 0.0 109.071 -179.425 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 102' ' ' GLU . . . . . 0.416 ' H ' ' HG3' ' S' ' 101' ' ' GLU . 1.6 tm-20 -63.15 -18.39 63.41 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.629 HG21 ' CE2' ' S' ' 99' ' ' TRP . 0.5 OUTLIER -91.22 -54.13 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 C-N-CA 117.154 -1.819 . . . . 0.0 111.036 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' S' S ' 104' ' ' LEU . . . . . 0.503 ' N ' HG12 ' S' ' 103' ' ' VAL . 17.5 mt -51.98 -69.01 0.12 Allowed 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.442 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 8.1 mt -45.84 -74.46 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.888 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -43.49 -57.82 2.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.725 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 116.257 -1.83 . . . . 0.0 111.252 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.475 ' O ' ' O ' ' S' ' 41' ' ' LEU . 70.5 m95 . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 116.506 -1.711 . . . . 0.0 109.976 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.512 ' CZ3' ' CB ' ' S' ' 54' ' ' ARG . 93.7 m95 . . . . . 0 N--CA 1.484 1.242 0 CA-C-O 115.943 -1.979 . . . . 0.0 109.049 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.883 0.373 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.03 164.63 57.31 Favored Pre-proline 0 N--CA 1.486 1.373 0 C-N-CA 119.515 -0.874 . . . . 0.0 110.542 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -56.81 -34.11 95.89 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 C-N-CA 121.323 1.348 . . . . 0.0 111.298 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.43 177.58 0.85 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.727 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 8' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' R' ' 9' ' ' ALA . 8.6 t 46.53 36.06 3.33 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 9' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' R' ' 8' ' ' SER . . . 63.81 179.88 0.16 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.85 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -171.73 -34.64 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.41 -0.916 . . . . 0.0 110.92 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 2.0 mmm -160.63 -50.87 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.07 20.87 1.11 Allowed 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.844 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 57.13 92.75 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.774 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -76.44 141.11 41.48 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.47 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 -94.38 163.7 13.31 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.231 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -150.37 -3.26 0.36 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.421 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 17' ' ' GLN . . . . . 0.44 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.4 mt-30 -92.42 -79.52 0.39 Allowed 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.855 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 18' ' ' GLU . . . . . 0.674 ' CD ' ' H ' ' R' ' 18' ' ' GLU . 0.0 OUTLIER -48.57 -27.71 2.95 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.888 1.327 . . . . 0.0 107.779 179.817 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 19' ' ' TRP . . . . . 0.44 ' N ' ' C ' ' R' ' 17' ' ' GLN . 71.8 t-105 -51.62 -60.42 3.18 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 112.912 -1.949 . . . . 0.0 109.127 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -49.5 -31.61 10.47 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.404 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 21' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.3 mmt180 -61.91 -75.68 0.07 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 118.387 -1.325 . . . . 0.0 109.865 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 22' ' ' PHE . . . . . 0.503 ' CD2' HD11 ' S' ' 51' ' ' LEU . 8.7 t80 -36.32 -39.91 0.21 Allowed 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.404 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 23' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' R' ' 25' ' ' LEU . 46.6 t -73.05 -74.39 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.598 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 24' ' ' ASP . . . . . 0.437 ' C ' ' O ' ' R' ' 23' ' ' VAL . 29.8 t70 -37.85 -29.67 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.757 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 25' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' R' ' 23' ' ' VAL . 13.5 tp -70.54 -66.26 0.63 Allowed 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.142 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 26' ' ' LEU . . . . . 0.841 HD21 HG13 ' S' ' 23' ' ' VAL . 5.5 tp -48.11 -56.25 8.27 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.372 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 27' ' ' LYS . . . . . 0.414 ' NZ ' ' CE1' ' S' ' 30' ' ' TYR . 0.1 OUTLIER -41.37 -57.13 2.26 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.256 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -78.35 -5.55 52.52 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.554 -0.858 . . . . 0.0 112.353 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 29' ' ' ALA . . . . . 0.417 ' O ' ' N ' ' R' ' 33' ' ' ASP . . . -83.24 -51.26 7.61 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.829 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 30' ' ' TYR . . . . . 0.418 ' O ' ' N ' ' R' ' 33' ' ' ASP . 24.0 t80 -41.23 -67.3 0.26 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.155 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -45.95 -25.82 0.61 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.653 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 32' ' ' ASN . . . . . 0.518 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 4.7 t-20 -93.19 -23.48 18.55 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.296 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 33' ' ' ASP . . . . . 0.518 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 3.3 t0 85.69 23.09 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 123.695 0.622 . . . . 0.0 111.346 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 34' ' ' LEU . . . . . 0.484 ' N ' ' CD2' ' R' ' 34' ' ' LEU . 0.6 OUTLIER -104.27 -13.37 16.18 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.679 0.752 . . . . 0.0 109.003 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 35' ' ' HIS . . . . . 0.413 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 27.1 p-80 -49.38 -24.88 2.13 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 114.301 -1.318 . . . . 0.0 113.007 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.2 mt -77.83 -64.33 0.42 Allowed Pre-proline 0 N--CA 1.484 1.235 0 C-N-CA 118.081 -1.447 . . . . 0.0 110.893 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 37' ' ' PRO . . . . . 0.525 ' O ' HD13 ' R' ' 41' ' ' LEU . 2.2 Cg_endo -53.83 -23.9 28.95 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 N-CA-C 109.978 -0.816 . . . . 0.0 109.978 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 38' ' ' LEU . . . . . 0.468 HD22 HD21 ' R' ' 25' ' ' LEU . 78.0 mt -83.9 -33.09 24.84 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.155 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 39' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 43' ' ' LEU . 1.0 OUTLIER -56.43 -32.53 64.97 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.814 179.752 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 40' ' ' ASN . . . . . 0.532 ' O ' ' N ' ' R' ' 109' ' ' TRP . 1.0 OUTLIER -81.77 3.52 25.49 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.792 -179.954 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 41' ' ' LEU . . . . . 0.525 HD13 ' O ' ' R' ' 37' ' ' PRO . 4.9 mp -105.6 -65.17 1.08 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.255 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 42' ' ' MET . . . . . 0.512 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -94.65 37.59 1.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.23 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 43' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 39' ' ' LEU . 1.1 tp 179.31 127.06 0.07 Allowed 'General case' 0 N--CA 1.505 2.294 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 44' ' ' THR . . . . . 0.684 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.93 -39.22 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.669 0 C-N-CA 117.639 -1.624 . . . . 0.0 115.251 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 45' ' ' PRO . . . . . 0.684 ' HD2' ' H ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -76.14 -95.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.288 0 C-N-CA 120.814 1.009 . . . . 0.0 112.165 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 46' ' ' ASP . . . . . 0.542 ' O ' ' HB3' ' R' ' 50' ' ' ALA . 0.8 OUTLIER -55.86 -6.89 0.25 Allowed 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 118.804 -1.158 . . . . 0.0 109.454 -179.857 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 47' ' ' GLU . . . . . 0.605 ' OE2' ' CH2' ' S' ' 19' ' ' TRP . 25.2 tt0 -72.11 -79.92 0.07 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.044 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 48' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' R' ' 47' ' ' GLU . 9.7 mmm-85 -43.04 -24.59 0.07 Allowed 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.104 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 49' ' ' GLU . . . . . 0.486 ' N ' ' O ' ' R' ' 47' ' ' GLU . 5.4 mt-10 -88.57 -68.23 0.78 Allowed 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.648 -1.221 . . . . 0.0 111.822 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 50' ' ' ALA . . . . . 0.542 ' HB3' ' O ' ' R' ' 46' ' ' ASP . . . -57.98 -60.55 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 51' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' S' ' 22' ' ' PHE . 2.4 mp -33.48 -62.9 0.27 Allowed 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.439 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.36 -47.38 35.3 Favored Glycine 0 N--CA 1.485 1.929 0 C-N-CA 118.74 -1.695 . . . . 0.0 109.416 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 53' ' ' THR . . . . . 0.523 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -58.99 -81.22 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 54' ' ' ARG . . . . . 0.451 ' HG2' ' H ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -34.04 -60.53 0.39 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.578 -179.802 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.04 -31.08 35.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 C-N-CA 118.136 -1.426 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 56' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' R' ' 53' ' ' THR . 22.2 mtp85 -80.73 -37.25 30.89 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.655 -1.218 . . . . 0.0 112.396 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 57' ' ' ILE . . . . . 0.955 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.45 -31.9 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 C-N-CA 116.801 -1.96 . . . . 0.0 108.297 -179.862 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 58' ' ' VAL . . . . . 0.955 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.7 t -61.96 -60.17 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 118.679 -1.208 . . . . 0.0 109.176 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 59' ' ' GLU . . . . . 0.443 ' N ' HG12 ' R' ' 58' ' ' VAL . 48.1 mt-10 -52.96 -34.88 57.8 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.808 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.73 -45.89 64.04 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.845 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 61' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' R' ' 61' ' ' LEU . 65.5 mt -84.82 0.24 51.54 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.563 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.32 -63.72 1.15 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.699 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 46.0 mtp180 -104.49 7.41 35.32 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.642 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 64' ' ' GLY . . . . . 0.549 ' O ' ' N ' ' R' ' 66' ' ' MET . . . -93.87 27.61 12.36 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.5 -1.04 . . . . 0.0 110.5 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 65' ' ' GLU . . . . . 0.44 ' C ' ' O ' ' R' ' 64' ' ' GLY . 2.0 mt-10 -32.51 -30.63 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.572 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 66' ' ' MET . . . . . 0.549 ' N ' ' O ' ' R' ' 64' ' ' GLY . 7.2 mmt -85.3 98.77 10.71 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.299 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 2.1 t 174.17 80.77 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 119.598 -0.841 . . . . 0.0 109.997 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 68' ' ' GLN . . . . . 0.532 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.2 OUTLIER -114.11 -23.36 9.55 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.651 -179.874 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -73.69 27.22 0.07 Allowed 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.405 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 70' ' ' GLU . . . . . 0.532 ' H ' ' C ' ' R' ' 68' ' ' GLN . 1.3 pt-20 -122.92 25.97 8.36 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.584 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -39.55 159.18 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.477 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 72' ' ' LYS . . . . . 0.444 ' O ' ' CG ' ' R' ' 72' ' ' LYS . 0.1 OUTLIER -44.45 127.4 5.88 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.706 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 73' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' R' ' 75' ' ' LEU . 1.1 t30 -118.33 16.0 13.92 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 122.084 0.945 . . . . 0.0 109.356 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 37.91 19.06 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 113.037 -1.892 . . . . 0.0 112.127 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 75' ' ' LEU . . . . . 0.575 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.9 tp -126.84 -25.47 3.34 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.678 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -89.83 -54.73 2.13 Favored Glycine 0 N--CA 1.489 2.187 0 C-N-CA 119.515 -1.326 . . . . 0.0 110.68 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.73 -102.29 0.11 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.189 -1.004 . . . . 0.0 110.965 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.76 145.23 7.27 Favored Glycine 0 N--CA 1.489 2.222 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.476 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 79' ' ' ILE . . . . . 0.901 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -44.75 -36.38 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.855 179.995 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 80' ' ' ALA . . . . . 0.539 ' O ' ' NH1' ' R' ' 84' ' ' ARG . . . -62.26 -31.44 72.01 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.511 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 81' ' ' THR . . . . . 0.508 ' C ' ' H ' ' R' ' 83' ' ' THR . 0.9 OUTLIER -86.6 -50.94 6.46 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.113 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -63.51 7.53 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.899 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 83' ' ' THR . . . . . 0.508 ' H ' ' C ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -91.54 -79.31 0.38 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.077 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 84' ' ' ARG . . . . . 0.814 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.58 -26.8 23.13 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.348 179.86 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.85 -44.69 81.53 Favored Glycine 0 N--CA 1.488 2.143 0 C-N-CA 119.343 -1.408 . . . . 0.0 109.924 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.23 -49.29 5.8 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.527 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 87' ' ' ASN . . . . . 0.424 ' OD1' ' N ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER -75.81 10.6 1.73 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.655 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 88' ' ' SER . . . . . 0.58 ' O ' ' HB3' ' R' ' 92' ' ' ALA . 0.5 OUTLIER -41.51 -27.29 0.09 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.423 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 89' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' R' ' 87' ' ' ASN . 5.6 mt -61.02 -68.6 0.29 Allowed 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.722 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 90' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' R' ' 91' ' ' ALA . 9.4 mmtp -69.5 -75.37 0.11 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.665 0.745 . . . . 0.0 112.622 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 91' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -30.69 -64.83 0.13 Allowed 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.664 -1.607 . . . . 0.0 112.89 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 92' ' ' ALA . . . . . 0.58 ' HB3' ' O ' ' R' ' 88' ' ' SER . . . -68.23 163.08 55.34 Favored Pre-proline 0 N--CA 1.49 1.527 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.774 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 93' ' ' PRO . . . . . 0.555 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.5 Cg_endo -59.23 131.58 41.91 Favored 'Trans proline' 0 C--N 1.32 -0.936 0 C-N-CA 121.656 1.571 . . . . 0.0 111.868 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 94' ' ' VAL . . . . . 0.448 ' C ' ' H ' ' R' ' 96' ' ' LEU . 96.7 t -78.78 -18.74 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.379 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.73 6.36 1.18 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.504 -0.878 . . . . 0.0 110.484 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 96' ' ' LEU . . . . . 0.448 ' H ' ' C ' ' R' ' 94' ' ' VAL . 2.2 tp -80.12 -33.55 38.57 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.717 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -63.63 -25.56 68.28 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.97 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.17 -26.42 68.32 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.863 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 99' ' ' TRP . . . . . 0.617 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.7 t90 -110.48 -62.36 1.53 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.372 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 100' ' ' LEU . . . . . 0.49 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -40.96 -33.03 0.27 Allowed 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 118.999 -1.08 . . . . 0.0 113.334 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 101' ' ' GLU . . . . . 0.49 ' C ' ' O ' ' R' ' 100' ' ' LEU . 6.7 mm-40 -43.76 -37.92 2.95 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 117.668 -1.613 . . . . 0.0 107.366 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 102' ' ' GLU . . . . . 0.405 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.2 mt-10 -90.81 -27.28 18.97 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.567 -1.651 . . . . 0.0 112.05 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 103' ' ' VAL . . . . . 0.617 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.1 t -93.52 -1.25 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 117.651 -1.62 . . . . 0.0 110.79 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 104' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' R' ' 100' ' ' LEU . 20.1 tp -108.22 -51.47 2.89 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.629 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 105' ' ' LEU . . . . . 0.68 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.4 OUTLIER -78.19 -28.52 48.16 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 118.845 -1.142 . . . . 0.0 111.73 -179.894 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttm -68.33 -21.47 64.74 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 118.937 -1.105 . . . . 0.0 110.583 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.304 -1.38 0 CA-C-O 116.276 -1.821 . . . . 0.0 110.732 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.956 0.408 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 26.6 t -150.16 68.49 8.73 Favored Pre-proline 0 C--N 1.305 -1.362 0 C-N-CA 119.447 -0.901 . . . . 0.0 111.136 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.18 -37.47 31.88 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 121.581 1.52 . . . . 0.0 111.439 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -71.53 151.28 44.01 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.905 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 1.5 p -63.37 -165.36 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.93 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 9' ' ' ALA . . . . . 0.436 ' C ' ' H ' ' S' ' 11' ' ' MET . . . -168.22 40.96 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 119.399 -0.92 . . . . 0.0 110.937 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . 51.16 11.45 0.1 Allowed 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.924 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 11' ' ' MET . . . . . 0.436 ' H ' ' C ' ' S' ' 9' ' ' ALA . 11.8 ptm -69.7 160.46 31.6 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.956 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.43 -60.21 4.06 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 119.521 -0.871 . . . . 0.0 110.927 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -170.85 145.58 2.41 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.756 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 14' ' ' GLN . . . . . 0.527 ' CD ' ' H ' ' S' ' 14' ' ' GLN . 0.0 OUTLIER -74.79 121.64 22.09 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.036 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -140.46 45.71 1.83 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.105 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 16' ' ' HIS . . . . . 0.409 ' H ' ' H ' ' S' ' 17' ' ' GLN . 26.3 t-80 -161.78 -12.54 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.606 -0.837 . . . . 0.0 110.637 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 17' ' ' GLN . . . . . 0.409 ' H ' ' H ' ' S' ' 16' ' ' HIS . 4.3 mt-30 -86.26 -85.69 0.15 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.499 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 18' ' ' GLU . . . . . 0.503 ' N ' ' CD ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -47.28 -33.6 5.77 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.901 -1.12 . . . . 0.0 108.116 179.791 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 19' ' ' TRP . . . . . 0.605 ' CH2' ' OE2' ' R' ' 47' ' ' GLU . 27.7 t-105 -51.34 -61.52 2.19 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.437 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 20' ' ' LEU . . . . . 0.439 ' O ' ' N ' ' S' ' 24' ' ' ASP . 1.3 mt -56.34 -41.72 76.55 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.511 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 21' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' S' ' 22' ' ' PHE . 20.4 mmt180 -44.15 -64.3 0.7 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.523 -1.271 . . . . 0.0 109.64 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 22' ' ' PHE . . . . . 0.549 ' O ' HD13 ' S' ' 26' ' ' LEU . 4.3 t80 -40.27 -40.39 1.13 Allowed 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 119.062 -1.055 . . . . 0.0 109.765 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 23' ' ' VAL . . . . . 0.841 HG13 HD21 ' R' ' 26' ' ' LEU . 45.1 t -80.56 -74.09 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 119.953 -0.699 . . . . 0.0 111.065 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 24' ' ' ASP . . . . . 0.511 ' O ' ' ND2' ' S' ' 28' ' ' ASN . 0.7 OUTLIER -36.63 -32.17 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.097 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 25' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' S' ' 23' ' ' VAL . 63.0 tp -73.54 -49.78 24.72 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.676 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 26' ' ' LEU . . . . . 0.562 HD11 ' CD1' ' S' ' 39' ' ' LEU . 1.4 mp -49.75 -59.78 3.5 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.931 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 27' ' ' LYS . . . . . 0.408 ' O ' ' NE2' ' S' ' 31' ' ' GLN . 0.4 OUTLIER -54.74 -21.39 10.8 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.603 -0.839 . . . . 0.0 113.244 -179.711 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 28' ' ' ASN . . . . . 0.511 ' ND2' ' O ' ' S' ' 24' ' ' ASP . 74.6 m-20 -89.89 -21.15 22.65 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 118.754 -1.179 . . . . 0.0 111.421 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 29' ' ' ALA . . . . . 0.602 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -95.42 -29.8 14.23 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.256 -0.978 . . . . 0.0 111.842 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 30' ' ' TYR . . . . . 0.414 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 6.9 t80 -46.83 -58.26 4.09 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 118.906 -1.118 . . . . 0.0 110.887 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 31' ' ' GLN . . . . . 0.595 ' CD ' ' H ' ' S' ' 31' ' ' GLN . 0.0 OUTLIER -56.6 -18.26 11.36 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.211 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 32' ' ' ASN . . . . . 0.442 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -98.69 -17.38 18.59 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.926 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 33' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.8 OUTLIER 78.73 27.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.608 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 34' ' ' LEU . . . . . 0.602 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.5 mm? -103.9 -13.76 16.25 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.017 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 35' ' ' HIS . . . . . 0.446 ' O ' HD13 ' S' ' 39' ' ' LEU . 24.8 p-80 -51.53 -24.63 5.46 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.387 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 36' ' ' LEU . . . . . 0.485 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.0 mt -70.64 -63.92 1.47 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 117.94 -1.504 . . . . 0.0 110.359 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 37' ' ' PRO . . . . . 0.485 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.6 Cg_endo -52.43 -33.67 57.93 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 120.719 0.946 . . . . 0.0 110.8 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.31 -41.28 63.73 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.02 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 39' ' ' LEU . . . . . 0.562 ' CD1' HD11 ' S' ' 26' ' ' LEU . 0.3 OUTLIER -51.55 -44.62 62.75 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.443 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 40' ' ' ASN . . . . . 0.546 ' O ' ' N ' ' R' ' 1' ' ' TRP . 1.0 OUTLIER -71.86 10.92 0.6 Allowed 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.608 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 41' ' ' LEU . . . . . 0.472 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.2 tp -106.87 -61.68 1.5 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.983 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 42' ' ' MET . . . . . 0.453 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 0.1 OUTLIER -100.16 39.34 1.35 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.196 -179.792 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 43' ' ' LEU . . . . . 0.479 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.3 OUTLIER 163.08 129.88 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 44' ' ' THR . . . . . 0.653 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.3 OUTLIER 178.7 -35.72 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.665 0 C-N-CA 117.469 -1.693 . . . . 0.0 115.298 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 45' ' ' PRO . . . . . 0.653 ' HD2' ' H ' ' S' ' 44' ' ' THR . 18.8 Cg_endo -78.89 -109.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 120.81 1.006 . . . . 0.0 112.793 -179.497 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.57 -15.97 43.7 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.016 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 47' ' ' GLU . . . . . 0.408 ' O ' ' CB ' ' S' ' 51' ' ' LEU . 45.5 mt-10 -70.48 -57.4 4.82 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 119.334 -0.947 . . . . 0.0 110.298 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -55.09 -40.38 70.36 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.724 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.23 -66.14 0.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.147 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 50' ' ' ALA . . . . . 0.815 ' HA ' HG22 ' S' ' 53' ' ' THR . . . -63.13 -33.13 74.81 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.778 -1.169 . . . . 0.0 111.044 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 51' ' ' LEU . . . . . 0.525 ' O ' HG23 ' S' ' 55' ' ' VAL . 1.7 tt -50.42 -28.71 8.69 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 52' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' S' ' 50' ' ' ALA . . . -83.05 -39.14 10.35 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 112.695 -2.048 . . . . 0.0 114.002 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 53' ' ' THR . . . . . 0.815 HG22 ' HA ' ' S' ' 50' ' ' ALA . 0.5 OUTLIER -55.04 -60.46 3.34 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 116.039 -2.264 . . . . 0.0 108.309 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 54' ' ' ARG . . . . . 0.678 ' O ' HG23 ' S' ' 58' ' ' VAL . 3.0 ptp180 -48.56 -45.12 37.25 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.416 -1.314 . . . . 0.0 109.665 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 55' ' ' VAL . . . . . 0.525 HG23 ' O ' ' S' ' 51' ' ' LEU . 97.7 t -67.71 -21.91 27.8 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 C-N-CA 116.949 -1.9 . . . . 0.0 109.125 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 56' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' S' ' 53' ' ' THR . 2.4 ptt180 -83.29 -42.64 16.92 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 118.672 -1.211 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 57' ' ' ILE . . . . . 0.904 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -70.81 -31.93 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 115.99 -2.284 . . . . 0.0 105.745 -179.803 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 58' ' ' VAL . . . . . 0.904 ' N ' HD13 ' S' ' 57' ' ' ILE . 24.4 t -57.64 -63.83 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 118.541 -1.263 . . . . 0.0 108.307 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -43.79 -26.86 0.28 Allowed 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.205 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 60' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' S' ' 60' ' ' GLU . 0.0 OUTLIER -88.36 -32.92 18.14 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.585 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 61' ' ' LEU . . . . . 0.771 HD12 ' O ' ' S' ' 61' ' ' LEU . 0.5 OUTLIER -55.09 -20.79 10.66 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 117.254 -1.779 . . . . 0.0 106.623 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 62' ' ' LEU . . . . . 0.705 ' O ' ' N ' ' S' ' 64' ' ' GLY . 0.6 OUTLIER -78.28 30.14 0.18 Allowed 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.874 -1.512 . . . . 0.0 107.736 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 63' ' ' ARG . . . . . 0.578 ' H ' ' C ' ' S' ' 61' ' ' LEU . 0.4 OUTLIER -30.29 -14.03 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 64' ' ' GLY . . . . . 0.705 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -37.91 -27.96 0.04 OUTLIER Glycine 0 N--CA 1.496 2.696 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 65' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' S' ' 63' ' ' ARG . 31.7 mt-10 -102.66 -63.94 1.12 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.222 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 2.5 ttt -162.88 153.39 16.58 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 118.767 -1.173 . . . . 0.0 112.257 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 67' ' ' SER . . . . . 0.402 ' OG ' ' CB ' ' S' ' 63' ' ' ARG . 1.1 p 171.91 82.53 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 68' ' ' GLN . . . . . 0.486 ' C ' ' H ' ' S' ' 70' ' ' GLU . 6.7 pt20 -115.1 -40.83 3.41 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.932 -1.031 . . . . 0.0 113.402 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.74 28.03 0.05 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.622 -0.831 . . . . 0.0 112.493 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 70' ' ' GLU . . . . . 0.533 ' O ' ' C ' ' S' ' 71' ' ' LEU . 9.2 mm-40 -83.93 -66.46 0.89 Allowed 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.043 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 71' ' ' LEU . . . . . 0.533 ' C ' ' O ' ' S' ' 70' ' ' GLU . 2.0 mp -8.14 116.24 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.21 0 O-C-N 124.743 1.277 . . . . 0.0 112.707 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.68 147.37 0.3 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 73' ' ' ASN . . . . . 0.406 ' HB3' ' H ' ' S' ' 74' ' ' GLU . 0.5 OUTLIER -125.92 -92.13 0.51 Allowed 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.22 -1.355 . . . . 0.0 109.318 179.524 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 74' ' ' GLU . . . . . 0.441 ' HG3' ' H ' ' S' ' 75' ' ' LEU . 0.0 OUTLIER -171.75 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.301 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.87 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 75' ' ' LEU . . . . . 0.441 ' H ' ' HG3' ' S' ' 74' ' ' GLU . 1.7 tm? -112.99 -15.98 12.75 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -46.8 -59.86 5.24 Favored Glycine 0 N--CA 1.479 1.526 0 C-N-CA 119.307 -1.425 . . . . 0.0 109.834 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.0 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 117.443 -1.703 . . . . 0.0 114.714 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.62 134.74 6.75 Favored Glycine 0 N--CA 1.501 2.968 0 N-CA-C 106.717 -2.553 . . . . 0.0 106.717 -179.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 79' ' ' ILE . . . . . 0.564 ' O ' ' N ' ' S' ' 81' ' ' THR . 0.0 OUTLIER -56.97 -34.96 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 C-N-CA 118.397 -1.321 . . . . 0.0 112.95 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 80' ' ' ALA . . . . . 0.495 ' C ' ' O ' ' S' ' 79' ' ' ILE . . . -35.3 -31.08 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.366 -0.934 . . . . 0.0 109.378 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 81' ' ' THR . . . . . 0.564 ' N ' ' O ' ' S' ' 79' ' ' ILE . 0.2 OUTLIER -78.16 -60.39 2.39 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 114.299 -1.318 . . . . 0.0 111.344 179.683 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 82' ' ' ILE . . . . . 0.405 ' H ' HG23 ' S' ' 82' ' ' ILE . 1.5 pt -63.62 -10.91 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.66 -51.02 15.52 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.2 -1.8 . . . . 0.0 109.549 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 84' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 85' ' ' GLY . 1.8 mpt_? -48.93 -70.88 0.08 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.027 0.918 . . . . 0.0 110.669 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 85' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' S' ' 84' ' ' ARG . . . -20.11 -55.84 0.01 OUTLIER Glycine 0 N--CA 1.487 2.073 0 CA-C-N 113.017 -1.901 . . . . 0.0 114.346 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 86' ' ' SER . . . . . 0.572 ' C ' ' H ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -86.39 -61.83 1.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 118.215 -1.394 . . . . 0.0 112.905 -179.776 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -56.73 5.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.235 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 88' ' ' SER . . . . . 0.572 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -52.61 -36.33 56.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.849 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 89' ' ' LEU . . . . . 0.914 ' H ' HD12 ' S' ' 89' ' ' LEU . 2.4 mp -75.46 -54.21 7.41 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.957 -1.097 . . . . 0.0 110.872 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 90' ' ' LYS . . . . . 0.464 ' O ' ' C ' ' S' ' 91' ' ' ALA . 23.8 mttt -45.28 -64.05 0.8 Allowed 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.67 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 91' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' S' ' 92' ' ' ALA . . . -23.76 -66.76 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 113.676 -1.602 . . . . 0.0 112.914 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 92' ' ' ALA . . . . . 0.675 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . 178.39 -51.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.52 0 C-N-CA 118.792 -1.163 . . . . 0.0 113.181 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 93' ' ' PRO . . . . . 0.675 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 5.6 Cg_exo -58.36 97.51 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.829 0 C-N-CA 120.66 0.906 . . . . 0.0 111.807 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 94' ' ' VAL . . . . . 0.457 ' O ' HG12 ' S' ' 94' ' ' VAL . 28.8 t -110.86 -12.4 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -78.14 -28.81 48.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.209 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 96' ' ' LEU . . . . . 0.434 HD22 HD21 ' R' ' 38' ' ' LEU . 71.3 mt -46.55 -33.3 4.0 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.719 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.76 -36.95 85.57 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.771 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -65.31 -31.34 72.42 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.659 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 99' ' ' TRP . . . . . 0.541 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 14.2 t90 -86.8 -58.73 2.49 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.988 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 100' ' ' LEU . . . . . 0.519 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -36.72 -38.29 0.17 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.352 -0.939 . . . . 0.0 112.929 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 101' ' ' GLU . . . . . 0.519 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.8 mt-10 -41.43 -44.82 2.97 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 102' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' S' ' 99' ' ' TRP . 1.8 tt0 -75.8 -33.77 60.15 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.493 -1.685 . . . . 0.0 111.49 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 103' ' ' VAL . . . . . 0.541 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 3.6 t -85.16 -52.63 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 116.881 -1.928 . . . . 0.0 111.707 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' S' S ' 104' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' S' ' 100' ' ' LEU . 0.9 OUTLIER -56.54 -57.3 12.94 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.935 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 95.1 mt -51.13 -68.11 0.2 Allowed 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.445 -1.302 . . . . 0.0 110.473 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mttp -44.85 -56.86 4.16 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.651 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 116.399 -1.762 . . . . 0.0 110.848 179.99 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' R' R ' 1' ' ' TRP . . . . . 0.546 ' N ' ' O ' ' S' ' 40' ' ' ASN . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.286 0 CA-C-O 116.37 -1.776 . . . . 0.0 110.175 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' R' R ' 109' ' ' TRP . . . . . 0.532 ' N ' ' O ' ' R' ' 40' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 116.319 -1.8 . . . . 0.0 110.615 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.072 0.463 . . . . 0.0 111.306 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -144.21 -11.08 0.64 Allowed 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.18 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -90.09 -72.38 0.57 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -49.26 -35.28 17.24 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -51.05 -62.52 1.56 Allowed 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 113.628 -1.624 . . . . 0.0 107.2 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tp -45.79 -38.09 6.76 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 112.938 -1.937 . . . . 0.0 110.316 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' R' ' 22' ' ' PHE . 26.5 mmt180 -55.93 -66.42 0.43 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 117.17 -1.812 . . . . 0.0 107.69 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.454 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -39.35 -43.24 1.15 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.068 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . 0.463 ' O ' ' N ' ' R' ' 26' ' ' LEU . 40.4 t -68.11 -70.67 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 119.384 -0.927 . . . . 0.0 111.108 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' R' ' 23' ' ' VAL . 4.7 t0 -25.98 -48.83 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.19 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.689 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -77.3 -45.71 25.34 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 117.017 -1.873 . . . . 0.0 109.322 -179.923 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . 0.662 ' C ' HD12 ' R' ' 26' ' ' LEU . 0.2 OUTLIER -47.12 -52.74 14.57 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.101 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' R' ' 29' ' ' ALA . 18.4 tptm -66.95 -68.46 0.37 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.103 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -41.86 -20.51 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.241 -0.984 . . . . 0.0 112.071 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.487 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -83.59 -54.22 5.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -43.79 -25.97 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.939 -1.104 . . . . 0.0 110.346 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . 0.413 ' N ' ' C ' ' R' ' 29' ' ' ALA . 2.6 tt0 -50.8 -41.92 57.63 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.548 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -106.1 -72.17 0.72 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.813 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . 0.631 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.7 OUTLIER 170.7 17.43 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.049 -1.06 . . . . 0.0 112.881 -179.746 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . 1.022 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.0 OUTLIER -92.69 -10.53 36.86 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.251 -1.379 . . . . 0.0 110.614 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . 0.444 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 11.0 p-80 -44.47 -30.88 0.94 Allowed 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.446 -0.901 . . . . 0.0 112.929 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.68 -58.11 5.96 Favored Pre-proline 0 N--CA 1.487 1.409 0 C-N-CA 117.884 -1.526 . . . . 0.0 109.906 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.18 -29.98 89.15 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 C-N-CA 119.923 0.415 . . . . 0.0 111.618 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.53 -45.97 34.91 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.694 -0.803 . . . . 0.0 109.283 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 43' ' ' LEU . 0.2 OUTLIER -45.87 -44.15 14.2 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.777 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -70.21 -16.48 63.07 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.16 -179.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tp -78.62 -48.61 14.76 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.738 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.13 47.39 2.42 Favored 'General case' 0 N--CA 1.511 2.593 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.512 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER 173.26 117.47 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.387 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.614 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -35.86 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.513 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.614 ' CD ' ' H ' ' R' ' 44' ' ' THR . 32.9 Cg_endo -80.91 -101.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.363 0 C-N-CA 121.154 1.236 . . . . 0.0 114.197 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -53.44 -18.92 3.02 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.516 ' OE2' ' NH1' ' S' ' 54' ' ' ARG . 0.4 OUTLIER -63.76 -65.74 0.64 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.395 -1.73 . . . . 0.0 109.832 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . 0.461 ' NH2' ' O ' ' S' ' 15' ' ' ARG . 2.7 mmm180 -51.62 -30.56 21.88 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 118.773 -1.171 . . . . 0.0 110.912 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . 0.435 ' O ' ' OG1' ' R' ' 53' ' ' THR . 4.6 mt-10 -82.89 -72.81 0.43 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -62.19 -43.03 99.74 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . 0.678 ' C ' HD12 ' R' ' 51' ' ' LEU . 0.2 OUTLIER -58.51 -46.84 85.92 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 117.986 -1.486 . . . . 0.0 111.248 -179.802 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . 0.413 ' N ' ' HG ' ' R' ' 51' ' ' LEU . . . -53.95 -59.26 10.14 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 107.496 -2.241 . . . . 0.0 107.496 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.528 ' O ' HG23 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -34.3 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.183 -1.008 . . . . 0.0 112.239 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.459 ' O ' HG12 ' R' ' 58' ' ' VAL . 0.0 OUTLIER -41.77 -56.42 2.68 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.644 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 14.9 p -67.01 -18.86 24.87 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 114.956 -2.698 . . . . 0.0 110.548 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' R' ' 60' ' ' GLU . 0.0 OUTLIER -93.02 -29.38 15.85 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 118.016 -1.474 . . . . 0.0 112.418 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 0.67 ' C ' HD12 ' R' ' 57' ' ' ILE . 0.2 OUTLIER -76.31 -41.43 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 115.663 -2.415 . . . . 0.0 106.872 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 0.609 HG13 ' N ' ' R' ' 59' ' ' GLU . 7.3 p -66.33 -52.94 41.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 117.391 -1.724 . . . . 0.0 110.822 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.609 ' N ' HG13 ' R' ' 58' ' ' VAL . 5.7 tt0 -64.03 -12.99 43.57 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.33 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' R' ' 56' ' ' ARG . 3.4 mm-40 -78.97 -52.3 8.44 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.739 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 pp -89.4 -25.85 21.33 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.067 -1.453 . . . . 0.0 111.554 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp . . . . . 0 N--CA 1.486 1.336 0 C-N-CA 118.321 -1.351 . . . . 0.0 110.696 179.997 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.54 1.01 46.76 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.867 -1.159 . . . . 0.0 113.958 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.845 ' H ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -122.11 -72.98 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.824 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.534 ' O ' ' N ' ' R' ' 82' ' ' ILE . . . -102.34 -71.28 0.72 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -37.09 -21.13 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -79.75 -31.26 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 118.118 -1.433 . . . . 0.0 112.389 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.35 19.71 16.14 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . 0.501 HH22 ' CD1' ' S' ' 41' ' ' LEU . 0.1 OUTLIER -93.46 -39.74 10.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 117.575 -1.65 . . . . 0.0 107.804 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . 0.418 ' N ' ' CD ' ' R' ' 84' ' ' ARG . . . -40.57 -24.72 0.08 OUTLIER Glycine 0 N--CA 1.481 1.699 0 CA-C-N 113.48 -1.691 . . . . 0.0 110.561 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . 0.478 ' N ' ' O ' ' R' ' 84' ' ' ARG . 1.8 t -81.48 -70.3 0.55 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.281 -0.968 . . . . 0.0 110.312 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -60.26 -3.59 0.65 Allowed 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.97 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . 0.477 ' HA ' ' HB3' ' R' ' 91' ' ' ALA . 0.6 OUTLIER -48.48 -26.73 2.29 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.98 -1.088 . . . . 0.0 110.698 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -41.18 -42.12 1.98 Allowed 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.957 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.97 -50.26 3.03 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.799 0.809 . . . . 0.0 110.399 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . 0.477 ' HB3' ' HA ' ' R' ' 88' ' ' SER . . . -39.26 -55.34 1.71 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.351 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -63.45 162.77 23.44 Favored Pre-proline 0 N--CA 1.489 1.503 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.814 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 1.5 Cg_endo -56.82 170.04 1.58 Allowed 'Trans proline' 0 C--N 1.316 -1.143 0 C-N-CA 121.02 1.146 . . . . 0.0 111.593 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . 0.445 ' C ' ' H ' ' R' ' 96' ' ' LEU . 79.5 t -93.98 -31.08 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.797 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.47 3.6 0.93 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.894 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . 0.486 HD13 ' HG2' ' R' ' 93' ' ' PRO . 1.3 tp -84.69 -44.93 12.95 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.593 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -59.07 -24.32 62.8 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.764 -0.775 . . . . 0.0 109.543 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -63.25 -40.08 96.41 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.435 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.635 ' CE3' HG21 ' R' ' 103' ' ' VAL . 7.3 t90 -101.2 -60.04 1.59 Allowed 'General case' 0 N--CA 1.512 2.672 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.327 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -43.67 -19.74 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 118.386 -1.325 . . . . 0.0 113.57 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.455 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.2 mm-40 -53.23 -37.13 61.79 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . 0.418 ' N ' ' C ' ' R' ' 100' ' ' LEU . 3.7 mt-10 -86.81 -37.66 17.57 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 111.622 -2.535 . . . . 0.0 114.556 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.635 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.0 t -82.62 -9.53 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 116.08 -2.248 . . . . 0.0 111.69 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 tp -94.37 -56.2 2.9 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.12 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . 0.654 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.4 OUTLIER -68.3 -27.17 66.06 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.847 -1.141 . . . . 0.0 111.548 -179.643 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 27.2 tttp . . . . . 0 N--CA 1.488 1.425 0 C-N-CA 119.111 -1.036 . . . . 0.0 110.438 179.89 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . 0.461 ' O ' ' NH2' ' R' ' 48' ' ' ARG . 4.1 mtt180 . . . . . 0 N--CA 1.488 1.47 0 CA-C-O 120.798 0.333 . . . . 0.0 110.656 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -157.32 -0.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.223 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.444 ' C ' ' N ' ' S' ' 19' ' ' TRP . 6.1 mt-30 -95.4 -83.33 0.36 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.833 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' S' ' 17' ' ' GLN . 9.2 pt-20 -45.22 -30.52 1.23 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . 0.444 ' N ' ' C ' ' S' ' 17' ' ' GLN . 62.4 t-105 -55.89 -64.01 0.99 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.146 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' S' ' 24' ' ' ASP . 6.5 tp -48.14 -36.71 13.92 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.92 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' S' ' 22' ' ' PHE . 17.6 mmt180 -56.53 -67.39 0.31 Allowed 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 117.383 -1.727 . . . . 0.0 106.361 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.459 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -37.55 -47.29 0.91 Allowed 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.58 178.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.433 HG23 ' CD2' ' S' ' 22' ' ' PHE . 48.6 t -74.27 -74.7 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.594 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' S' ' 20' ' ' LEU . 14.3 t0 -37.1 -41.73 0.38 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.596 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.517 HD23 ' SD ' ' S' ' 42' ' ' MET . 58.6 tp -60.62 -53.11 61.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.07 -61.51 2.34 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.361 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 21.8 tptp -39.67 -53.97 2.1 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.047 -0.661 . . . . 0.0 112.572 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -65.97 -25.28 67.03 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.473 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . 0.549 ' HB1' HD13 ' S' ' 34' ' ' LEU . . . -82.99 -48.95 10.08 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.875 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . 0.485 ' CE2' ' NE2' ' S' ' 35' ' ' HIS . 9.4 t80 -42.09 -21.7 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.916 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' S' ' 29' ' ' ALA . 0.9 OUTLIER -69.63 -47.18 64.29 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.926 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.8 OUTLIER -74.72 -27.74 60.5 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.504 -0.879 . . . . 0.0 109.293 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.5 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 1.3 t70 86.49 50.72 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.479 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . 0.58 ' N ' ' CD1' ' S' ' 34' ' ' LEU . 0.0 OUTLIER -136.08 14.62 3.3 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.708 1.242 . . . . 0.0 109.223 179.672 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . 0.485 ' NE2' ' CE2' ' S' ' 30' ' ' TYR . 31.1 p-80 -61.73 -19.15 62.11 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 112.904 -1.953 . . . . 0.0 111.526 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' S' ' 36' ' ' LEU . 7.8 mt -69.61 -59.01 5.09 Favored Pre-proline 0 N--CA 1.483 1.184 0 C-N-CA 118.894 -1.122 . . . . 0.0 109.213 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -54.31 -34.83 81.77 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 N-CA-C 110.115 -0.763 . . . . 0.0 110.115 179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . 0.474 HD22 HD21 ' S' ' 25' ' ' LEU . 19.5 mt -72.13 -40.45 68.07 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 118.991 -1.084 . . . . 0.0 110.523 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.494 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.4 OUTLIER -50.61 -50.8 53.15 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-O 121.523 0.678 . . . . 0.0 109.315 179.644 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . 0.614 ' ND2' HH12 ' S' ' 48' ' ' ARG . 0.7 OUTLIER -56.49 -6.06 0.26 Allowed 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.349 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . 0.501 ' CD1' HH22 ' R' ' 84' ' ' ARG . 1.8 tp -100.43 -67.87 0.84 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.901 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . 0.517 ' SD ' HD23 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -70.6 -3.88 20.43 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.658 -1.217 . . . . 0.0 111.172 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . 0.448 ' O ' ' O ' ' S' ' 39' ' ' LEU . 1.5 mp -157.0 132.91 9.52 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.177 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.597 ' H ' ' CD ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -170.42 -30.45 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 115.916 -2.314 . . . . 0.0 116.407 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.597 ' CD ' ' H ' ' S' ' 44' ' ' THR . 34.1 Cg_endo -99.03 -102.97 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.398 0 CA-C-N 119.277 0.777 . . . . 0.0 113.701 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.44 -16.75 2.48 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 118.142 -1.423 . . . . 0.0 107.831 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . 0.457 ' N ' ' C ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -68.27 -67.48 0.46 Allowed 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.554 -1.203 . . . . 0.0 107.804 179.498 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . 0.614 HH12 ' ND2' ' S' ' 40' ' ' ASN . 0.0 OUTLIER -41.56 -33.81 0.5 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.927 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . 0.441 ' O ' ' OG1' ' S' ' 53' ' ' THR . 4.2 mt-10 -84.79 -67.83 0.77 Allowed 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 119.536 -0.866 . . . . 0.0 113.041 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . 0.574 ' HB1' HH12 ' S' ' 54' ' ' ARG . . . -45.88 -23.67 0.31 Allowed 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.195 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . 0.411 ' C ' ' N ' ' S' ' 53' ' ' THR . 4.2 mp -77.46 -56.74 4.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.086 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -21.63 4.07 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 118.635 -1.745 . . . . 0.0 109.434 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.441 ' OG1' ' O ' ' S' ' 49' ' ' GLU . 0.1 OUTLIER -73.64 -78.67 0.09 Allowed 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 114.173 -1.013 . . . . 0.0 111.007 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.574 HH12 ' HB1' ' S' ' 50' ' ' ALA . 23.3 mtt85 -41.58 -26.99 0.08 Allowed 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.742 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 98.7 t -80.0 -41.5 21.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 C-N-CA 119.022 -1.071 . . . . 0.0 108.845 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' S' ' 53' ' ' THR . 19.7 mtt180 -58.33 -50.61 73.01 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 116.993 -1.883 . . . . 0.0 107.34 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -66.57 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 C-N-CA 117.035 -1.866 . . . . 0.0 111.293 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 52.0 t -42.93 -64.45 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 C-N-CA 118.424 -1.31 . . . . 0.0 113.318 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -48.55 -46.7 39.23 Favored 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.985 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.74 -30.63 70.16 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 119.297 -0.961 . . . . 0.0 112.227 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.15 -27.46 69.39 Favored 'General case' 0 C--N 1.284 -2.252 0 C-N-CA 118.467 -1.293 . . . . 0.0 110.757 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . 0.624 HD13 HD21 ' S' ' 104' ' ' LEU . 4.9 mt -81.87 -62.91 1.5 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 116.479 2.029 . . . . 0.0 116.479 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 . . . . . 0 N--CA 1.504 2.234 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.814 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . 0.788 ' C ' ' H ' ' S' ' 74' ' ' GLU . 14.8 tttt . . . . . 0 N--CA 1.525 3.282 1 N-CA-C 122.063 4.097 . . . . 0.0 122.063 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . 0.26 0.2 OUTLIER -74.1 18.18 0.15 Allowed 'General case' 0 N--CA 1.519 2.989 0 O-C-N 118.418 -2.677 . . . . 0.0 108.844 179.455 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . 0.788 ' H ' ' C ' ' S' ' 72' ' ' LYS 0.363 0.0 OUTLIER 40.81 -51.1 0.0 OUTLIER 'General case' 1 N--CA 1.58 6.033 1 N-CA-C 126.846 5.869 . . . . 0.0 126.846 -171.986 . . . . . . . . 6 4 . 1 . 001 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . 0.501 HD12 ' N ' ' S' ' 76' ' ' GLY . 3.4 pp -91.29 -20.36 21.97 Favored 'General case' 0 C--N 1.267 -2.982 0 CA-C-N 118.796 0.725 . . . . 0.0 112.039 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . 0.501 ' N ' HD12 ' S' ' 75' ' ' LEU . . . -82.18 -16.38 72.03 Favored Glycine 1 N--CA 1.548 6.125 0 CA-C-N 112.728 -2.033 . . . . 0.0 115.106 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -136.72 -69.18 0.47 Allowed 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 115.923 -2.311 . . . . 0.0 113.344 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . 0.439 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 149.12 127.72 1.61 Allowed Glycine 0 CA--C 1.456 -3.644 1 N-CA-C 98.104 -5.999 . . . . 0.0 98.104 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.21 -22.61 27.71 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.211 1 C-N-CA 111.581 -4.047 . . . . 0.0 106.397 -178.572 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.478 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -63.66 -37.32 86.88 Favored 'General case' 0 N--CA 1.511 2.619 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' S' ' 78' ' ' GLY . 9.1 p -53.67 -55.94 21.62 Favored 'General case' 0 C--N 1.297 -1.683 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.296 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . 0.468 HG21 HD13 ' S' ' 82' ' ' ILE 0.37 0.3 OUTLIER -63.28 11.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 117.812 2.523 . . . . 0.0 117.812 -178.761 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -96.55 -62.28 1.29 Allowed 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 118.402 -1.319 . . . . 0.0 108.063 178.686 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -52.34 -23.7 6.34 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 118.357 -1.337 . . . . 0.0 109.006 179.241 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.63 -11.1 59.45 Favored Glycine 0 N--CA 1.498 2.825 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.386 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -100.49 -23.16 14.78 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . 0.514 ' N ' ' ND2' ' S' ' 87' ' ' ASN . 0.6 OUTLIER -105.49 -3.8 22.05 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.573 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . 0.51 ' N ' ' O ' ' S' ' 84' ' ' ARG . 0.2 OUTLIER -62.01 -15.6 45.36 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . 0.462 ' N ' ' C ' ' S' ' 87' ' ' ASN . 3.4 mt -71.72 -78.9 0.08 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.221 -1.809 . . . . 0.0 111.366 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -53.96 -66.61 0.36 Allowed 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.54 0.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 160.04 76.9 Favored Pre-proline 0 N--CA 1.501 2.085 0 C-N-CA 118.482 -1.287 . . . . 0.0 110.359 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -68.27 158.22 58.46 Favored 'Trans proline' 0 C--N 1.324 -0.723 0 N-CA-C 108.29 -1.465 . . . . 0.0 108.29 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' S' ' 96' ' ' LEU . 36.4 t -88.04 -65.12 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.353 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -45.37 -12.39 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 C-N-CA 119.065 -1.054 . . . . 0.0 112.783 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' S' ' 94' ' ' VAL . 0.9 OUTLIER -65.59 -34.95 79.42 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.04 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -54.08 -24.18 16.51 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.559 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -82.81 -28.92 29.9 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 118.516 -1.274 . . . . 0.0 110.814 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.712 ' CE3' HG21 ' S' ' 103' ' ' VAL . 6.2 t90 -90.34 -56.25 3.28 Favored 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.518 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.611 HD12 HD23 ' S' ' 104' ' ' LEU . 1.6 mm? -40.18 -31.58 0.14 Allowed 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 118.954 -1.098 . . . . 0.0 113.829 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.484 ' C ' ' O ' ' S' ' 100' ' ' LEU . 42.5 mt-10 -46.72 -39.7 12.05 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 105.02 -2.215 . . . . 0.0 105.02 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -86.01 -32.76 21.31 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 112.79 -2.004 . . . . 0.0 114.333 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.712 HG21 ' CE3' ' S' ' 99' ' ' TRP . 2.8 t -90.64 -2.43 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 116.64 -2.024 . . . . 0.0 113.125 -179.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . 0.624 HD21 HD13 ' S' ' 62' ' ' LEU . 0.2 OUTLIER -109.06 -49.36 3.14 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.92 -179.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . 0.433 ' N ' ' CD2' ' S' ' 105' ' ' LEU . 3.9 mm? -69.04 -64.2 0.91 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 118.832 -1.147 . . . . 0.0 109.602 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -57.83 10.49 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.646 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 116.371 -1.776 . . . . 0.0 109.858 -179.996 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmm-85 . . . . . 0 N--CA 1.49 1.533 0 CA-C-O 120.702 0.287 . . . . 0.0 110.299 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -147.94 -2.2 0.55 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.934 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.416 ' C ' ' N ' ' R' ' 19' ' ' TRP . 2.7 mt-30 -83.88 -80.24 0.19 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.022 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' R' ' 17' ' ' GLN . 5.3 mt-10 -44.2 -31.5 1.0 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 122.708 1.242 . . . . 0.0 108.666 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . 0.416 ' N ' ' C ' ' R' ' 17' ' ' GLN . 74.7 t-105 -56.82 -61.5 2.39 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.78 -2.009 . . . . 0.0 110.823 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 tt -48.11 -24.89 1.24 Allowed 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.533 ' O ' ' N ' ' R' ' 23' ' ' VAL . 10.1 mmt180 -69.78 -70.61 0.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.017 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.472 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.35 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.318 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . 0.533 ' N ' ' O ' ' R' ' 21' ' ' ARG . 48.9 t -75.22 -55.88 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.323 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -38.64 -52.84 1.65 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.459 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.413 ' N ' HD23 ' R' ' 25' ' ' LEU . 0.5 OUTLIER -64.38 -55.85 18.33 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.698 -1.201 . . . . 0.0 110.432 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . 0.501 HD11 HD11 ' R' ' 39' ' ' LEU . 0.4 OUTLIER -63.54 -7.05 6.04 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.149 -179.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -83.66 -36.15 24.01 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 118.882 -1.127 . . . . 0.0 112.821 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -113.08 -0.14 14.8 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 119.69 -0.804 . . . . 0.0 113.098 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 30' ' ' TYR . . . -80.2 -53.17 6.92 Favored 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 118.884 -1.127 . . . . 0.0 112.647 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . 0.436 ' C ' ' O ' ' R' ' 29' ' ' ALA . 14.8 t80 -30.75 -46.63 0.08 Allowed 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . 0.481 HE21 ' CA ' ' R' ' 31' ' ' GLN . 0.0 OUTLIER -58.7 -52.43 65.71 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.346 -0.942 . . . . 0.0 111.191 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . 0.507 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 15.9 m120 -78.03 -12.14 59.96 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.245 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.9 t70 78.91 36.24 0.18 Allowed 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.233 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -99.48 -15.04 18.83 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.022 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . 0.446 ' O ' HD13 ' R' ' 39' ' ' LEU . 29.4 p-80 -52.42 -31.67 35.4 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.358 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' R' ' 36' ' ' LEU . 5.8 mt -69.95 -61.52 2.88 Favored Pre-proline 0 C--N 1.303 -1.431 0 C-N-CA 117.849 -1.541 . . . . 0.0 111.768 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 1.5 Cg_endo -54.3 -25.44 38.88 Favored 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 120.493 0.795 . . . . 0.0 111.208 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 46.5 mt -85.26 -35.81 21.3 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.123 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.501 HD11 HD11 ' R' ' 26' ' ' LEU . 0.1 OUTLIER -53.91 -36.15 62.42 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.514 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . 0.611 HD22 ' N ' ' R' ' 40' ' ' ASN . 1.7 m120 -73.31 4.57 4.46 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.012 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . 0.437 HD12 HD23 ' R' ' 38' ' ' LEU . 50.3 mt -110.68 -67.32 1.0 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.857 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.0 OUTLIER -83.8 40.29 0.73 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.778 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -154.92 165.84 35.43 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.626 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.651 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.293 0.2 OUTLIER -121.76 -151.69 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.353 -179.785 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.651 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.8 Cg_endo -101.09 -37.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.33 -0.444 0 N-CA-C 109.953 -0.826 . . . . 0.0 109.953 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -26.2 63.8 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.709 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.422 ' O ' ' CB ' ' R' ' 51' ' ' LEU . 4.7 mm-40 -64.46 -51.0 65.27 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -51.73 -38.76 56.65 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 119.141 -1.023 . . . . 0.0 110.327 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . 0.447 ' O ' ' OG1' ' R' ' 53' ' ' THR . 1.2 tt0 -74.66 -67.84 0.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.164 -1.015 . . . . 0.0 112.101 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.505 ' HB1' HH21 ' R' ' 54' ' ' ARG . . . -56.36 -41.35 76.02 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.042 -0.663 . . . . 0.0 112.718 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . 0.422 ' CB ' ' O ' ' R' ' 47' ' ' GLU . 0.9 OUTLIER -53.5 -66.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.67 -44.62 6.89 Favored Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.295 -1.431 . . . . 0.0 109.941 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.546 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -49.02 -80.45 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.964 179.893 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.505 HH21 ' HB1' ' R' ' 50' ' ' ALA . 38.1 mtt-85 -37.53 -34.36 0.09 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.849 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -77.56 -32.62 18.51 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 118.197 -1.401 . . . . 0.0 110.446 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -79.8 -35.47 38.42 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.258 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 0.937 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.84 -36.37 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 117.641 -1.624 . . . . 0.0 108.941 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 0.937 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.3 t -61.76 -61.44 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 118.295 -1.362 . . . . 0.0 109.141 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.508 ' N ' HG12 ' R' ' 58' ' ' VAL . 1.3 mm-40 -45.9 -44.42 14.57 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.813 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -52.93 -52.26 58.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.106 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 65.8 mt -76.4 -1.66 28.06 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.619 -0.832 . . . . 0.0 111.53 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.489 1.478 0 C-N-CA 119.701 -0.799 . . . . 0.0 112.138 179.978 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.796 0.331 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.99 143.09 7.64 Favored Glycine 0 N--CA 1.493 2.464 0 C-N-CA 119.364 -1.398 . . . . 0.0 111.159 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.854 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.47 -42.23 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.226 -179.914 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.471 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.33 -65.98 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.594 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 50.3 m -36.15 -45.82 0.47 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 22.6 pt -72.87 -36.68 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 118.962 -1.095 . . . . 0.0 112.612 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.471 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -52.51 -72.31 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.814 -1.154 . . . . 0.0 111.145 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . 0.416 ' HD2' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -54.89 -14.9 1.62 Allowed 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.486 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.18 -59.48 7.86 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.342 -1.408 . . . . 0.0 110.229 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . 0.471 ' C ' ' H ' ' R' ' 88' ' ' SER . 100.0 p -88.0 -43.88 11.41 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.781 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.64 8.65 0.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.49 -0.884 . . . . 0.0 110.847 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . 0.526 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.4 OUTLIER -68.92 -23.59 64.19 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.622 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . 0.465 ' C ' ' O ' ' R' ' 88' ' ' SER . 10.2 mt -30.87 -34.9 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.69 0.619 . . . . 0.0 112.022 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . 0.526 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -110.14 -64.82 1.22 Allowed 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.63 0.728 . . . . 0.0 111.413 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.23 -37.86 0.06 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.025 -1.443 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.428 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -56.58 159.21 7.04 Favored Pre-proline 0 N--CA 1.49 1.561 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.859 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . 0.428 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 3.1 Cg_exo -59.62 169.55 4.19 Favored 'Trans proline' 0 C--N 1.325 -0.672 0 C-N-CA 121.257 1.304 . . . . 0.0 111.333 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 63.9 t -108.98 -21.43 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.182 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -94.11 -1.15 54.74 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 119.363 -0.935 . . . . 0.0 111.12 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.55 -31.03 12.53 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.879 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -37.65 71.29 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.442 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -66.38 -10.32 42.21 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.311 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.71 ' CE3' HG21 ' R' ' 103' ' ' VAL . 5.9 t90 -97.87 -62.24 1.27 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.553 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.516 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -39.43 -38.09 0.53 Allowed 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.516 ' C ' ' O ' ' R' ' 100' ' ' LEU . 1.1 mm-40 -41.57 -38.61 1.38 Allowed 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 117.928 -1.509 . . . . 0.0 107.806 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -90.6 -27.2 19.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.484 -1.689 . . . . 0.0 112.868 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.71 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.6 t -87.97 -9.19 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 117.26 -1.776 . . . . 0.0 111.023 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -98.61 -52.97 3.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.018 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . 0.48 ' N ' HD22 ' R' ' 105' ' ' LEU . 4.5 mm? -70.29 -68.51 0.42 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.74 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 13.9 tptt . . . . . 0 N--CA 1.487 1.415 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.875 -179.912 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . 0.442 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 121.013 0.435 . . . . 0.0 110.157 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -7.33 0.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.384 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.442 ' H ' ' C ' ' S' ' 15' ' ' ARG . 0.0 OUTLIER -76.89 -86.24 0.05 Allowed 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.775 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -43.24 -34.77 1.24 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.279 1.038 . . . . 0.0 109.176 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -51.97 -57.55 9.13 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 113.815 -1.538 . . . . 0.0 109.075 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mt -59.37 -30.71 68.61 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.105 -1.407 . . . . 0.0 111.493 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.557 ' O ' ' N ' ' S' ' 24' ' ' ASP . 9.0 mmt85 -56.24 -65.23 0.64 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 117.902 -1.519 . . . . 0.0 109.519 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.482 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -36.62 -39.49 0.21 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.076 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 23.0 t -74.2 -36.69 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.136 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.557 ' N ' ' O ' ' S' ' 21' ' ' ARG . 54.7 t0 -58.83 -64.01 1.09 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.577 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.66 -56.03 8.13 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 118.956 -1.098 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.737 ' C ' HD13 ' S' ' 26' ' ' LEU . 2.3 tm? -38.68 -46.4 1.22 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.244 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . 0.428 ' NZ ' ' CE2' ' R' ' 30' ' ' TYR . 26.0 mtmm -66.16 -77.37 0.07 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.523 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -39.13 -47.76 1.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . 0.525 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -69.91 -27.37 64.73 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.641 -0.824 . . . . 0.0 113.132 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -41.31 98.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 118.582 -1.247 . . . . 0.0 111.089 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -50.13 -30.97 12.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.791 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.448 ' O ' ' OD1' ' S' ' 33' ' ' ASP . 87.7 m-20 -101.77 -83.5 0.46 Allowed 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.482 -0.887 . . . . 0.0 111.402 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.463 ' C ' HD22 ' S' ' 34' ' ' LEU . 0.3 OUTLIER 172.74 24.47 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.787 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . 0.761 HD22 ' N ' ' S' ' 34' ' ' LEU . 2.1 mm? -98.07 -13.34 21.07 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -51.15 -18.0 0.78 Allowed 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 119.249 -0.98 . . . . 0.0 111.055 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.476 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.1 mt -78.51 -65.86 0.31 Allowed Pre-proline 0 N--CA 1.482 1.14 0 C-N-CA 118.592 -1.243 . . . . 0.0 110.278 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.476 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 6.1 Cg_exo -49.22 -33.44 28.02 Favored 'Trans proline' 0 C--N 1.318 -1.079 0 N-CA-C 110.161 -0.746 . . . . 0.0 110.161 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.21 -38.59 75.3 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 119.48 -0.888 . . . . 0.0 110.05 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.5 OUTLIER -57.65 -22.55 46.36 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.079 179.655 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.58 15.69 19.2 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.696 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -115.52 -63.85 1.4 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.24 -21.82 61.33 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.704 -1.198 . . . . 0.0 112.532 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . 0.472 HD12 ' H ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -152.84 160.2 43.07 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.854 179.777 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.6 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER 178.93 -41.65 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 118.306 -1.357 . . . . 0.0 114.32 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.6 ' HD2' ' H ' ' S' ' 44' ' ' THR . 10.6 Cg_endo -75.88 -98.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.255 1.303 . . . . 0.0 113.064 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.59 -24.88 1.48 Allowed 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.875 -1.13 . . . . 0.0 110.351 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -59.31 -69.17 0.21 Allowed 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.778 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -29.45 4.48 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.7 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -82.56 -67.88 0.75 Allowed 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 118.759 -1.176 . . . . 0.0 112.203 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.11 -51.09 71.1 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . 0.481 HD12 ' O ' ' R' ' 42' ' ' MET . 3.9 tp -39.47 -58.32 1.28 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.214 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . 0.4 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -53.98 -44.0 72.2 Favored Glycine 0 N--CA 1.492 2.383 0 C-N-CA 119.28 -1.438 . . . . 0.0 109.912 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -47.6 -75.87 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.64 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.66 ' HE ' ' CA ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -48.74 -24.87 1.55 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.437 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -79.06 -27.61 13.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.342 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -81.79 -37.91 26.41 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.307 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 0.804 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -73.61 -35.07 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 117.326 -1.75 . . . . 0.0 107.931 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . 0.804 ' N ' HD13 ' S' ' 57' ' ' ILE . 11.8 t -60.56 -56.02 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 117.925 -1.51 . . . . 0.0 109.292 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.83 -27.06 49.54 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.462 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -71.79 -52.19 18.81 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.017 -1.073 . . . . 0.0 112.821 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -60.74 -24.69 65.91 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 117.738 -1.585 . . . . 0.0 110.269 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . 0.43 ' O ' ' C ' ' S' ' 63' ' ' ARG . 5.3 tp -85.38 25.48 1.02 Allowed 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.539 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . 0.43 ' C ' ' O ' ' S' ' 62' ' ' LEU . 6.6 mtp-105 . . . . . 0 N--CA 1.501 2.1 0 O-C-N 124.696 1.248 . . . . 0.0 114.315 -179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 29.1 tttm . . . . . 0 N--CA 1.489 1.485 0 CA-C-O 120.955 0.407 . . . . 0.0 111.863 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 17.5 m-20 -104.19 -103.06 0.31 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.539 0.685 . . . . 0.0 110.696 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -147.85 -40.67 0.17 Allowed 'General case' 0 C--N 1.28 -2.434 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.816 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.2 tp -130.17 18.97 5.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.484 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -73.58 -57.89 4.8 Favored Glycine 0 N--CA 1.491 2.353 0 C-N-CA 119.577 -1.297 . . . . 0.0 110.89 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.44 -67.31 0.16 Allowed 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.199 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . 0.469 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 152.74 161.64 10.41 Favored Glycine 0 N--CA 1.491 2.333 0 C-N-CA 119.193 -1.48 . . . . 0.0 110.945 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.873 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -65.57 -40.68 88.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 C-N-CA 120.024 -0.671 . . . . 0.0 111.055 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.418 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -67.29 -37.11 82.87 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.274 -0.971 . . . . 0.0 111.617 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' S' ' 78' ' ' GLY . 77.7 p -60.2 -56.42 21.84 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.337 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . 0.421 HD13 HG21 ' S' ' 82' ' ' ILE . 18.5 pt -57.25 -0.63 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.515 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.468 ' C ' ' H ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -98.49 -69.98 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.257 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.68 -3.84 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 118.859 -1.136 . . . . 0.0 110.922 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . 0.468 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -95.69 -22.59 20.74 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.341 -1.409 . . . . 0.0 110.292 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 65.2 p -87.32 -12.83 45.3 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.279 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' S' ' 89' ' ' LEU . 9.2 m120 -102.87 3.72 36.9 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -40.32 -24.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.852 -0.739 . . . . 0.0 111.22 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' S' ' 87' ' ' ASN . 7.3 mt -55.84 -49.58 72.93 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.922 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -103.92 -34.96 8.31 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.092 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.0 -71.42 0.07 Allowed 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.2 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . 0.434 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -70.7 159.22 85.9 Favored Pre-proline 0 N--CA 1.488 1.436 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.351 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . 0.434 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 5.8 Cg_exo -57.12 176.79 0.22 Allowed 'Trans proline' 0 C--N 1.323 -0.791 0 C-N-CA 121.668 1.579 . . . . 0.0 112.038 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . 0.478 ' O ' HG12 ' S' ' 94' ' ' VAL . 65.7 t -96.08 -9.64 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.628 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -77.12 -22.29 52.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.584 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -37.9 79.45 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.847 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 -47.9 82.3 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.747 -0.781 . . . . 0.0 111.439 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -80.2 -8.15 59.3 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.908 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.594 ' CH2' HG21 ' S' ' 103' ' ' VAL . 6.2 t90 -101.37 -65.63 0.96 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 118.925 -1.11 . . . . 0.0 112.398 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.554 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -59.15 -39.9 83.87 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -179.67 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.554 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.0 OUTLIER -40.98 -29.91 0.12 Allowed 'General case' 0 C--N 1.296 -1.748 0 C-N-CA 117.563 -1.655 . . . . 0.0 106.95 179.738 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . 0.545 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 mt-10 -91.88 -24.6 19.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 112.9 -1.955 . . . . 0.0 112.348 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.594 HG21 ' CH2' ' S' ' 99' ' ' TRP . 18.9 t -87.96 -21.19 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 116.536 -2.066 . . . . 0.0 109.833 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tp -86.94 -57.78 2.84 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.949 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.35 -75.09 0.2 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 118.728 -1.189 . . . . 0.0 110.343 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -76.63 47.39 0.49 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.381 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.305 -1.352 0 CA-C-O 116.324 -1.798 . . . . 0.0 110.921 179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' R' ' 17' ' ' GLN . 23.5 ttt180 . . . . . 0 N--CA 1.488 1.472 0 CA-C-O 120.284 0.087 . . . . 0.0 111.145 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -38.74 83.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' R' ' 15' ' ' ARG . 1.5 mt-30 -123.15 -91.42 0.55 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.301 -0.56 . . . . 0.0 109.795 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -57.24 -24.1 52.47 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . 0.4 ' N ' ' C ' ' R' ' 17' ' ' GLN . 9.4 t-105 -59.17 -46.99 86.95 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 112.559 -2.11 . . . . 0.0 106.214 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.0 tp -56.34 -47.22 79.25 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.562 -2.108 . . . . 0.0 110.411 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.0 OUTLIER -47.99 -70.0 0.11 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 119.05 -1.06 . . . . 0.0 110.416 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.5 OUTLIER -27.38 -51.14 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.329 179.675 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . 0.423 HG23 ' H ' ' R' ' 23' ' ' VAL . 1.2 t -68.73 -46.29 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.326 -0.949 . . . . 0.0 110.991 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.504 ' N ' ' O ' ' R' ' 21' ' ' ARG . 64.0 t0 -39.03 -45.37 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.709 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.409 ' HG ' ' H ' ' R' ' 25' ' ' LEU . 1.4 mt -75.88 -34.91 60.0 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.06 -1.056 . . . . 0.0 109.986 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . 0.423 ' N ' ' O ' ' R' ' 23' ' ' VAL . 1.0 OUTLIER -55.57 -31.81 62.49 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.048 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -79.93 -39.53 30.1 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 118.931 -1.108 . . . . 0.0 112.244 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -85.86 -18.18 33.53 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.898 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.423 ' HB1' ' N ' ' R' ' 35' ' ' HIS . . . -82.36 -58.84 2.76 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 118.968 -1.093 . . . . 0.0 111.766 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -45.47 -32.15 2.06 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.596 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' R' ' 31' ' ' GLN . 0.3 OUTLIER -46.79 -40.75 14.22 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.099 -1.04 . . . . 0.0 109.667 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . 0.4 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 63.6 t30 -106.51 -73.53 0.68 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.561 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . 0.4 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.5 OUTLIER 170.6 18.17 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 119.134 -1.026 . . . . 0.0 112.63 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . 0.502 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.9 OUTLIER -88.8 -13.44 39.41 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.05 -1.06 . . . . 0.0 109.19 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . 0.542 ' O ' HD13 ' R' ' 39' ' ' LEU . 46.5 p-80 -51.55 -27.52 11.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.385 -1.279 . . . . 0.0 113.024 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.456 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.9 mt -70.17 -62.52 2.21 Favored Pre-proline 0 N--CA 1.486 1.365 0 C-N-CA 117.872 -1.531 . . . . 0.0 110.815 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.1 Cg_exo -51.63 -25.21 19.34 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 C-N-CA 120.743 0.962 . . . . 0.0 110.667 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 24.5 mt -81.08 -38.83 26.68 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.096 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.542 HD13 ' O ' ' R' ' 35' ' ' HIS . 0.5 OUTLIER -59.94 -21.09 60.7 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.163 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . 0.546 ' O ' ' ND2' ' R' ' 40' ' ' ASN . 0.1 OUTLIER -103.69 11.68 35.68 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.374 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 39.4 tp -107.0 -69.81 0.82 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.635 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . 0.462 ' C ' HD12 ' R' ' 43' ' ' LEU . 1.1 mtt -77.36 7.74 4.97 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 118.121 -1.432 . . . . 0.0 112.81 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . 0.462 HD12 ' C ' ' R' ' 42' ' ' MET . 9.0 mp -116.5 -176.2 2.91 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.513 ' HB ' ' CD ' ' R' ' 45' ' ' PRO 0.275 0.0 OUTLIER -126.2 -153.33 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 118.543 -1.263 . . . . 0.0 109.62 179.996 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.513 ' CD ' ' HB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -97.99 -38.27 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.612 0 CA-C-N 119.95 1.018 . . . . 0.0 111.351 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . 0.439 ' OD1' ' OE1' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -56.42 -18.96 12.84 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.092 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.439 ' OE1' ' OD1' ' R' ' 46' ' ' ASP . 3.6 mp0 -60.67 -71.33 0.14 Allowed 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.327 -0.949 . . . . 0.0 109.727 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -43.67 -44.45 6.44 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.674 -0.81 . . . . 0.0 109.867 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . 0.466 ' O ' ' OG1' ' R' ' 53' ' ' THR . 8.0 mm-40 -56.47 -77.32 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.06 -1.056 . . . . 0.0 111.58 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -66.73 -60.07 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.286 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . 0.542 ' C ' HD23 ' R' ' 51' ' ' LEU . 4.5 tt -34.02 -58.53 0.45 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.122 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.2 -48.09 59.87 Favored Glycine 0 N--CA 1.488 2.11 0 C-N-CA 119.042 -1.551 . . . . 0.0 109.44 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.506 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.3 OUTLIER -48.46 -79.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.895 -0.722 . . . . 0.0 112.453 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.618 ' H ' ' CD ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -39.88 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.826 -179.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' R' ' 53' ' ' THR . 1.5 t -88.43 -30.18 5.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 C-N-CA 118.488 -1.285 . . . . 0.0 111.236 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -76.58 -37.41 56.56 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.146 -1.022 . . . . 0.0 110.163 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 0.476 HG22 ' O ' ' R' ' 53' ' ' THR . 0.1 OUTLIER -76.79 -52.42 17.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 C-N-CA 118.834 -1.147 . . . . 0.0 109.651 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.5 p -51.99 -44.42 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 117.692 -1.603 . . . . 0.0 110.742 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.503 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 1.5 tm-20 -66.73 -29.56 69.57 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.625 -0.83 . . . . 0.0 111.251 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -48.81 20.88 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.985 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 97.8 mt -70.69 -22.69 62.44 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.681 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 6.5 tp . . . . . 0 C--N 1.301 -1.501 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.297 179.94 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.518 0 CA-C-O 121.119 0.485 . . . . 0.0 111.384 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . 0.478 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 171.19 157.8 13.86 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.771 -1.332 . . . . 0.0 109.771 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.76 ' N ' HD13 ' R' ' 79' ' ' ILE . 0.7 OUTLIER -73.56 28.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 C-N-CA 119.754 -0.778 . . . . 0.0 112.51 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.478 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.99 -37.4 5.61 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . 0.487 ' O ' ' N ' ' R' ' 83' ' ' THR . 17.4 p -95.87 -56.44 2.66 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.182 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . 0.409 ' H ' HG23 ' R' ' 82' ' ' ILE . 1.5 pp -47.43 -13.99 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.393 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.487 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -66.25 -80.43 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.642 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . 0.801 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -54.18 -20.5 6.92 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.808 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.99 -46.7 91.05 Favored Glycine 0 N--CA 1.489 2.194 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.101 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -27.95 7.55 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.187 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . 0.607 ' C ' ' H ' ' R' ' 89' ' ' LEU . 1.9 t-20 -88.3 -56.27 3.39 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.793 -1.163 . . . . 0.0 111.446 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . 0.597 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.8 -2.91 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.605 -1.238 . . . . 0.0 110.459 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . 0.749 ' O ' ' N ' ' R' ' 91' ' ' ALA . 1.2 mm? 28.79 32.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.805 1.316 . . . . 0.0 110.929 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' R' ' 88' ' ' SER . 6.9 tptt 20.19 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 114.163 -1.381 . . . . 0.0 113.927 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . 0.749 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -88.13 -3.09 58.93 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.749 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.715 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -70.89 171.13 8.99 Favored Pre-proline 0 N--CA 1.487 1.416 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.83 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . 0.715 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 6.1 Cg_exo -59.33 120.35 8.15 Favored 'Trans proline' 0 C--N 1.324 -0.758 0 C-N-CA 121.112 1.208 . . . . 0.0 111.618 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 43.1 t -60.99 -37.61 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 118.966 -1.094 . . . . 0.0 109.979 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -60.4 -10.05 4.36 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.709 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . 0.53 HD23 ' O ' ' R' ' 96' ' ' LEU . 3.2 tt -72.3 -55.03 7.82 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.678 -0.809 . . . . 0.0 110.074 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . 0.488 ' O ' ' CG ' ' R' ' 101' ' ' GLU . 0.0 OUTLIER -63.13 -12.06 24.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.088 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -80.96 -34.2 33.32 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.049 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.638 ' HE1' ' ND2' ' S' ' 32' ' ' ASN . 46.2 t90 -80.52 -58.84 2.93 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 121.952 0.882 . . . . 0.0 111.129 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.587 ' C ' ' N ' ' R' ' 102' ' ' GLU . 0.3 OUTLIER -70.43 -15.2 62.8 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 117.416 -1.714 . . . . 0.0 115.26 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' R' ' 97' ' ' ARG . 3.0 mm-40 -57.94 -18.71 25.1 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . 0.587 ' N ' ' C ' ' R' ' 100' ' ' LEU . 5.0 mt-10 -99.13 -35.63 9.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 112.378 -2.192 . . . . 0.0 114.195 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.519 HG21 ' CH2' ' R' ' 99' ' ' TRP . 5.1 t -73.55 -14.18 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 113.958 -3.097 . . . . 0.0 108.761 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 2.1 mt -88.65 -58.6 2.49 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.399 179.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 15.8 mt -62.5 -77.87 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.887 -1.125 . . . . 0.0 110.38 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.8 tptm . . . . . 0 C--N 1.302 -1.469 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.718 179.835 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 120.745 0.307 . . . . 0.0 111.446 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.49 15.72 6.55 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.174 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.473 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.5 mp0 -88.58 -90.07 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.906 -0.717 . . . . 0.0 110.461 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -43.45 -26.54 0.21 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.443 1.116 . . . . 0.0 109.198 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . 0.473 ' N ' ' C ' ' S' ' 17' ' ' GLN . 53.9 t-105 -57.11 -60.96 2.82 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 113.114 -1.857 . . . . 0.0 109.724 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 4.9 tp -43.49 -35.35 1.61 Allowed 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.851 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' S' ' 23' ' ' VAL . 29.7 mtt180 -64.01 -71.95 0.16 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.945 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.513 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -25.89 -40.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.461 0.476 . . . . 0.0 111.791 179.604 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.552 ' N ' ' O ' ' S' ' 21' ' ' ARG . 89.4 t -73.65 -71.65 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 C-N-CA 119.959 -0.696 . . . . 0.0 111.718 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.417 ' C ' ' O ' ' S' ' 23' ' ' VAL . 33.1 t70 -28.28 -35.83 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.589 HD12 ' CE ' ' S' ' 42' ' ' MET . 1.5 mt -87.3 -44.07 11.69 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.015 -1.074 . . . . 0.0 111.069 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -57.15 -63.13 1.32 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.156 -1.017 . . . . 0.0 111.74 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -50.55 -49.17 56.7 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -67.46 -35.61 79.53 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.737 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -27.91 69.46 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 118.896 -1.121 . . . . 0.0 111.771 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -51.19 -53.57 33.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 118.694 -1.202 . . . . 0.0 110.519 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.12 -14.82 4.35 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.404 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.638 ' ND2' ' HE1' ' R' ' 99' ' ' TRP . 0.6 OUTLIER -105.43 -17.16 14.52 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.544 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.485 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.7 t0 75.13 25.35 1.35 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.847 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.5 -13.97 17.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.881 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . 0.441 ' O ' HD13 ' S' ' 39' ' ' LEU . 12.2 p-80 -47.11 -19.8 0.14 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.926 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -80.16 -65.71 0.27 Allowed Pre-proline 0 N--CA 1.484 1.254 0 C-N-CA 117.593 -1.643 . . . . 0.0 110.43 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -50.25 -24.52 11.7 Favored 'Trans proline' 0 C--N 1.32 -0.95 0 N-CA-C 110.066 -0.782 . . . . 0.0 110.066 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . 0.51 ' O ' ' SD ' ' S' ' 42' ' ' MET . 73.1 mt -82.5 -39.1 22.91 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.929 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.2 OUTLIER -52.36 -38.26 58.31 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.898 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . 0.434 ' ND2' HH22 ' S' ' 48' ' ' ARG . 0.3 OUTLIER -76.23 13.13 0.97 Allowed 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 118.748 -1.181 . . . . 0.0 110.16 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . 0.417 ' H ' ' C ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER -116.2 -54.9 2.44 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.568 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . 0.589 ' CE ' HD12 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -82.85 -8.02 59.61 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 118.13 -1.428 . . . . 0.0 112.057 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -112.78 173.47 6.36 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.62 HG22 ' HD3' ' S' ' 45' ' ' PRO 0.295 0.3 OUTLIER -129.12 -140.63 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.57 0 CA-C-O 117.37 -1.3 . . . . 0.0 109.497 179.941 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.62 ' HD3' HG22 ' S' ' 44' ' ' THR . 12.1 Cg_endo -98.95 -44.4 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.501 0 CA-C-N 122.282 1.851 . . . . 0.0 111.102 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -23.03 5.49 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.102 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -68.5 -51.01 47.92 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.022 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . 0.434 HH22 ' ND2' ' S' ' 40' ' ' ASN . 4.8 mpt_? -55.76 -46.96 77.76 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.459 -0.792 . . . . 0.0 112.442 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.49 -66.08 0.6 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . 0.486 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -60.32 -61.59 2.49 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . 0.633 ' C ' HD12 ' S' ' 51' ' ' LEU . 0.2 OUTLIER -45.48 -38.11 5.91 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.529 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . 0.41 ' N ' ' HG ' ' S' ' 51' ' ' LEU . . . -63.22 -40.66 99.33 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 108.279 -1.928 . . . . 0.0 108.279 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.531 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -54.74 -73.89 0.05 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.291 -0.954 . . . . 0.0 110.921 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.501 ' CD ' ' H ' ' S' ' 54' ' ' ARG . 1.3 mmt180 -37.43 -39.15 0.28 Allowed 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.262 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.1 t -64.11 -40.86 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 C-N-CA 117.742 -1.583 . . . . 0.0 109.246 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' S' ' 53' ' ' THR . 30.2 mtt180 -62.27 -51.59 67.11 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.691 -1.203 . . . . 0.0 109.325 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 0.494 HG22 HD11 ' S' ' 61' ' ' LEU . 2.0 mt -54.76 -64.96 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.784 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 86.2 t -43.29 -70.68 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.915 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -52.79 -31.13 36.98 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -34.38 64.25 Favored 'General case' 0 C--N 1.308 -1.225 0 C-N-CA 118.238 -1.385 . . . . 0.0 111.438 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . 0.494 HD11 HG22 ' S' ' 57' ' ' ILE . 15.3 mt -75.5 -39.39 58.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.292 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mt -60.04 -31.53 70.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.284 -0.967 . . . . 0.0 110.197 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.442 0 C-N-CA 119.405 -0.918 . . . . 0.0 110.629 179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt . . . . . 0 N--CA 1.493 1.685 0 N-CA-C 111.219 0.081 . . . . 0.0 111.219 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . 0.497 ' O ' ' C ' ' S' ' 74' ' ' GLU . 52.7 t30 -129.09 6.16 5.39 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.292 -0.963 . . . . 0.0 113.405 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 73' ' ' ASN . 2.5 mm-40 -42.77 -46.85 5.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.094 -1.817 . . . . 0.0 106.094 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.3 tp -143.32 24.58 1.76 Allowed 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 112.919 -1.946 . . . . 0.0 108.514 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -127.42 -99.79 1.06 Allowed Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.896 -1.621 . . . . 0.0 113.023 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . 0.418 ' HB2' HG21 ' S' ' 53' ' ' THR . . . -150.59 -67.66 0.19 Allowed 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.062 -1.055 . . . . 0.0 112.765 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.57 160.08 33.11 Favored Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.093 -1.527 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.865 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -61.97 -39.87 85.23 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.273 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.21 -58.48 6.89 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.329 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . 0.457 HG23 ' H ' ' S' ' 81' ' ' THR . 73.1 p -42.2 -59.29 1.84 Allowed 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 34.1 pt -60.14 -3.16 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 119.093 -1.043 . . . . 0.0 112.925 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -107.81 -37.77 6.03 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.749 -0.78 . . . . 0.0 111.396 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.34 19.19 1.0 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.482 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.9 -38.88 2.81 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.595 -1.288 . . . . 0.0 110.424 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -51.55 5.92 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.688 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -79.37 11.18 3.1 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.321 -0.951 . . . . 0.0 110.107 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . 0.441 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.1 OUTLIER -72.9 -31.5 64.71 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.331 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' S' ' 88' ' ' SER . 7.3 mt -34.95 -50.49 0.48 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.539 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -40.01 -66.72 0.28 Allowed 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.576 0.703 . . . . 0.0 112.358 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.27 -46.47 17.71 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.442 -1.253 . . . . 0.0 112.572 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -42.49 153.69 0.3 Allowed Pre-proline 0 N--CA 1.49 1.571 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.252 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -58.26 141.42 96.74 Favored 'Trans proline' 0 C--O 1.216 -0.6 0 C-N-CA 121.53 1.487 . . . . 0.0 112.139 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . 0.671 ' O ' HG12 ' S' ' 94' ' ' VAL . 63.4 t -109.71 11.13 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.087 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -99.21 -0.17 42.02 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.816 -0.753 . . . . 0.0 111.005 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 70.0 mt -101.64 -21.0 14.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.171 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.11 -24.05 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.679 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -101.57 -22.32 14.51 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.88 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.616 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 17.7 t90 -82.13 -60.45 2.22 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.999 -1.081 . . . . 0.0 112.959 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.644 ' HA ' HG23 ' S' ' 103' ' ' VAL . 0.4 OUTLIER -50.41 -36.27 32.12 Favored 'General case' 0 C--N 1.286 -2.188 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.998 -179.493 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.4 mt-10 -40.87 -32.14 0.21 Allowed 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.842 -1.543 . . . . 0.0 107.439 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . 0.527 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -88.56 -28.19 20.9 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.042 -1.89 . . . . 0.0 112.381 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.644 HG23 ' HA ' ' S' ' 100' ' ' LEU . 2.1 t -79.9 -35.91 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 115.233 -2.587 . . . . 0.0 108.331 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.5 -52.68 63.49 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.951 -1.1 . . . . 0.0 108.054 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' S' ' 105' ' ' LEU . 12.7 tp -56.48 -57.08 13.85 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 119.469 -0.892 . . . . 0.0 109.909 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -95.91 80.57 3.34 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.502 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.304 -1.411 0 CA-C-O 116.186 -1.864 . . . . 0.0 111.029 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.019 0.438 . . . . 0.0 110.83 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -103.83 55.91 0.73 Allowed 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.556 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.6 tt0 -113.09 -82.27 0.59 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.272 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.1 OUTLIER -49.52 -21.66 1.02 Allowed 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 123.445 1.593 . . . . 0.0 106.937 179.571 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . 0.556 ' N ' ' C ' ' R' ' 17' ' ' GLN 0.257 43.2 t-105 -55.49 -51.66 66.25 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.607 -2.542 . . . . 0.0 109.042 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.07 -21.95 48.17 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.24 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.475 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.0 mmt85 -71.28 -72.07 0.23 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.354 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.481 ' CD2' HG23 ' R' ' 23' ' ' VAL . 0.0 OUTLIER -35.5 -32.66 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.193 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . 0.481 HG23 ' CD2' ' R' ' 22' ' ' PHE . 89.0 t -81.95 -58.16 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.805 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -34.94 -45.2 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.385 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' R' ' 25' ' ' LEU . 0.7 OUTLIER -82.83 -40.2 20.67 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.726 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . 0.412 ' CD1' HD11 ' R' ' 39' ' ' LEU . 4.8 tp -37.75 -52.63 1.28 Allowed 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.789 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -51.85 28.3 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.615 -1.234 . . . . 0.0 112.501 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -51.02 -31.4 18.13 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.855 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.476 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -83.39 -53.45 5.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.0 -1.08 . . . . 0.0 112.692 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . 0.411 ' O ' ' C ' ' R' ' 31' ' ' GLN . 61.5 t80 -36.51 -51.19 0.82 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' R' ' 30' ' ' TYR . 1.9 tt0 -38.45 -35.69 0.19 Allowed 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.576 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -101.77 -80.82 0.5 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.796 -0.762 . . . . 0.0 110.638 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 168.35 35.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.689 0.757 . . . . 0.0 109.106 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . 0.421 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 2.1 mm? -100.86 -19.3 16.0 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.434 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . 0.406 ' CG ' ' N ' ' R' ' 36' ' ' LEU . 6.3 p-80 -48.09 -41.2 25.61 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 114.842 -1.072 . . . . 0.0 112.754 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.1 mt -58.06 -64.07 3.18 Favored Pre-proline 0 C--N 1.302 -1.494 0 C-N-CA 117.988 -1.485 . . . . 0.0 111.146 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.9 Cg_endo -56.35 -17.26 20.46 Favored 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.955 1.103 . . . . 0.0 111.27 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.82 -56.46 3.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.099 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.446 ' C ' ' N ' ' R' ' 41' ' ' LEU . 2.6 mm? -51.71 -33.78 35.93 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 117.988 -1.485 . . . . 0.0 108.049 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -12.94 0.07 Allowed 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.058 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . 0.446 ' N ' ' C ' ' R' ' 39' ' ' LEU . 11.6 mt -112.0 -58.01 2.19 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 120.0 -0.68 . . . . 0.0 111.349 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . 0.498 ' N ' ' SD ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -87.03 39.11 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 118.235 -1.386 . . . . 0.0 110.279 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -160.48 170.62 20.58 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.275 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.487 ' HB ' ' CD ' ' R' ' 45' ' ' PRO 0.314 0.1 OUTLIER -132.86 -153.68 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.619 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.817 -179.955 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.487 ' CD ' ' HB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -95.21 -40.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.217 -0.531 0 N-CA-C 110.01 -0.804 . . . . 0.0 110.01 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -58.93 -34.19 71.45 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.111 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.47 ' N ' ' OE1' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -63.23 -48.06 79.86 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.945 179.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -37.94 28.94 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.016 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -77.64 -73.27 0.31 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.972 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.42 -48.03 37.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.906 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -61.69 1.59 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.176 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.57 -44.95 68.26 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 119.69 -1.243 . . . . 0.0 111.451 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.482 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.1 OUTLIER -52.57 -83.42 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.61 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 10.1 mtt85 -42.33 -21.77 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.798 -179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . 0.643 HG22 ' HB3' ' S' ' 42' ' ' MET . 2.3 t -82.04 -40.61 17.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.027 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' R' ' 60' ' ' GLU . 0.0 OUTLIER -81.4 -30.93 33.45 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 118.594 -1.242 . . . . 0.0 112.825 -179.599 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 0.411 HG21 HD13 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -78.66 -42.51 25.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 C-N-CA 118.007 -1.477 . . . . 0.0 109.228 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 0.535 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.9 p -62.1 -49.42 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.68 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.535 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 3.9 pt-20 -66.91 -28.15 68.07 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 117.93 -1.508 . . . . 0.0 111.351 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . 0.402 ' HG3' HH11 ' R' ' 56' ' ' ARG . 17.2 mm-40 -72.18 -44.9 62.32 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 119.067 -1.053 . . . . 0.0 112.253 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 40.0 mt -82.61 -7.15 59.66 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.497 -1.281 . . . . 0.0 111.983 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp . . . . . 0 N--CA 1.49 1.551 0 C-N-CA 118.708 -1.197 . . . . 0.0 110.871 179.837 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.517 0 CA-C-O 120.849 0.357 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . 0.52 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 178.09 155.82 15.14 Favored Glycine 0 N--CA 1.488 2.165 0 C-N-CA 119.527 -1.32 . . . . 0.0 110.557 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.773 ' N ' HD13 ' R' ' 79' ' ' ILE . 0.8 OUTLIER -71.48 25.63 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 C-N-CA 119.887 -0.725 . . . . 0.0 112.168 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.52 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.2 -39.69 5.17 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . 0.465 ' O ' ' N ' ' R' ' 83' ' ' THR . 18.2 p -94.91 -61.16 1.54 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.857 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . 0.414 ' C ' HD12 ' R' ' 82' ' ' ILE . 1.8 pp -43.43 -22.29 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 119.319 -0.953 . . . . 0.0 110.998 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.465 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -60.24 -81.98 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.036 -179.922 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . 0.836 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -50.12 -26.01 4.06 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 118.738 -1.185 . . . . 0.0 110.015 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.95 -47.37 19.65 Favored Glycine 0 N--CA 1.486 1.981 0 C-N-CA 119.493 -1.337 . . . . 0.0 110.307 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.51 -56.18 2.43 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.103 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . 0.611 ' C ' ' H ' ' R' ' 89' ' ' LEU . 2.5 m-80 -43.41 -49.82 7.01 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.656 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . 0.61 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.78 -1.05 0.5 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.377 -1.329 . . . . 0.0 109.954 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . 0.744 ' O ' ' N ' ' R' ' 91' ' ' ALA . 0.3 OUTLIER 27.59 33.37 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.172 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' R' ' 88' ' ' SER . 5.1 tptp 21.52 25.85 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 CA-C-N 114.249 -1.341 . . . . 0.0 113.404 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . 0.744 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -79.9 -20.65 45.33 Favored 'General case' 0 C--N 1.286 -2.171 0 C-N-CA 117.133 -1.827 . . . . 0.0 111.03 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.487 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -61.12 161.02 18.21 Favored Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.93 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . 0.487 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.9 Cg_endo -58.31 168.48 3.76 Favored 'Trans proline' 0 C--N 1.323 -0.8 0 C-N-CA 121.543 1.495 . . . . 0.0 111.525 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 12.5 t -91.46 -24.03 5.66 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.532 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.26 -9.23 38.56 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.515 -0.874 . . . . 0.0 110.996 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . 0.432 HD23 HD23 ' R' ' 100' ' ' LEU . 0.5 OUTLIER -66.33 -47.65 72.83 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.806 -0.758 . . . . 0.0 111.463 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -31.55 68.48 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.229 -0.989 . . . . 0.0 111.157 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -73.99 -19.69 60.57 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.206 -0.998 . . . . 0.0 111.298 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.66 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 1.8 t90 -96.14 -70.22 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.311 -0.955 . . . . 0.0 112.629 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.586 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.1 mm? -36.6 -52.35 0.87 Allowed 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.586 ' C ' ' O ' ' R' ' 100' ' ' LEU . 47.9 mt-10 -33.85 -42.06 0.11 Allowed 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.087 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' R' ' 100' ' ' LEU . 0.4 OUTLIER -85.17 -29.74 24.51 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 113.455 -1.702 . . . . 0.0 112.874 -179.949 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.66 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 4.7 t -80.79 -35.97 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 116.603 -2.039 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.37 -58.38 3.8 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 4.7 mt -47.51 -70.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 118.642 -1.223 . . . . 0.0 111.533 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? . . . . . 0 N--CA 1.489 1.513 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.993 -179.917 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 120.987 0.422 . . . . 0.0 110.944 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . 0.451 ' O ' ' CG ' ' S' ' 16' ' ' HIS . 58.1 t-80 -142.68 12.69 1.9 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.926 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.449 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.3 mt-30 -88.94 -83.92 0.22 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.928 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.478 ' H ' ' HG3' ' S' ' 18' ' ' GLU . 24.5 mt-10 -43.58 -32.74 1.0 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . 0.449 ' N ' ' C ' ' S' ' 17' ' ' GLN . 65.2 t-105 -48.5 -56.33 8.59 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 112.881 -1.963 . . . . 0.0 109.65 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.48 -35.9 42.05 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 113.693 -1.594 . . . . 0.0 111.679 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.559 ' O ' ' C ' ' S' ' 22' ' ' PHE . 50.4 mtt-85 -63.35 -73.24 0.12 Allowed 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.566 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.637 ' CE1' HD12 ' S' ' 26' ' ' LEU . 1.5 t80 -24.92 -50.68 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.643 0.735 . . . . 0.0 111.34 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.414 ' O ' ' C ' ' S' ' 24' ' ' ASP . 24.8 t -70.56 -46.78 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.787 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' S' ' 21' ' ' ARG . 16.8 t0 -36.64 -62.95 0.44 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.919 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.426 ' H ' ' HG ' ' S' ' 25' ' ' LEU . 0.3 OUTLIER -64.0 -49.88 70.7 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 118.658 -1.217 . . . . 0.0 110.391 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.637 HD12 ' CE1' ' S' ' 22' ' ' PHE . 0.7 OUTLIER -40.1 -63.27 0.63 Allowed 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.879 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -57.04 6.39 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.404 -0.918 . . . . 0.0 112.606 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -64.36 -16.84 63.02 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.099 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' S' ' 31' ' ' GLN . . . -90.36 -47.9 7.46 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 118.933 -1.107 . . . . 0.0 112.491 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . 0.413 ' C ' ' O ' ' S' ' 29' ' ' ALA . 0.4 OUTLIER -40.19 -26.8 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.376 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.3 tt0 -75.71 -37.93 59.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.384 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 18.1 t-20 -95.1 -8.33 36.85 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.6 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.5 t0 84.71 23.05 0.1 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 123.626 0.579 . . . . 0.0 110.794 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.88 -16.46 31.88 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.025 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . 0.476 ' O ' HD22 ' S' ' 39' ' ' LEU . 26.4 p-80 -54.95 -25.3 28.6 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 113.97 -1.468 . . . . 0.0 113.018 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 5.6 mt -70.75 -63.34 1.63 Allowed Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.417 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.7 Cg_endo -54.61 -36.54 89.6 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 C-N-CA 120.636 0.89 . . . . 0.0 111.57 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . 0.511 ' O ' ' SD ' ' S' ' 42' ' ' MET . 19.7 mt -74.8 -37.52 62.33 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.656 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.476 HD22 ' O ' ' S' ' 35' ' ' HIS . 0.1 OUTLIER -53.07 -38.31 62.4 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.384 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -76.27 7.62 4.12 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.95 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.57 -55.62 2.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.724 -0.79 . . . . 0.0 112.457 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . 0.643 ' HB3' HG22 ' R' ' 55' ' ' VAL . 0.0 OUTLIER -78.67 6.38 8.96 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 118.496 -1.282 . . . . 0.0 111.474 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 68.6 mt -127.38 -175.62 3.5 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.68 HG22 ' HD3' ' S' ' 45' ' ' PRO 0.299 0.3 OUTLIER -129.23 -147.34 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.364 0 C-N-CA 118.681 -1.207 . . . . 0.0 109.51 -179.91 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.68 ' HD3' HG22 ' S' ' 44' ' ' THR . 8.0 Cg_endo -96.55 -42.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.218 -0.492 0 CA-C-N 120.147 1.088 . . . . 0.0 110.566 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -52.27 -29.94 25.48 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.891 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -59.92 -54.21 48.8 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.645 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.1 -39.82 60.37 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.471 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . 0.431 ' O ' ' OG1' ' S' ' 53' ' ' THR . 85.6 mt-10 -82.34 -68.65 0.68 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.831 -1.148 . . . . 0.0 112.49 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -49.68 -50.01 45.25 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . 0.662 ' C ' HD12 ' S' ' 51' ' ' LEU . 0.4 OUTLIER -60.08 -40.97 91.43 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 118.155 -1.418 . . . . 0.0 110.7 -179.947 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . 0.463 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -61.4 -30.96 75.65 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.518 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -65.16 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 114.748 -0.726 . . . . 0.0 110.733 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -41.35 -24.11 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . 0.485 ' N ' ' O ' ' S' ' 53' ' ' THR . 12.9 t -71.42 -44.28 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 117.957 -1.497 . . . . 0.0 107.627 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.3 OUTLIER -59.55 -48.65 80.81 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.997 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 mt -57.44 -63.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.968 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 79.5 t -46.5 -59.92 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 C-N-CA 118.243 -1.383 . . . . 0.0 111.467 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -61.02 -18.8 59.75 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.502 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -79.95 -39.38 30.32 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.657 -1.217 . . . . 0.0 111.002 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.15 -29.7 64.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.95 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.97 -66.59 0.36 Allowed 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 118.981 -1.088 . . . . 0.0 109.719 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.305 -1.366 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 1.1 tptm . . . . . 0 N--CA 1.497 1.877 0 N-CA-C 109.992 -0.373 . . . . 0.0 109.992 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' S' ' 77' ' ' ALA . 14.4 t-20 -107.74 6.51 27.69 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.319 -0.952 . . . . 0.0 112.281 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . 0.482 ' C ' ' O ' ' S' ' 73' ' ' ASN . 1.4 mt-10 -44.99 -44.67 10.09 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 tp -145.0 21.4 1.59 Allowed 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.929 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -129.94 -100.02 0.9 Allowed Glycine 0 N--CA 1.499 2.841 0 C-N-CA 118.829 -1.653 . . . . 0.0 112.96 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . 0.52 ' O ' ' ND2' ' S' ' 73' ' ' ASN . . . -147.29 -59.34 0.27 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.202 -0.999 . . . . 0.0 112.688 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 179.24 161.06 26.09 Favored Glycine 0 N--CA 1.491 2.331 0 C-N-CA 118.666 -1.731 . . . . 0.0 111.593 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.937 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -59.73 -28.69 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 115.093 -0.554 . . . . 0.0 111.249 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.448 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.38 -55.29 16.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.508 -0.877 . . . . 0.0 113.248 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . 0.428 HG23 ' H ' ' S' ' 81' ' ' THR . 80.9 p -46.52 -51.61 15.03 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . 0.409 ' H ' HG23 ' S' ' 82' ' ' ILE . 7.3 pt -70.81 11.47 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 C-N-CA 119.165 -1.014 . . . . 0.0 113.304 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -120.9 -46.48 2.34 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.062 179.89 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . 0.482 ' C ' ' H ' ' S' ' 86' ' ' SER . 3.0 ptm180 -63.89 -23.02 67.19 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.974 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.55 -4.9 1.54 Allowed Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.217 -1.468 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . 0.482 ' H ' ' C ' ' S' ' 84' ' ' ARG . 1.0 OUTLIER -157.24 -12.92 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.542 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -92.91 -22.6 19.14 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.72 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . 0.414 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.4 OUTLIER -75.85 -37.51 58.91 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.58 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' S' ' 88' ' ' SER . 26.4 mt -37.62 -43.7 0.64 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 120.229 -0.589 . . . . 0.0 111.844 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -42.66 -64.3 0.64 Allowed 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.47 15.69 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.825 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . 0.624 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -59.28 164.84 4.38 Favored Pre-proline 0 N--CA 1.489 1.492 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.035 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . 0.624 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 21.4 Cg_exo -45.55 133.39 12.99 Favored 'Trans proline' 0 C--N 1.321 -0.913 0 C-N-CA 121.871 1.714 . . . . 0.0 112.49 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 4.1 t -108.92 -5.25 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.251 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.94 -7.16 1.58 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.932 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 2.7 mt -75.8 -32.96 60.1 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.716 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -37.47 72.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.456 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -72.47 -30.47 64.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.051 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.544 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 16.7 t90 -88.2 -61.77 1.64 Allowed 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.657 ' HA ' HG23 ' S' ' 103' ' ' VAL . 0.3 OUTLIER -52.36 -32.61 39.23 Favored 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 115.435 1.642 . . . . 0.0 115.435 -179.64 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' S' ' 100' ' ' LEU . 0.4 OUTLIER -43.78 -27.95 0.38 Allowed 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 117.751 -1.58 . . . . 0.0 106.953 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . 0.526 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.8 mt-10 -94.98 -28.24 15.24 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.122 -1.853 . . . . 0.0 112.942 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.657 HG23 ' HA ' ' S' ' 100' ' ' LEU . 2.1 t -77.65 -28.65 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 114.893 -2.723 . . . . 0.0 108.322 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.66 -56.82 4.32 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.458 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 6.5 mt -60.78 -69.42 0.23 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.709 -1.196 . . . . 0.0 110.957 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' S' ' 107' ' ' SER . 1.7 ttmm -96.86 162.38 13.44 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.406 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . 0.466 ' N ' ' CG ' ' S' ' 106' ' ' LYS . 81.8 p . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 116.243 -1.837 . . . . 0.0 110.844 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 . . . . . 0 N--CA 1.49 1.529 0 CA-C-O 121.296 0.57 . . . . 0.0 111.374 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . 0.424 ' H ' ' H ' ' R' ' 17' ' ' GLN . 0.9 OUTLIER -157.1 -4.74 0.1 Allowed 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.076 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.424 ' H ' ' H ' ' R' ' 16' ' ' HIS . 1.1 mt-30 -91.42 -85.56 0.23 Allowed 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.231 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . 0.436 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.5 OUTLIER -45.52 -33.96 3.02 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 123.106 1.431 . . . . 0.0 107.66 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -52.71 -58.55 6.46 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 112.925 -1.943 . . . . 0.0 108.175 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.68 -28.66 65.96 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.695 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.535 ' O ' ' C ' ' R' ' 22' ' ' PHE . 10.4 mmt-85 -56.3 -68.02 0.25 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 117.885 -1.526 . . . . 0.0 110.144 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.535 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -33.3 -40.09 0.06 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.049 179.613 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . 0.428 ' N ' ' O ' ' R' ' 21' ' ' ARG . 14.9 t -72.05 -47.47 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 C-N-CA 119.469 -0.893 . . . . 0.0 110.44 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' R' ' 21' ' ' ARG . 36.0 t70 -45.5 -21.34 0.09 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.241 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 -43.37 6.36 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.994 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 tt -47.74 -38.0 14.46 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.325 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttp -76.64 -38.55 54.46 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -82.88 -2.2 54.17 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.113 -1.035 . . . . 0.0 113.63 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.478 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -115.47 -30.97 6.06 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.144 -1.022 . . . . 0.0 113.426 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -44.01 -38.95 3.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.111 -1.035 . . . . 0.0 112.164 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.76 -29.71 58.9 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.524 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.5 m-20 -87.86 -11.32 48.14 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 118.981 -1.088 . . . . 0.0 111.377 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 2.5 t70 81.19 24.69 0.27 Allowed 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.773 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . 0.478 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 1.7 mm? -95.7 -22.15 17.73 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.821 0.82 . . . . 0.0 109.828 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . 0.425 ' O ' HD13 ' R' ' 39' ' ' LEU . 37.9 p-80 -52.82 -18.26 1.79 Allowed 'General case' 0 C--N 1.295 -1.804 0 CA-C-N 114.227 -1.352 . . . . 0.0 113.068 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.474 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.5 mt -78.82 -65.69 0.31 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 118.503 -1.279 . . . . 0.0 111.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.474 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.1 Cg_endo -50.93 -28.13 23.0 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 120.541 0.828 . . . . 0.0 110.227 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 7.2 mt -82.54 -34.83 27.72 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 119.354 -0.939 . . . . 0.0 111.482 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -58.14 -26.36 62.58 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.775 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.87 15.28 8.67 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 118.825 -1.15 . . . . 0.0 109.204 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . 0.55 HD23 HH21 ' S' ' 54' ' ' ARG . 1.8 tp -114.2 -63.6 1.43 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.376 -0.829 . . . . 0.0 113.007 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.6 OUTLIER -62.56 7.46 0.07 Allowed 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 117.443 -1.703 . . . . 0.0 112.253 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' R' ' 41' ' ' LEU . 2.3 pp -150.95 -177.25 5.9 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.389 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.6 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.312 0.3 OUTLIER -119.04 -150.82 0.01 OUTLIER Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.327 -179.846 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.6 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.6 Cg_endo -93.37 -42.69 0.03 OUTLIER 'Trans proline' 0 C--O 1.213 -0.745 0 CA-C-N 119.228 0.76 . . . . 0.0 110.614 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.35 -21.98 6.64 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.391 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.5 ' HG3' ' H ' ' R' ' 44' ' ' THR . 2.3 mt-10 -76.71 -41.89 43.48 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.018 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -62.63 -30.43 71.35 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.63 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -73.6 -62.97 1.3 Allowed 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.915 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.489 ' C ' HH21 ' R' ' 54' ' ' ARG . . . -52.73 -31.37 37.52 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.574 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.0 mt -56.36 -61.27 2.52 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.97 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.28 -53.37 9.47 Favored Glycine 0 N--CA 1.484 1.843 0 C-N-CA 119.119 -1.515 . . . . 0.0 110.009 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.48 ' O ' HG22 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -39.71 -80.1 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.559 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.489 HH21 ' C ' ' R' ' 50' ' ' ALA . 20.7 mtt180 -38.11 -53.74 1.39 Allowed 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.51 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 5.8 t -63.21 -31.18 51.77 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.75 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.95 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -78.67 -33.59 46.94 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.161 -1.416 . . . . 0.0 111.468 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 0.798 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -82.67 -34.99 12.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 117.754 -1.578 . . . . 0.0 108.264 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 0.798 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.6 t -59.61 -53.49 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.419 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -58.65 -46.84 86.26 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.012 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -48.36 -31.1 5.65 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.768 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 96.3 mt -96.92 -24.68 15.73 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.189 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp . . . . . 0 N--CA 1.489 1.524 0 C-N-CA 119.365 -0.934 . . . . 0.0 111.484 -179.991 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.273 0 CA-C-O 120.763 0.315 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -178.66 155.46 16.52 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 119.221 -1.466 . . . . 0.0 110.723 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.794 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -46.74 -47.67 7.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.466 -179.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.423 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -59.83 -62.15 2.09 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 118.768 -1.173 . . . . 0.0 110.637 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 43.9 m -39.23 -47.76 1.7 Allowed 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 pt -77.32 -13.11 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.48 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -87.72 -58.94 2.39 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.607 -1.237 . . . . 0.0 112.099 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.92 6.6 0.35 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.362 -179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . 0.482 ' HA3' HD11 ' R' ' 57' ' ' ILE . . . -102.51 -33.82 4.35 Favored Glycine 0 N--CA 1.492 2.378 0 C-N-CA 119.69 -1.243 . . . . 0.0 110.412 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 1.5 t -83.07 -30.59 27.9 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.477 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -93.63 8.42 40.94 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.956 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.41 -27.26 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.29 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 90.2 mt -44.11 -28.09 0.46 Allowed 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.202 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . 0.409 ' O ' ' C ' ' R' ' 91' ' ' ALA . 18.3 mttt -80.9 -71.45 0.47 Allowed 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.309 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -36.72 -63.18 0.43 Allowed 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.163 -1.38 . . . . 0.0 111.959 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -40.72 109.06 0.59 Allowed Pre-proline 0 N--CA 1.488 1.438 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.915 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -55.92 156.41 19.68 Favored 'Trans proline' 0 C--O 1.215 -0.629 0 C-N-CA 120.667 0.911 . . . . 0.0 111.83 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.5 -41.41 90.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.38 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -66.44 -27.93 68.2 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.803 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -39.05 83.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.545 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -27.83 63.39 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.467 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.31 -22.37 57.74 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.104 -1.039 . . . . 0.0 109.96 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.699 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 2.9 t90 -95.56 -66.48 0.91 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.509 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.2 mm? -41.16 -38.01 1.0 Allowed 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.509 ' C ' ' O ' ' R' ' 100' ' ' LEU . 7.3 mt-10 -41.31 -39.16 1.33 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 117.874 -1.53 . . . . 0.0 107.702 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . 0.403 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.1 mt-10 -90.01 -27.63 19.63 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 113.428 -1.715 . . . . 0.0 112.427 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.699 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.3 t -89.05 -7.94 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 117.361 -1.736 . . . . 0.0 110.746 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 8.6 tp -97.93 -54.03 3.21 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.507 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -69.28 -68.3 0.41 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 118.76 -1.176 . . . . 0.0 110.765 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 2.7 tttp . . . . . 0 N--CA 1.487 1.376 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.91 -179.967 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 120.963 0.411 . . . . 0.0 110.392 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.23 -25.17 0.06 Allowed 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.326 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.429 ' O ' ' C ' ' S' ' 18' ' ' GLU . 0.3 OUTLIER -85.53 -69.57 0.65 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.693 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.429 ' C ' ' O ' ' S' ' 17' ' ' GLN . 3.3 mp0 -43.55 -41.39 4.47 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 123.133 1.444 . . . . 0.0 107.862 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.265 42.3 t-105 -52.73 -53.72 43.79 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 111.958 -2.383 . . . . 0.0 108.899 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.11 -37.54 72.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 113.8 -1.545 . . . . 0.0 110.759 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.507 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.6 mmt180 -51.0 -70.75 0.08 Allowed 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 118.283 -1.367 . . . . 0.0 109.28 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.507 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.53 -42.93 0.06 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.333 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 3.6 t -81.6 -33.15 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.119 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.498 ' N ' ' O ' ' S' ' 21' ' ' ARG . 55.6 t0 -53.42 -34.64 58.58 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 120.075 -0.65 . . . . 0.0 112.273 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.96 -44.55 7.65 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.664 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.73 HD21 HD22 ' S' ' 39' ' ' LEU . 0.1 OUTLIER -45.01 -49.5 11.27 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.298 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.95 -71.18 0.07 Allowed 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.37 -0.932 . . . . 0.0 112.743 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.19 -5.86 1.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.791 -0.764 . . . . 0.0 113.054 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.55 -46.16 7.09 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.712 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -45.71 -52.5 10.84 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.618 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -42.0 -30.72 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.849 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.43 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 56.5 m-20 -99.5 -84.72 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 119.625 -0.83 . . . . 0.0 110.658 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.553 ' H ' HD22 ' S' ' 34' ' ' LEU . 0.5 OUTLIER 170.95 23.43 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 119.253 -0.979 . . . . 0.0 112.151 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . 0.848 HD22 ' N ' ' S' ' 34' ' ' LEU . 1.3 mm? -94.43 -14.63 25.03 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.0 -1.08 . . . . 0.0 109.856 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . 0.688 ' O ' HD23 ' S' ' 39' ' ' LEU . 38.4 p-80 -48.76 -28.56 3.72 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.735 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.453 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.8 mt -72.74 -63.33 1.14 Allowed Pre-proline 0 C--N 1.303 -1.439 0 C-N-CA 118.285 -1.366 . . . . 0.0 111.419 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -52.28 -21.62 13.75 Favored 'Trans proline' 0 C--N 1.321 -0.882 0 C-N-CA 121.088 1.192 . . . . 0.0 111.376 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 23.5 mt -86.12 -44.51 12.18 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.73 HD22 HD21 ' S' ' 26' ' ' LEU . 0.9 OUTLIER -49.39 -45.55 46.25 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.12 -1.032 . . . . 0.0 109.858 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.87 -4.0 0.89 Allowed 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.618 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 mp -103.66 -59.25 1.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.091 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . 0.48 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -95.64 22.66 6.9 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.586 -179.805 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.1 OUTLIER -169.39 123.85 0.81 Allowed 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.586 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.75 -41.54 0.0 OUTLIER Pre-proline 0 N--CA 1.484 1.261 0 C-N-CA 117.084 -1.846 . . . . 0.0 114.855 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.586 ' HD2' ' H ' ' S' ' 44' ' ' THR . 19.1 Cg_endo -79.43 -109.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 121.12 1.213 . . . . 0.0 113.196 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . 0.444 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 2.3 m-20 -50.66 -12.8 0.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.488 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . 0.473 ' N ' ' C ' ' S' ' 45' ' ' PRO . 8.9 mm-40 -75.94 -71.82 0.36 Allowed 'General case' 0 C--N 1.297 -1.676 0 C-N-CA 119.544 -0.862 . . . . 0.0 110.582 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -49.55 -15.43 0.16 Allowed 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.894 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' C ' ' S' ' 47' ' ' GLU . 9.8 mm-40 -91.45 -69.11 0.75 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.433 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.04 -27.69 69.28 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.211 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.54 -63.59 1.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.629 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . 0.436 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -45.72 -48.15 13.05 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.013 -1.635 . . . . 0.0 109.013 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.509 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -45.43 -74.54 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.616 0.722 . . . . 0.0 111.86 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.55 HH21 HD23 ' R' ' 41' ' ' LEU . 0.0 OUTLIER -35.24 -58.99 0.54 Allowed 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.71 -1.132 . . . . 0.0 112.873 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 16.1 t -59.62 -25.28 31.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 C-N-CA 117.465 -1.694 . . . . 0.0 110.971 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -79.3 -38.72 34.63 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.296 -1.362 . . . . 0.0 111.443 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 0.751 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -79.08 -34.65 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 117.801 -1.56 . . . . 0.0 108.827 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . 0.751 ' N ' HD13 ' S' ' 57' ' ' ILE . 78.1 t -68.68 -63.11 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.183 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -50.19 -31.14 13.02 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.412 -1.315 . . . . 0.0 110.193 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . 0.415 ' CG ' ' O ' ' S' ' 56' ' ' ARG . 7.7 mm-40 -62.12 -62.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.551 -0.86 . . . . 0.0 112.089 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . 0.501 ' C ' HD12 ' S' ' 61' ' ' LEU . 4.6 pp -62.45 -8.63 6.46 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 117.738 -1.585 . . . . 0.0 109.716 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . 0.421 ' O ' ' C ' ' S' ' 63' ' ' ARG . 2.3 tp -79.97 33.02 0.27 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.717 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . 0.488 ' H ' ' C ' ' S' ' 61' ' ' LEU . 19.7 mtm180 . . . . . 0 N--CA 1.499 1.979 0 O-C-N 124.555 1.16 . . . . 0.0 113.736 -179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.489 1.492 0 CA-C-O 121.108 0.48 . . . . 0.0 111.249 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -99.2 -103.13 0.22 Allowed 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.83 0.824 . . . . 0.0 110.839 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -140.61 -56.97 0.52 Allowed 'General case' 0 C--N 1.283 -2.3 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.139 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 tp -121.01 13.37 11.32 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.25 -55.83 27.98 Favored Glycine 0 N--CA 1.492 2.416 0 C-N-CA 119.816 -1.183 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -163.71 -68.98 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.984 -1.087 . . . . 0.0 111.225 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . 149.38 131.18 1.93 Allowed Glycine 0 N--CA 1.488 2.134 0 C-N-CA 119.372 -1.394 . . . . 0.0 110.371 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.901 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.78 -36.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.237 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.91 -44.26 73.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.583 -0.847 . . . . 0.0 112.314 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 25.3 p -62.54 -40.9 98.29 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 pt -73.35 -15.07 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 119.344 -0.943 . . . . 0.0 112.758 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.434 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -81.51 -57.21 3.57 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.492 -1.283 . . . . 0.0 111.391 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -68.68 -4.55 16.11 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.008 -1.077 . . . . 0.0 110.747 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.86 -25.55 60.0 Favored Glycine 0 N--CA 1.488 2.104 0 C-N-CA 119.321 -1.418 . . . . 0.0 110.124 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 41.8 p -105.94 -34.91 7.46 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.657 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' S' ' 89' ' ' LEU . 24.3 m120 -77.0 12.99 1.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.909 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -38.71 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.294 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' S' ' 87' ' ' ASN . 1.0 OUTLIER -42.02 -66.37 0.36 Allowed 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.646 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.49 -62.09 1.78 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.687 -1.205 . . . . 0.0 111.669 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.35 -70.85 0.09 Allowed 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.168 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.64 148.54 90.19 Favored Pre-proline 0 N--CA 1.489 1.498 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.908 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -55.0 159.54 9.38 Favored 'Trans proline' 0 C--N 1.325 -0.667 0 C-N-CA 121.066 1.177 . . . . 0.0 110.996 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -83.24 -32.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.917 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -67.46 -20.95 65.55 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.648 -0.821 . . . . 0.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 1.2 tp -62.02 -36.35 81.29 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.576 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -16.29 38.75 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.256 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -101.49 -35.47 9.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.234 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.625 ' CH2' HG21 ' S' ' 103' ' ' VAL . 19.6 t90 -66.6 -62.29 1.53 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.911 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.529 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -57.07 -32.57 66.39 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -179.711 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.529 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.9 mm-40 -42.77 -29.65 0.33 Allowed 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 117.692 -1.603 . . . . 0.0 106.746 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . 0.528 ' N ' ' C ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -94.99 -26.41 16.11 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.987 -1.915 . . . . 0.0 112.157 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.625 HG21 ' CH2' ' S' ' 99' ' ' TRP . 14.0 t -83.28 -14.83 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 C-N-CA 115.964 -2.294 . . . . 0.0 108.102 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . 0.404 ' HA ' HD12 ' S' ' 104' ' ' LEU . 19.9 tp -83.56 -53.48 5.64 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.203 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 86.4 mt -77.8 -80.03 0.11 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' S' ' 102' ' ' GLU . 16.2 mtpt -95.51 -160.05 0.76 Allowed 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.166 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' S' ' 102' ' ' GLU . 65.5 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 116.445 -1.74 . . . . 0.0 111.533 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 120.894 0.378 . . . . 0.0 110.152 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . 0.464 ' O ' ' CG ' ' R' ' 16' ' ' HIS . 22.1 t-80 -111.62 6.74 20.18 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.6 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' R' ' 18' ' ' GLU . 1.0 OUTLIER -91.05 -80.19 0.35 Allowed 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.358 -0.937 . . . . 0.0 111.36 -179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.0 OUTLIER -44.33 -35.06 2.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 123.231 1.491 . . . . 0.0 107.824 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -52.69 -61.34 2.35 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 112.33 -2.214 . . . . 0.0 109.16 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -47.11 -44.4 21.37 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.459 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 1.0 OUTLIER -47.77 -73.1 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 118.645 -1.222 . . . . 0.0 109.639 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -25.45 -47.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.156 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . 0.435 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.5 t -71.14 -53.32 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 118.956 -1.097 . . . . 0.0 111.478 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 32.9 t0 -35.68 -65.19 0.26 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.647 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.11 -48.43 70.75 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.13 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.37 -46.44 62.76 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.545 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -61.6 -45.0 95.96 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 -74.73 -36.02 62.66 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.473 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -70.25 -29.26 66.02 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.622 -1.231 . . . . 0.0 113.077 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . 0.429 ' CD2' ' N ' ' R' ' 31' ' ' GLN . 23.7 t80 -42.01 -60.25 1.48 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.005 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . 0.429 ' N ' ' CD2' ' R' ' 30' ' ' TYR . 1.8 tt0 -60.43 -28.84 68.6 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.084 -1.046 . . . . 0.0 110.703 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . 0.436 ' OD1' ' NE1' ' S' ' 99' ' ' TRP . 0.2 OUTLIER -80.78 -15.86 55.32 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.534 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 74.15 23.98 2.02 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.949 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.82 -10.52 20.65 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 114.724 -1.125 . . . . 0.0 108.712 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -53.77 -15.57 1.33 Allowed 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.225 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -77.75 -65.4 0.36 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 117.544 -1.663 . . . . 0.0 110.662 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.8 Cg_exo -50.19 -31.76 29.99 Favored 'Trans proline' 0 C--N 1.321 -0.889 0 N-CA-C 109.686 -0.929 . . . . 0.0 109.686 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 5.6 mt -73.39 -40.41 64.35 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.443 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -60.01 -22.5 62.68 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.205 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -91.53 11.48 23.98 Favored 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.513 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.19 -64.22 1.35 Allowed 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.933 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . 0.489 ' SD ' ' O ' ' R' ' 22' ' ' PHE . 3.4 ptp -73.71 8.96 1.62 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 117.369 -1.732 . . . . 0.0 112.246 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 65.5 mt -128.77 -174.07 3.15 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.647 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.306 0.3 OUTLIER -134.97 -145.12 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 119.093 -1.043 . . . . 0.0 109.305 179.908 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.647 ' HD3' HG22 ' R' ' 44' ' ' THR . 10.2 Cg_endo -98.62 -43.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.554 0 CA-C-N 120.614 1.255 . . . . 0.0 111.16 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.53 -27.45 38.51 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.208 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.417 ' CG ' ' H ' ' R' ' 44' ' ' THR . 5.1 mm-40 -61.56 -49.8 75.19 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.983 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.98 -34.72 66.01 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.927 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -75.56 -71.46 0.37 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.127 -1.029 . . . . 0.0 112.521 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.445 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.88 -46.49 51.7 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.304 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 tt -52.68 -45.09 66.65 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.776 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.74 -42.04 97.79 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 118.91 -1.614 . . . . 0.0 109.302 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.5 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.3 OUTLIER -49.55 -78.91 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.835 -0.682 . . . . 0.0 112.022 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.1 -37.06 0.8 Allowed 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.088 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 33.3 t -72.31 -34.24 48.55 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.593 -1.243 . . . . 0.0 110.227 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.1 OUTLIER -73.42 -38.31 65.6 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.553 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 0.994 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -77.19 -39.86 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 117.577 -1.649 . . . . 0.0 109.631 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 0.994 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.2 t -63.21 -68.76 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 117.438 -1.705 . . . . 0.0 109.325 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.522 ' N ' HG12 ' R' ' 58' ' ' VAL . 16.7 tt0 -43.16 -36.27 1.65 Allowed 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.956 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -65.67 -54.32 29.07 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 118.971 -1.091 . . . . 0.0 112.109 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 34.7 mt -78.88 -6.31 55.8 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.439 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 5.1 tp . . . . . 0 N--CA 1.491 1.617 0 C-N-CA 119.621 -0.831 . . . . 0.0 110.981 -179.948 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.912 0.387 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.16 131.99 2.08 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 119.43 -1.367 . . . . 0.0 110.295 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.827 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -45.34 -44.54 3.62 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.258 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.41 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -64.9 -62.95 1.25 Allowed 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 118.797 -1.161 . . . . 0.0 109.678 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 23.0 m -33.85 -49.23 0.32 Allowed 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.938 -1.028 . . . . 0.0 113.092 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . 0.438 HD13 HG21 ' R' ' 82' ' ' ILE . 30.3 pt -73.73 -34.85 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 119.006 -1.078 . . . . 0.0 113.014 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.529 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.1 OUTLIER -55.55 -67.42 0.28 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.715 -1.194 . . . . 0.0 110.83 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -6.62 1.0 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.889 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.5 -48.42 36.7 Favored Glycine 0 N--CA 1.489 2.184 0 C-N-CA 119.414 -1.375 . . . . 0.0 110.3 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.68 -7.53 54.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.718 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.2 OUTLIER -109.89 12.91 23.69 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.99 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -41.36 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.767 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . 0.468 ' N ' ' O ' ' R' ' 87' ' ' ASN . 4.2 mt -50.85 -33.82 25.42 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.737 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.39 -19.26 18.59 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.264 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.46 -62.81 1.42 Allowed 'General case' 0 C--N 1.291 -1.942 0 C-N-CA 118.976 -1.09 . . . . 0.0 112.31 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.612 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -99.95 164.98 15.42 Favored Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.305 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . 0.612 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 4.0 Cg_exo -58.83 171.87 1.86 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 C-N-CA 121.465 1.443 . . . . 0.0 111.611 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . 0.521 ' O ' HG12 ' R' ' 94' ' ' VAL . 75.3 t -82.11 -8.91 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 119.386 -0.926 . . . . 0.0 110.787 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -65.37 -30.36 71.18 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.598 -0.841 . . . . 0.0 111.049 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . 0.483 ' HG ' HD23 ' R' ' 100' ' ' LEU . 0.7 OUTLIER -60.71 -44.09 97.02 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.718 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.53 -44.89 26.16 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.17 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -73.03 -24.22 60.7 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.348 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.587 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 3.6 t90 -92.04 -66.19 0.95 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.158 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.483 HD23 ' HG ' ' R' ' 96' ' ' LEU . 2.1 mm? -43.17 -28.07 0.27 Allowed 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 118.729 -1.188 . . . . 0.0 112.865 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.456 ' C ' ' O ' ' R' ' 100' ' ' LEU . 3.5 mt-10 -46.98 -38.81 11.31 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 117.491 -1.684 . . . . 0.0 106.823 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -90.67 -30.9 16.85 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.908 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.587 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.5 t -85.88 -12.37 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 C-N-CA 117.331 -1.747 . . . . 0.0 111.224 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' R' ' 104' ' ' LEU . 18.8 tp -96.98 -55.3 2.91 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.625 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . 0.493 ' N ' HD22 ' R' ' 105' ' ' LEU . 4.0 mm? -72.49 -74.55 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.923 -1.111 . . . . 0.0 111.32 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 11.0 ttpt . . . . . 0 N--CA 1.486 1.35 0 C-N-CA 119.513 -0.875 . . . . 0.0 110.955 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.435 0 CA-C-O 121.308 0.575 . . . . 0.0 111.157 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . 0.401 ' H ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER -171.34 -4.07 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' S' ' 18' ' ' GLU . 8.7 tt0 -82.01 -86.01 0.1 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.051 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' S' ' 17' ' ' GLN . 1.0 OUTLIER -40.43 -34.83 0.37 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 122.648 1.213 . . . . 0.0 109.156 179.789 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -51.26 -60.91 2.61 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.041 -1.891 . . . . 0.0 110.457 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.32 -31.97 35.75 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.645 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.506 ' O ' ' C ' ' S' ' 22' ' ' PHE . 11.7 mmm-85 -59.68 -71.56 0.12 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.506 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.1 t80 -32.74 -50.47 0.26 Allowed 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 119.341 -0.944 . . . . 0.0 111.096 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.31 -44.81 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.427 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.419 ' O ' ' C ' ' S' ' 25' ' ' LEU . 25.7 t0 -48.14 -75.88 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.651 -0.82 . . . . 0.0 111.609 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.419 ' C ' ' O ' ' S' ' 24' ' ' ASP . 1.2 mt -39.91 -44.78 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.756 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.557 HD21 ' CD1' ' S' ' 39' ' ' LEU . 0.2 OUTLIER -54.41 -57.39 11.49 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.01 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.75 -49.86 0.8 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -85.59 -32.62 21.99 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 118.922 -1.111 . . . . 0.0 113.355 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . 0.463 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -66.75 -39.85 88.08 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.072 -1.051 . . . . 0.0 112.541 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -58.21 -38.32 76.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.93 -1.108 . . . . 0.0 112.028 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.0 -21.79 4.89 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 118.712 -1.195 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.46 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 35.3 m120 -111.57 -76.27 0.6 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.829 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.0 OUTLIER 172.06 1.28 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 118.644 -1.222 . . . . 0.0 113.02 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . 0.978 HD22 ' H ' ' S' ' 34' ' ' LEU . 0.9 OUTLIER -75.01 -18.51 60.35 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.609 -0.836 . . . . 0.0 111.558 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -51.12 -22.68 2.63 Favored 'General case' 0 C--N 1.293 -1.866 0 C-N-CA 119.494 -0.882 . . . . 0.0 112.746 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.467 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.4 mt -73.35 -64.03 0.89 Allowed Pre-proline 0 N--CA 1.486 1.338 0 C-N-CA 118.327 -1.349 . . . . 0.0 110.234 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.467 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -53.45 -32.73 64.09 Favored 'Trans proline' 0 C--N 1.322 -0.864 0 C-N-CA 120.769 0.979 . . . . 0.0 110.455 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . 0.421 HD21 HD21 ' R' ' 96' ' ' LEU . 21.8 mt -74.12 -39.7 63.17 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.19 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.557 ' CD1' HD21 ' S' ' 26' ' ' LEU . 0.2 OUTLIER -52.97 -44.2 66.98 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.332 179.802 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.1 OUTLIER -66.94 -0.92 3.44 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.536 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 tp -105.32 -67.36 0.92 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.623 -0.831 . . . . 0.0 112.964 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 2.0 mmm -91.04 47.6 1.42 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 118.761 -1.175 . . . . 0.0 111.624 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . 0.848 HD23 ' O ' ' S' ' 43' ' ' LEU . 0.3 OUTLIER 160.72 125.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.641 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -179.33 -41.86 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.376 0 C-N-CA 116.507 -2.077 . . . . 0.0 115.794 -179.694 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.641 ' HD2' ' H ' ' S' ' 44' ' ' THR . 5.5 Cg_endo -65.71 -110.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 120.713 0.942 . . . . 0.0 113.343 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . 0.483 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 0.2 OUTLIER -54.91 -12.14 0.76 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 119.029 -1.068 . . . . 0.0 110.361 -179.735 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . 0.428 ' N ' ' C ' ' S' ' 45' ' ' PRO . 6.4 mm-40 -68.17 -64.39 0.87 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.607 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -57.82 -33.45 68.62 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.255 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -70.41 -63.12 1.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.21 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.09 -37.52 83.01 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.336 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 mt -46.74 -57.57 4.72 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 118.64 -1.224 . . . . 0.0 109.293 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' S' ' 53' ' ' THR . . . -52.2 -64.96 3.57 Favored Glycine 0 N--CA 1.484 1.852 0 N-CA-C 108.486 -1.846 . . . . 0.0 108.486 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.574 ' O ' HG22 ' S' ' 57' ' ' ILE . 0.2 OUTLIER -34.85 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.641 0.734 . . . . 0.0 112.78 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.4 ' CD ' ' HA ' ' R' ' 42' ' ' MET . 8.1 ttp85 -51.57 -46.11 63.31 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.376 -1.284 . . . . 0.0 113.393 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 95.1 t -68.95 -19.08 23.61 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 C-N-CA 117.473 -1.691 . . . . 0.0 109.918 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.411 ' CD ' ' C ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -85.62 -37.06 19.93 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.542 -1.263 . . . . 0.0 110.804 -179.958 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 0.738 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -74.54 -38.38 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 117.429 -1.708 . . . . 0.0 107.902 179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . 0.738 ' N ' HD13 ' S' ' 57' ' ' ILE . 0.9 OUTLIER -60.43 -50.95 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 117.156 -1.817 . . . . 0.0 107.399 179.452 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . 0.446 ' N ' HG12 ' S' ' 58' ' ' VAL . 3.4 tt0 -51.7 -31.88 27.82 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.092 179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -68.99 -57.58 5.28 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 118.98 -1.088 . . . . 0.0 112.178 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . 0.646 ' C ' HD12 ' S' ' 61' ' ' LEU . 3.6 pp -61.43 -7.47 3.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.912 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . 0.604 ' N ' HD12 ' S' ' 61' ' ' LEU . 7.0 tp -76.13 28.88 0.12 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 119.494 -0.882 . . . . 0.0 110.586 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . 0.514 ' H ' ' C ' ' S' ' 61' ' ' LEU . 3.9 mtm180 . . . . . 0 N--CA 1.5 2.075 0 O-C-N 124.361 1.038 . . . . 0.0 113.625 -179.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.5 tttm . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.012 0.434 . . . . 0.0 110.913 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -81.2 -102.93 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.76 0.79 . . . . 0.0 110.7 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -141.87 -65.63 0.42 Allowed 'General case' 0 C--N 1.279 -2.482 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.505 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 mp -82.42 5.96 18.76 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.684 -0.807 . . . . 0.0 109.162 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . 0.504 ' O ' ' HB2' ' S' ' 77' ' ' ALA . . . -68.87 -56.13 9.85 Favored Glycine 0 N--CA 1.488 2.106 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.196 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . 0.504 ' HB2' ' O ' ' S' ' 76' ' ' GLY . . . 175.54 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.004 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 175.79 167.89 35.36 Favored Glycine 0 N--CA 1.493 2.443 0 C-N-CA 119.363 -1.399 . . . . 0.0 110.823 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.808 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -62.77 -43.52 98.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.234 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -58.25 -53.83 53.82 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.234 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . 0.406 HG21 ' HB1' ' S' ' 77' ' ' ALA . 0.5 OUTLIER -43.14 -60.49 1.64 Allowed 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.786 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . 0.417 HG21 HD13 ' S' ' 82' ' ' ILE . 15.8 pt -68.46 10.47 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -106.7 -45.42 4.22 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.982 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . 0.46 ' NH1' ' HB1' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -74.4 -32.79 62.82 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.785 -1.166 . . . . 0.0 111.489 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.27 -45.59 90.41 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 119.242 -1.456 . . . . 0.0 110.23 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.45 -29.48 69.62 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.169 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . 0.523 ' O ' ' N ' ' S' ' 89' ' ' LEU . 1.2 m-20 -100.8 15.91 26.83 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.6 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . 0.406 ' C ' ' O ' ' S' ' 87' ' ' ASN . 0.5 OUTLIER -37.85 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 120.249 -0.581 . . . . 0.0 112.004 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . 0.523 ' N ' ' O ' ' S' ' 87' ' ' ASN . 11.8 mt -57.38 -54.65 44.42 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.392 -0.923 . . . . 0.0 111.298 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -94.83 -35.27 12.14 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.689 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.01 -49.12 72.31 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.602 -1.181 . . . . 0.0 112.498 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . 0.77 ' HB3' HH22 ' S' ' 97' ' ' ARG . . . -86.53 163.74 40.54 Favored Pre-proline 0 N--CA 1.489 1.516 0 C-N-CA 119.164 -1.014 . . . . 0.0 111.598 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . 0.596 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 3.0 Cg_exo -53.67 175.96 0.1 Allowed 'Trans proline' 0 C--N 1.324 -0.732 0 C-N-CA 121.546 1.497 . . . . 0.0 111.429 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -108.55 -33.67 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.291 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.65 3.29 29.5 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.186 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -31.25 24.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.798 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . 0.77 HH22 ' HB3' ' S' ' 92' ' ' ALA . 0.0 OUTLIER -63.8 -23.05 67.21 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.014 -1.074 . . . . 0.0 110.259 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -78.07 -14.34 59.53 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.033 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.747 ' CH2' HG21 ' S' ' 103' ' ' VAL . 21.4 t90 -107.36 -59.09 1.87 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.019 0.914 . . . . 0.0 111.513 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.524 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.7 OUTLIER -58.61 -34.04 70.69 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.517 ' C ' ' O ' ' S' ' 100' ' ' LEU . 5.0 mt-10 -43.3 -32.2 0.76 Allowed 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 117.29 -1.764 . . . . 0.0 106.571 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . 0.524 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.7 mt-10 -89.97 -23.78 21.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 112.637 -2.074 . . . . 0.0 112.437 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.747 HG21 ' CH2' ' S' ' 99' ' ' TRP . 21.9 t -88.17 -22.73 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 C-N-CA 116.255 -2.178 . . . . 0.0 109.975 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . 0.563 HD21 HD11 ' S' ' 62' ' ' LEU . 21.6 tp -81.29 -55.23 4.86 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.032 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mt -57.87 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 118.325 -1.35 . . . . 0.0 110.274 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' S' ' 102' ' ' GLU . 0.4 OUTLIER -112.07 -177.83 3.27 Favored 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.512 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 116.417 -1.754 . . . . 0.0 110.838 179.955 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 . . . . . 0 N--CA 1.483 1.222 0 CA-C-O 120.821 0.343 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -71.13 63.29 0.33 Allowed 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.057 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.51 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.2 mt-30 -115.12 -76.86 0.57 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -55.4 -17.93 5.88 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 123.55 1.643 . . . . 0.0 106.666 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . 0.51 ' N ' ' C ' ' R' ' 17' ' ' GLN . 63.0 t-105 -57.22 -61.67 2.3 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 111.421 -2.627 . . . . 0.0 109.666 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tp -50.04 -38.4 37.71 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.558 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.553 ' O ' ' N ' ' R' ' 24' ' ' ASP . 11.7 mtt-85 -54.28 -69.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.273 -1.371 . . . . 0.0 110.121 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.526 ' CG ' HD22 ' S' ' 51' ' ' LEU . 0.1 OUTLIER -35.39 -43.1 0.23 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 119.046 -1.061 . . . . 0.0 110.705 179.616 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 85.2 t -68.58 -38.44 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.437 -0.905 . . . . 0.0 110.093 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' R' ' 21' ' ' ARG . 27.6 t70 -48.55 -75.57 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.096 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.419 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.2 OUTLIER -44.6 -45.21 9.39 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.857 179.877 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . 0.418 HD12 ' CE1' ' R' ' 22' ' ' PHE . 1.4 tt -42.39 -58.17 2.32 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.472 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . 0.536 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.5 OUTLIER -69.49 -61.66 1.7 Allowed 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.763 -0.775 . . . . 0.0 112.319 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -46.11 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.536 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -114.16 -29.19 7.04 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 119.302 -0.959 . . . . 0.0 113.127 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -48.54 -41.6 30.85 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 118.875 -1.13 . . . . 0.0 111.31 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.29 -22.54 66.3 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.113 -1.035 . . . . 0.0 111.495 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . 0.529 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 22.1 t-20 -102.16 -10.98 19.15 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.83 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . 0.529 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 81.66 13.2 0.63 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 121.643 0.735 . . . . 0.0 110.195 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -86.91 -15.76 37.99 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.267 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -52.25 -30.45 27.69 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 113.881 -1.508 . . . . 0.0 113.439 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.465 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 3.3 mt -66.64 -63.46 2.96 Favored Pre-proline 0 C--N 1.304 -1.401 0 C-N-CA 117.92 -1.512 . . . . 0.0 110.557 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.471 ' O ' ' ND2' ' R' ' 40' ' ' ASN . 3.5 Cg_exo -52.75 -27.79 35.44 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 C-N-CA 120.536 0.824 . . . . 0.0 110.556 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . 0.447 HD11 ' CZ3' ' S' ' 99' ' ' TRP . 15.1 mt -84.49 -36.43 22.26 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.778 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.466 ' C ' ' H ' ' R' ' 41' ' ' LEU . 0.0 OUTLIER -51.47 -57.45 9.0 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.761 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' R' ' 37' ' ' PRO . 0.1 OUTLIER -64.13 2.51 0.55 Allowed 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.049 -1.06 . . . . 0.0 111.113 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . 0.466 ' H ' ' C ' ' R' ' 39' ' ' LEU . 3.7 tp -93.32 -64.11 1.13 Allowed 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.509 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . 0.463 ' O ' HD23 ' S' ' 51' ' ' LEU . 0.0 OUTLIER -79.53 12.57 2.43 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 117.431 -1.708 . . . . 0.0 109.406 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . 0.519 HD21 ' CE1' ' R' ' 22' ' ' PHE . 19.6 mt -132.34 169.96 15.76 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.608 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.29 0.2 OUTLIER -132.24 -135.52 0.0 OUTLIER Pre-proline 0 CA--C 1.57 1.735 0 CA-C-O 116.957 -1.497 . . . . 0.0 109.725 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.608 ' HD3' HG22 ' R' ' 44' ' ' THR . 18.8 Cg_endo -100.45 -49.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.483 0.874 0 CA-C-N 123.127 2.152 . . . . 0.0 112.051 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.43 -22.05 4.32 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.549 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.31 -52.8 11.19 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.89 -13.14 21.97 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.318 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -88.42 -65.09 1.05 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.144 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.588 ' HB1' HH11 ' R' ' 54' ' ' ARG . . . -61.63 -44.18 97.47 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.077 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.45 -60.63 2.39 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.665 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -44.76 42.1 Favored Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.297 -1.43 . . . . 0.0 109.973 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.496 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.2 OUTLIER -48.21 -79.93 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.092 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.588 HH11 ' HB1' ' R' ' 50' ' ' ALA . 0.1 OUTLIER -39.91 -37.77 0.61 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.199 -179.818 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . 0.595 HG22 ' HB3' ' S' ' 42' ' ' MET . 93.5 t -72.64 -35.27 50.06 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.726 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.9 OUTLIER -77.21 -39.45 48.64 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.151 -1.02 . . . . 0.0 111.821 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 0.794 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -73.38 -36.14 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 117.713 -1.595 . . . . 0.0 108.383 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 0.794 ' N ' HD13 ' R' ' 57' ' ' ILE . 3.1 t -56.28 -65.24 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 C-N-CA 118.07 -1.452 . . . . 0.0 109.39 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.507 ' N ' HG12 ' R' ' 58' ' ' VAL . 63.3 mt-10 -47.61 -44.55 26.76 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.88 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -46.15 -44.36 15.78 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.874 -0.731 . . . . 0.0 111.758 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 9.8 mt -99.15 -0.1 42.31 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.291 -0.964 . . . . 0.0 111.668 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.6 tp . . . . . 0 N--CA 1.493 1.696 0 C-N-CA 119.194 -1.002 . . . . 0.0 111.448 179.981 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 120.922 0.391 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -161.73 155.27 26.46 Favored Glycine 0 N--CA 1.493 2.446 0 C-N-CA 119.48 -1.343 . . . . 0.0 110.279 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.749 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -54.77 -49.5 68.36 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.785 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.444 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -61.14 -56.51 20.02 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.036 -1.066 . . . . 0.0 111.217 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 4.0 m -38.87 -54.42 1.63 Allowed 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 9.4 pt -64.72 -20.65 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.514 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -75.32 -73.28 0.26 Allowed 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 118.389 -1.324 . . . . 0.0 111.677 -179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -6.24 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.545 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . 0.514 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -69.25 -46.03 58.97 Favored Glycine 0 N--CA 1.49 2.287 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.741 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . 0.493 ' C ' ' H ' ' R' ' 88' ' ' SER . 33.8 t -102.77 -42.14 5.97 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.438 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -67.5 9.42 0.25 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.606 -0.837 . . . . 0.0 111.234 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . 0.527 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.4 OUTLIER -74.22 -22.91 59.15 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.031 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' R' ' 88' ' ' SER . 3.8 mt -37.29 -25.31 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.996 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . 0.527 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -108.71 -56.66 2.24 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.318 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.84 -6.21 2.57 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.663 -1.153 . . . . 0.0 112.585 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 138.68 97.48 Favored Pre-proline 0 N--CA 1.489 1.505 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.567 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -63.01 128.28 22.56 Favored 'Trans proline' 0 C--O 1.214 -0.705 0 C-N-CA 121.016 1.144 . . . . 0.0 111.582 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . 0.581 ' O ' HG12 ' R' ' 94' ' ' VAL . 82.7 t -67.68 -5.5 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.487 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -91.93 7.62 41.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.723 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.1 tp -104.35 -41.93 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.163 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.7 -47.2 67.41 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.286 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -60.04 -17.37 38.57 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.674 -0.81 . . . . 0.0 112.567 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.676 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 3.9 t90 -113.66 -65.26 1.2 Allowed 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.489 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.494 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.3 mm? -39.89 -38.56 0.7 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.494 ' C ' ' O ' ' R' ' 100' ' ' LEU . 11.2 mt-10 -43.79 -33.94 1.43 Allowed 'General case' 0 C--N 1.291 -1.966 0 C-N-CA 117.738 -1.585 . . . . 0.0 107.825 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . 0.441 ' N ' ' C ' ' R' ' 100' ' ' LEU . 6.4 mt-10 -91.75 -31.85 15.62 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.939 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.676 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 3.2 t -82.44 -10.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 117.288 -1.765 . . . . 0.0 110.287 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . 0.422 ' HA ' HD12 ' R' ' 104' ' ' LEU . 34.0 tp -92.95 -50.44 5.55 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.631 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.5 -66.44 0.38 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 119.16 -1.016 . . . . 0.0 110.252 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm . . . . . 0 N--CA 1.487 1.419 0 C-N-CA 119.681 -0.807 . . . . 0.0 111.179 179.925 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . 0.49 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.2 OUTLIER . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.764 0.316 . . . . 0.0 110.847 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -66.11 7.73 0.27 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.757 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.495 ' O ' ' N ' ' S' ' 20' ' ' LEU . 1.2 mp0 -92.65 -85.51 0.26 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.76 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.6 mt-10 -42.93 -29.93 0.37 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 122.966 1.365 . . . . 0.0 108.276 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . 0.466 ' N ' ' C ' ' S' ' 17' ' ' GLN . 22.8 t-105 -56.45 -54.43 45.73 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 112.729 -2.032 . . . . 0.0 107.927 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . 0.495 ' N ' ' O ' ' S' ' 17' ' ' GLN . 0.5 OUTLIER -57.64 -36.55 72.0 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 113.573 -1.648 . . . . 0.0 111.455 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -54.82 -74.41 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 118.595 -1.242 . . . . 0.0 110.027 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.547 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.7 OUTLIER -27.13 -48.26 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 119.234 -0.986 . . . . 0.0 111.472 179.626 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' S' ' 21' ' ' ARG . 62.2 t -66.82 -49.75 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.439 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' S' ' 21' ' ' ARG . 15.6 t70 -41.07 -56.25 2.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.583 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.56 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.2 OUTLIER -60.61 -45.32 94.45 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.272 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' S' ' 26' ' ' LEU . 0.2 OUTLIER -48.31 -43.71 33.27 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.389 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.05 -41.04 33.73 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.84 -9.86 18.67 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 119.305 -0.958 . . . . 0.0 113.329 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -46.69 15.02 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.774 -1.171 . . . . 0.0 112.096 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . 0.408 ' C ' ' N ' ' S' ' 32' ' ' ASN . 17.7 t80 -49.93 -46.34 51.98 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.687 -0.805 . . . . 0.0 112.015 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -47.4 -19.68 0.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.138 -1.025 . . . . 0.0 111.212 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.494 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 79.4 m-20 -110.67 -68.58 0.92 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.213 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.494 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.1 OUTLIER 160.17 -13.42 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.53 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . 0.435 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 1.4 mm? -54.94 -17.81 4.19 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.941 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . 0.434 ' ND1' ' O ' ' S' ' 33' ' ' ASP . 19.4 p-80 -50.17 -21.12 1.19 Allowed 'General case' 0 C--N 1.292 -1.904 0 C-N-CA 119.486 -0.886 . . . . 0.0 112.338 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.459 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -77.94 -64.1 0.42 Allowed Pre-proline 0 N--CA 1.484 1.239 0 C-N-CA 118.481 -1.288 . . . . 0.0 111.173 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -51.4 -42.31 55.52 Favored 'Trans proline' 0 C--N 1.319 -0.993 0 C-N-CA 120.526 0.817 . . . . 0.0 110.495 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.98 -54.6 44.82 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.589 -0.844 . . . . 0.0 110.416 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.4 OUTLIER -46.22 -53.21 11.0 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.816 179.864 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -52.36 -10.67 0.15 Allowed 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -107.14 -60.37 1.69 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.726 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . 0.595 ' HB3' HG22 ' R' ' 55' ' ' VAL . 0.0 OUTLIER -89.62 28.51 1.29 Allowed 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.462 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . 0.715 HD23 ' C ' ' S' ' 43' ' ' LEU . 5.3 tt -178.13 127.95 0.13 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.506 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -178.98 -42.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.484 0 C-N-CA 116.514 -2.074 . . . . 0.0 116.276 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.506 ' HD2' ' H ' ' S' ' 44' ' ' THR . 19.1 Cg_endo -78.72 -107.17 0.01 OUTLIER 'Trans proline' 0 CA--C 1.553 1.464 0 C-N-CA 121.251 1.301 . . . . 0.0 114.12 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -47.52 -16.85 0.07 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.118 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' S' ' 49' ' ' GLU . 22.0 mm-40 -69.42 -76.9 0.09 Allowed 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.149 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' S' ' 47' ' ' GLU . 11.0 ttp85 -38.32 -27.13 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.245 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' S' ' 47' ' ' GLU . 3.3 tt0 -77.47 -62.32 1.7 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 118.239 -1.385 . . . . 0.0 110.821 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . 0.463 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -59.47 -35.64 74.47 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.774 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . 0.526 HD22 ' CG ' ' R' ' 22' ' ' PHE . 95.2 mt -55.41 -72.48 0.07 Allowed 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.419 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.78 -40.32 5.23 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.456 -1.354 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.473 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -50.79 -80.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.616 -0.833 . . . . 0.0 112.496 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.628 HH21 HG11 ' S' ' 58' ' ' VAL . 0.0 OUTLIER -39.42 -35.34 0.27 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.401 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.3 t -74.66 -31.0 25.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 C-N-CA 118.452 -1.299 . . . . 0.0 111.013 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.473 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.5 -36.89 32.67 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.818 -1.153 . . . . 0.0 111.421 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 0.852 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -72.91 -40.11 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 118.078 -1.449 . . . . 0.0 108.604 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . 0.852 ' N ' HD13 ' S' ' 57' ' ' ILE . 19.3 t -59.46 -59.25 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 C-N-CA 117.463 -1.695 . . . . 0.0 108.837 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.1 -23.52 5.48 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.544 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.04 -58.09 5.07 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.631 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . 0.582 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -64.85 -9.96 24.75 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 118.564 -1.254 . . . . 0.0 110.737 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . 0.457 ' O ' ' C ' ' S' ' 63' ' ' ARG . 12.6 tp -72.65 28.62 0.06 Allowed 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 119.552 -0.859 . . . . 0.0 109.814 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . 0.582 ' H ' ' C ' ' S' ' 61' ' ' LEU . 47.7 mtt-85 . . . . . 0 N--CA 1.5 2.04 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 tttm . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 120.768 0.318 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -92.01 -103.4 0.11 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.305 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -140.95 -56.65 0.5 Allowed 'General case' 0 C--N 1.279 -2.491 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.884 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.11 5.21 40.29 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.4 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.92 -58.61 12.86 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 119.551 -1.309 . . . . 0.0 110.907 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.85 -82.02 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.126 -1.03 . . . . 0.0 111.003 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 157.23 132.3 1.44 Allowed Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.249 -1.453 . . . . 0.0 110.664 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.801 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -42.26 -45.6 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.127 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.45 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -62.83 -57.33 11.25 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.167 -1.013 . . . . 0.0 111.622 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . 0.531 ' CG2' HG21 ' S' ' 57' ' ' ILE . 23.6 m -47.24 -47.42 24.7 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.764 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . 0.415 HD13 HG21 ' S' ' 82' ' ' ILE . 22.1 pt -75.14 -0.61 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.662 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -90.6 -60.84 1.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 118.583 -1.247 . . . . 0.0 111.699 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -13.27 34.64 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.251 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.53 -48.57 83.95 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.373 -1.394 . . . . 0.0 110.699 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -88.46 -25.26 22.71 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.161 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -94.54 8.75 41.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.757 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.07 -28.13 16.38 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.753 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . 0.532 ' H ' HD12 ' S' ' 89' ' ' LEU . 9.4 mp -42.42 -64.3 0.63 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.864 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' S' ' 91' ' ' ALA . 0.0 OUTLIER -95.77 -51.44 4.49 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.778 -179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . 0.44 ' C ' ' O ' ' S' ' 90' ' ' LYS . . . -34.26 -51.87 0.46 Allowed 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.889 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . 0.567 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -82.83 162.71 54.31 Favored Pre-proline 0 C--N 1.303 -1.432 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.464 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . 0.567 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 4.4 Cg_exo -56.39 144.67 82.28 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 121.475 1.45 . . . . 0.0 111.222 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . 0.421 ' C ' ' H ' ' S' ' 96' ' ' LEU . 6.0 t -85.15 -6.82 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 119.286 -0.965 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.22 4.48 1.64 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.655 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . 0.421 ' H ' ' C ' ' S' ' 94' ' ' VAL . 8.0 mp -97.02 -19.16 18.94 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.498 -0.881 . . . . 0.0 111.011 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . 0.438 ' N ' ' CD ' ' S' ' 97' ' ' ARG . 3.5 mpt_? -64.2 -42.75 96.51 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.438 -0.905 . . . . 0.0 111.003 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -86.51 -1.78 57.9 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.705 ' CH2' HG21 ' S' ' 103' ' ' VAL . 10.7 t90 -115.63 -66.14 1.12 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.573 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.6 OUTLIER -52.67 -38.06 59.83 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.514 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.3 mm-40 -41.95 -26.95 0.1 Allowed 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 117.573 -1.651 . . . . 0.0 107.285 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . 0.573 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -95.57 -25.61 16.1 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 113.462 -1.699 . . . . 0.0 112.127 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.705 HG21 ' CH2' ' S' ' 99' ' ' TRP . 8.2 t -84.22 -20.32 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 116.148 -2.221 . . . . 0.0 108.119 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' S' ' 104' ' ' LEU . 19.3 tp -81.43 -57.4 3.49 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.857 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 1.1 mt -49.06 -61.89 1.83 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 118.672 -1.211 . . . . 0.0 109.446 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -74.24 170.21 16.02 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.683 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . 0.413 ' O ' ' OG ' ' S' ' 107' ' ' SER . 29.5 t . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 116.247 -1.835 . . . . 0.0 110.703 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . 0.51 ' C ' ' H ' ' R' ' 17' ' ' GLN . 4.5 mmt85 . . . . . 0 N--CA 1.488 1.458 0 CA-C-O 121.377 0.608 . . . . 0.0 112.326 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . 0.714 ' NE2' HD21 ' S' ' 36' ' ' LEU . 10.1 t-80 -69.17 24.81 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.151 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.537 ' O ' ' N ' ' R' ' 19' ' ' TRP . 4.3 mt-30 -85.59 -98.47 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.488 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . 0.496 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.7 mt-10 -32.0 -37.08 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-O 123.259 1.504 . . . . 0.0 108.989 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . 0.633 ' CD1' ' CD2' ' R' ' 16' ' ' HIS . 57.3 t-105 -50.09 -57.96 6.54 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 112.553 -2.112 . . . . 0.0 109.604 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' R' ' 17' ' ' GLN . 7.9 tp -54.64 -46.01 73.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.014 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -45.39 -68.4 0.2 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.456 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.448 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.1 OUTLIER -36.8 -38.81 0.19 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.82 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 97.3 t -73.5 -50.06 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.741 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -41.5 -64.65 0.53 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.877 -0.729 . . . . 0.0 111.24 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.453 ' HG ' ' H ' ' R' ' 25' ' ' LEU . 0.8 OUTLIER -54.4 -48.42 71.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.9 -0.72 . . . . 0.0 110.979 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' R' ' 25' ' ' LEU . 1.1 tt -35.31 -62.42 0.39 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.535 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.6 OUTLIER -57.5 -68.03 0.27 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.059 -1.056 . . . . 0.0 112.02 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -44.57 -17.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.514 ' HB1' ' N ' ' R' ' 35' ' ' HIS . . . -95.93 -31.27 13.18 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.521 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . 0.508 ' CE1' ' NZ ' ' S' ' 27' ' ' LYS . 15.1 t80 -55.86 -40.33 72.74 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.716 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -71.1 -21.97 62.15 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.805 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . 0.527 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 26.5 m120 -100.07 -16.1 17.99 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . 0.527 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 5.3 t70 83.73 23.56 0.13 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 123.671 0.607 . . . . 0.0 110.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -98.58 -14.79 19.76 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.769 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . 0.514 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 1.9 p-80 -48.11 -35.12 10.84 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.294 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.458 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 6.0 mt -64.82 -63.07 3.99 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 118.024 -1.47 . . . . 0.0 111.697 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -48.63 -35.03 28.59 Favored 'Trans proline' 0 C--N 1.315 -1.219 0 C-N-CA 120.917 1.078 . . . . 0.0 111.894 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . 0.405 HD11 ' CZ3' ' S' ' 99' ' ' TRP . 72.8 mt -76.81 -40.65 47.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.637 -0.825 . . . . 0.0 110.246 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.465 HD13 ' O ' ' R' ' 35' ' ' HIS . 0.3 OUTLIER -56.81 -22.17 34.32 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.681 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -89.44 6.64 39.86 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.176 -1.009 . . . . 0.0 111.117 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . 0.477 ' C ' ' H ' ' R' ' 43' ' ' LEU . 67.3 mt -114.54 -60.88 1.83 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.227 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . 0.403 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -71.12 16.24 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.348 -1.341 . . . . 0.0 111.535 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' R' ' 41' ' ' LEU . 4.8 mp -141.67 159.18 42.76 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.131 -0.627 . . . . 0.0 109.374 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.699 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.288 0.3 OUTLIER -107.67 -148.94 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.623 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.453 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.699 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.4 Cg_endo -98.12 -39.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.474 0.357 0 CA-C-N 119.945 1.016 . . . . 0.0 110.524 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.379 -0.928 . . . . 0.0 110.165 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.9 -41.77 95.33 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.91 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.03 -34.8 73.73 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.57 -0.852 . . . . 0.0 111.245 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.14 -64.42 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.74 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.433 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -53.95 -39.71 66.18 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.181 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -48.61 -67.6 0.26 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.612 -0.835 . . . . 0.0 110.862 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . 0.408 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -45.32 -52.82 8.35 Favored Glycine 0 N--CA 1.486 2.002 0 C-N-CA 119.283 -1.437 . . . . 0.0 110.644 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' R' ' 50' ' ' ALA . 0.2 OUTLIER -37.7 -78.58 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.276 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 9.6 mtt85 -40.94 -51.89 3.16 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.294 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 59.1 t -64.36 -26.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 C-N-CA 118.344 -1.343 . . . . 0.0 111.34 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.411 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -81.23 -39.28 25.62 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.826 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 0.92 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -74.33 -34.78 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 117.718 -1.593 . . . . 0.0 108.465 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 0.92 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.3 t -61.43 -65.27 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 118.004 -1.478 . . . . 0.0 109.414 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.482 ' N ' HG12 ' R' ' 58' ' ' VAL . 5.3 mm-40 -41.28 -50.73 3.67 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.882 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.64 -47.32 82.56 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.823 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 80.9 mt -83.09 6.09 20.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.538 -0.865 . . . . 0.0 112.241 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 tp . . . . . 0 N--CA 1.492 1.675 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.365 179.998 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.318 0 CA-C-O 120.736 0.303 . . . . 0.0 111.002 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.45 138.36 2.69 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.491 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.879 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.28 -38.99 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.221 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.93 -61.62 1.95 Allowed 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.891 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 48.9 m -38.75 -38.87 0.45 Allowed 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 13.4 pt -82.27 -22.64 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.45 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.85 -55.19 21.0 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 118.693 -1.203 . . . . 0.0 111.663 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . 0.421 ' HD2' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -72.91 -9.71 58.99 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.171 -1.012 . . . . 0.0 111.484 -179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.01 -32.79 52.01 Favored Glycine 0 N--CA 1.49 2.274 0 C-N-CA 119.089 -1.529 . . . . 0.0 110.775 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . 0.483 ' C ' ' H ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -84.88 -55.82 3.89 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.213 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . 0.402 ' O ' ' C ' ' R' ' 88' ' ' SER . 25.1 m-80 -69.06 11.61 0.2 Allowed 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.324 -0.951 . . . . 0.0 111.264 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . 0.483 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.3 OUTLIER -42.61 -31.27 0.43 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 1.5 mt -50.22 -45.1 53.54 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.875 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . 0.533 ' O ' ' N ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -107.47 -54.57 2.46 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.772 -0.771 . . . . 0.0 111.112 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.68 -27.78 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.237 -1.347 . . . . 0.0 112.643 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.533 ' N ' ' O ' ' R' ' 90' ' ' LYS . . . -88.0 156.12 52.26 Favored Pre-proline 0 N--CA 1.49 1.535 0 C-N-CA 118.674 -1.21 . . . . 0.0 110.698 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -51.84 129.58 30.86 Favored 'Trans proline' 0 C--N 1.325 -0.7 0 C-N-CA 121.445 1.43 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . 0.416 HG23 ' H ' ' R' ' 94' ' ' VAL . 4.7 t -62.14 -12.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.992 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -91.45 4.62 52.06 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.514 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -90.24 -49.86 6.31 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.1 -38.8 3.84 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.798 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -58.7 -41.18 85.68 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.516 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.668 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.3 t90 -84.85 -63.16 1.38 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.281 -0.967 . . . . 0.0 112.323 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.6 mm? -41.06 -38.2 0.98 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 118.952 -1.099 . . . . 0.0 113.96 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.474 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.6 mm-40 -44.99 -29.65 0.87 Allowed 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 117.851 -1.54 . . . . 0.0 107.856 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . 0.465 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.6 mt-10 -94.58 -30.94 14.11 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 113.304 -1.771 . . . . 0.0 111.818 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.668 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.6 t -89.67 -6.64 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 117.466 -1.694 . . . . 0.0 110.503 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 13.7 tp -104.02 -49.35 3.64 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.25 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.67 -68.5 0.64 Allowed 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.755 -0.778 . . . . 0.0 112.255 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 45.1 tttp . . . . . 0 N--CA 1.492 1.643 0 C-N-CA 119.955 -0.698 . . . . 0.0 111.821 -179.875 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . 0.492 ' C ' ' H ' ' S' ' 17' ' ' GLN . 6.1 mtp180 . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 120.492 0.187 . . . . 0.0 111.325 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . 0.548 ' O ' ' CG ' ' S' ' 16' ' ' HIS . 43.6 t-80 -69.15 13.55 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.451 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.492 ' H ' ' C ' ' S' ' 15' ' ' ARG . 1.5 tp60 -91.26 -97.19 0.12 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.416 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.403 ' C ' ' O ' ' S' ' 17' ' ' GLN . 0.6 OUTLIER -44.36 -27.99 0.49 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.537 1.161 . . . . 0.0 108.638 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . 0.451 ' N ' ' C ' ' S' ' 17' ' ' GLN . 11.2 t-105 -48.87 -63.92 0.95 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.782 -1.554 . . . . 0.0 108.444 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -44.51 -39.07 4.56 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.266 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.525 ' O ' ' N ' ' S' ' 24' ' ' ASP . 5.8 mmp_? -51.63 -71.12 0.07 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.181 -1.408 . . . . 0.0 109.344 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.522 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -28.92 -44.7 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.797 -0.761 . . . . 0.0 111.202 179.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.424 ' N ' ' O ' ' S' ' 21' ' ' ARG . 99.1 t -70.32 -48.78 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.709 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.525 ' N ' ' O ' ' S' ' 21' ' ' ARG . 63.5 t0 -42.94 -72.83 0.05 Allowed 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.636 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.415 ' HG ' ' H ' ' S' ' 25' ' ' LEU . 0.2 OUTLIER -43.26 -45.97 6.03 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.711 -0.796 . . . . 0.0 109.952 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -40.82 -59.71 1.35 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.941 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . 0.508 ' NZ ' ' CE1' ' R' ' 30' ' ' TYR . 0.1 OUTLIER -50.36 -70.35 0.09 Allowed 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.682 -0.807 . . . . 0.0 112.461 -179.84 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -49.16 -24.72 1.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.73 -56.03 3.46 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 118.898 -1.121 . . . . 0.0 112.262 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -47.86 -33.41 7.42 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 119.657 -0.817 . . . . 0.0 111.157 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.37 -28.9 21.37 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 118.881 -1.128 . . . . 0.0 110.229 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.492 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 7.4 m120 -111.45 -65.44 1.17 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.492 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.0 OUTLIER 164.24 -11.54 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.751 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . 0.514 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 3.7 mm? -59.11 -16.7 20.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.177 -0.609 . . . . 0.0 111.821 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . 0.444 ' ND1' ' O ' ' S' ' 33' ' ' ASP . 11.4 p-80 -48.43 -18.15 0.21 Allowed 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 119.356 -0.938 . . . . 0.0 112.134 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.714 HD21 ' NE2' ' R' ' 16' ' ' HIS . 6.2 mt -80.92 -65.63 0.26 Allowed Pre-proline 0 C--N 1.308 -1.219 0 C-N-CA 117.995 -1.482 . . . . 0.0 110.931 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.2 Cg_exo -50.31 -28.79 21.51 Favored 'Trans proline' 0 C--N 1.319 -0.987 0 C-N-CA 120.624 0.882 . . . . 0.0 110.975 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.36 -41.54 39.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.326 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.493 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.3 OUTLIER -52.29 -43.34 64.42 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.376 -0.93 . . . . 0.0 109.756 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 3.5 m-80 -71.39 13.12 0.26 Allowed 'General case' 0 C--N 1.297 -1.684 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.83 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . 0.493 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.1 tp -113.71 -54.38 2.61 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 120.044 -0.662 . . . . 0.0 112.344 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.22 7.12 17.16 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 118.665 -1.214 . . . . 0.0 112.725 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 2.1 pp -177.03 153.35 0.98 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.305 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.577 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.7 OUTLIER -179.05 -42.38 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.175 0 C-N-CA 117.783 -1.567 . . . . 0.0 114.762 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.577 ' HD2' ' H ' ' S' ' 44' ' ' THR . 14.4 Cg_endo -77.15 -105.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 121.037 1.158 . . . . 0.0 112.88 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . 0.4 ' OD1' ' O ' ' S' ' 46' ' ' ASP . 34.8 t0 -55.25 -6.18 0.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.693 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . 0.502 ' H ' ' C ' ' S' ' 45' ' ' PRO . 8.4 mm-40 -82.92 -59.45 2.49 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 119.723 -0.791 . . . . 0.0 109.972 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . 0.621 ' NH1' ' CE3' ' R' ' 19' ' ' TRP . 19.4 tpt180 -54.83 -24.88 24.97 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.918 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . 0.422 ' O ' ' OG1' ' S' ' 53' ' ' THR . 31.8 mt-10 -82.24 -71.13 0.5 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.745 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.53 -51.13 68.07 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.048 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.26 -61.84 0.84 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.899 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.38 -40.99 78.83 Favored Glycine 0 N--CA 1.489 2.177 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.596 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.551 ' O ' HG22 ' S' ' 57' ' ' ILE . 0.2 OUTLIER -48.9 -77.27 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.221 179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.78 ' HE ' ' N ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -44.15 -29.49 0.63 Allowed 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.805 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 96.8 t -81.52 -28.57 10.32 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.527 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.65 -36.03 33.07 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.843 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 0.784 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -74.6 -38.94 46.55 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . 0.784 ' N ' HD13 ' S' ' 57' ' ' ILE . 3.1 t -55.81 -68.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 118.635 -1.226 . . . . 0.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . 0.553 ' N ' HG12 ' S' ' 58' ' ' VAL . 11.8 tt0 -48.11 -33.24 7.92 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.886 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -67.78 -48.41 66.4 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.078 -1.049 . . . . 0.0 112.18 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . 0.755 ' O ' HD12 ' S' ' 61' ' ' LEU . 0.5 OUTLIER -61.58 -18.92 61.39 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 118.131 -1.428 . . . . 0.0 108.698 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . 0.435 ' O ' ' C ' ' S' ' 63' ' ' ARG . 1.7 tp -77.92 26.06 0.2 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.858 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . 0.504 ' H ' ' C ' ' S' ' 61' ' ' LEU . 61.5 mtt180 . . . . . 0 N--CA 1.501 2.095 0 O-C-N 124.398 1.061 . . . . 0.0 113.832 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 tttm . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 120.85 0.357 . . . . 0.0 110.911 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -84.59 -101.71 0.05 Allowed 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.782 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -141.12 -26.25 0.72 Allowed 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.834 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 tp -126.68 7.85 6.88 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.027 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -54.39 -71.11 0.76 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 119.577 -1.296 . . . . 0.0 110.897 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.74 -86.14 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.305 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.69 128.02 1.65 Allowed Glycine 0 N--CA 1.49 2.288 0 C-N-CA 118.913 -1.613 . . . . 0.0 111.367 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.84 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -38.71 -41.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.307 0 CA-C-N 115.393 -0.403 . . . . 0.0 111.099 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.447 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.62 -42.72 86.36 Favored 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 118.807 -1.157 . . . . 0.0 110.835 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 19.1 m -53.17 -49.58 66.36 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 24.8 pt -72.8 11.13 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.447 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -105.96 -63.55 1.24 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.881 -1.128 . . . . 0.0 111.965 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . 0.448 ' H ' ' HD2' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -58.29 -21.57 49.38 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 118.459 -1.297 . . . . 0.0 110.876 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.39 -29.96 72.93 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.345 -1.407 . . . . 0.0 110.714 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -27.32 13.48 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.266 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -101.79 10.29 40.07 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.578 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . 0.423 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.3 OUTLIER -46.48 -21.99 0.23 Allowed 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.265 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' S' ' 88' ' ' SER . 75.8 mt -37.69 -72.05 0.07 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' S' ' 92' ' ' ALA . 0.0 OUTLIER -58.93 -55.68 32.0 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.803 -1.159 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.84 -24.17 0.02 OUTLIER 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.87 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . 0.518 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -120.37 162.34 34.52 Favored Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.618 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . 0.518 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 1.2 Cg_endo -61.6 -178.33 0.28 Allowed 'Trans proline' 0 C--N 1.319 -0.98 0 C-N-CA 121.236 1.291 . . . . 0.0 111.394 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 24.5 t -100.5 -16.48 7.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.116 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -70.41 -6.07 33.0 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.588 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.3 -24.91 62.23 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.993 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 13.7 mtt85 -78.22 -14.39 59.47 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.58 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -104.77 -10.48 17.39 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.979 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.794 ' CH2' HG21 ' S' ' 103' ' ' VAL . 22.7 t90 -107.02 -58.14 1.98 Allowed 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 122.201 1.0 . . . . 0.0 112.459 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.575 HD21 HD13 ' S' ' 104' ' ' LEU . 0.6 OUTLIER -53.64 -37.56 63.22 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -179.585 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.53 ' C ' ' O ' ' S' ' 100' ' ' LEU . 8.1 mt-10 -43.81 -32.14 0.99 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 116.939 -1.904 . . . . 0.0 106.215 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . 0.534 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 tt0 -83.79 -27.48 28.79 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 112.683 -2.053 . . . . 0.0 112.054 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.794 HG21 ' CH2' ' S' ' 99' ' ' TRP . 45.0 t -85.74 -32.12 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 C-N-CA 116.01 -2.276 . . . . 0.0 111.304 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . 0.575 HD13 HD21 ' S' ' 100' ' ' LEU . 2.1 mp -97.14 -55.83 2.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.417 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 15.5 mt -75.79 -81.27 0.08 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 118.703 -1.199 . . . . 0.0 113.416 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . 0.42 ' O ' ' O ' ' S' ' 102' ' ' GLU . 7.2 tttm -86.61 108.25 18.52 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 119.024 -1.07 . . . . 0.0 112.124 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 116.328 -1.796 . . . . 0.0 110.832 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 121.273 0.559 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -163.58 -13.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.459 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.424 ' C ' ' N ' ' R' ' 19' ' ' TRP . 4.8 tt0 -88.78 -79.25 0.32 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.626 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.2 mp0 -41.9 -34.57 0.69 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 123.339 1.542 . . . . 0.0 108.3 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CZ3' ' CD ' ' S' ' 48' ' ' ARG . 21.9 t-105 -57.19 -55.66 31.86 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 112.381 -2.19 . . . . 0.0 110.038 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' R' ' 17' ' ' GLN . 6.6 tp -56.55 -27.62 58.12 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.788 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' R' ' 24' ' ' ASP . 0.0 OUTLIER -65.33 -62.71 1.37 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.558 -1.257 . . . . 0.0 109.578 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.499 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.2 OUTLIER -33.85 -43.93 0.15 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.305 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 19.7 t -73.27 -35.57 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 119.549 -0.861 . . . . 0.0 110.2 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.592 ' N ' ' O ' ' R' ' 21' ' ' ARG . 34.7 t0 -59.56 -69.79 0.19 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.645 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.24 -41.29 5.75 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.246 -0.981 . . . . 0.0 109.689 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mt -48.86 -62.39 1.55 Allowed 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.225 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -59.94 -38.21 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.528 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -61.52 -35.33 77.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.502 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.605 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -94.31 -39.73 10.34 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.355 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -47.74 -29.48 3.13 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.474 -0.89 . . . . 0.0 112.035 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -52.32 -30.92 30.67 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.375 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -109.11 -79.68 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.234 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 p30 173.51 31.07 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.097 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . 0.605 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 1.3 mm? -94.64 -21.95 18.47 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.862 0.839 . . . . 0.0 110.202 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . 0.475 ' O ' HD22 ' R' ' 39' ' ' LEU . 13.8 p-80 -49.61 -23.49 1.71 Allowed 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 114.296 -1.32 . . . . 0.0 113.962 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.3 mt -74.08 -66.02 0.54 Allowed Pre-proline 0 N--CA 1.487 1.412 0 C-N-CA 118.164 -1.414 . . . . 0.0 111.316 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 1.4 Cg_endo -52.74 -29.54 42.62 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 120.619 0.879 . . . . 0.0 110.301 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . 0.446 HD11 HD21 ' S' ' 96' ' ' LEU . 9.0 mp -82.04 -29.27 32.02 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.845 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.475 HD22 ' O ' ' R' ' 35' ' ' HIS . 0.0 OUTLIER -59.34 -30.66 68.53 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.78 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . 0.453 ' CG ' HH12 ' R' ' 48' ' ' ARG . 0.8 OUTLIER -77.06 11.46 1.8 Allowed 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 118.716 -1.194 . . . . 0.0 109.199 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . 0.458 ' H ' ' C ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -111.28 -69.0 0.89 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.335 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . 0.413 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -90.35 41.47 1.05 Allowed 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 118.437 -1.305 . . . . 0.0 108.878 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . 0.421 ' O ' ' O ' ' R' ' 39' ' ' LEU . 4.5 tt 173.89 135.02 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.511 -1.662 . . . . 0.0 106.511 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.5 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -171.25 -38.31 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.892 0 C-N-CA 114.799 -2.76 . . . . 0.0 117.47 -179.437 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.5 ' CD ' ' H ' ' R' ' 44' ' ' THR . 71.7 Cg_endo -98.69 -105.31 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 121.564 1.509 . . . . 0.0 114.869 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -45.1 -28.84 0.78 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.058 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.765 ' OE1' HD11 ' S' ' 43' ' ' LEU . 7.7 mm-40 -57.66 -67.18 0.36 Allowed 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 118.348 -1.341 . . . . 0.0 109.409 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . 0.453 HH12 ' CG ' ' R' ' 40' ' ' ASN . 1.9 tpp180 -42.92 -24.68 0.07 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.063 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . 0.468 ' N ' ' O ' ' R' ' 47' ' ' GLU . 11.9 mt-10 -96.03 -69.41 0.76 Allowed 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.125 -1.03 . . . . 0.0 113.509 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.832 ' HB1' ' HE ' ' R' ' 54' ' ' ARG . . . -58.8 -27.27 64.89 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . 1.027 HD23 ' N ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -71.71 -37.92 70.59 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.039 -1.464 . . . . 0.0 112.306 -179.671 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . 1.027 ' N ' HD23 ' R' ' 51' ' ' LEU . . . -71.21 -36.25 63.79 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 108.556 -1.817 . . . . 0.0 108.556 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.533 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -64.25 -79.65 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.341 -0.929 . . . . 0.0 109.997 179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.832 ' HE ' ' HB1' ' R' ' 50' ' ' ALA . 17.1 mtt-85 -32.44 -55.59 0.34 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.213 -1.358 . . . . 0.0 112.977 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 2.1 p -62.89 -30.31 49.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 117.439 -1.704 . . . . 0.0 111.486 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.639 ' NH1' ' HE ' ' S' ' 21' ' ' ARG . 11.1 mmt180 -76.69 -45.29 30.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.297 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -65.61 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 C-N-CA 118.044 -1.462 . . . . 0.0 110.292 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 0.717 HG13 ' N ' ' R' ' 59' ' ' GLU . 9.4 p -45.71 -58.12 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 C-N-CA 117.963 -1.495 . . . . 0.0 111.203 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.717 ' N ' HG13 ' R' ' 58' ' ' VAL . 78.6 mt-10 -54.64 -28.19 45.18 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.723 -1.191 . . . . 0.0 112.706 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -79.38 -51.73 9.02 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.937 -1.105 . . . . 0.0 112.98 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 13.3 mt -67.88 -9.82 48.02 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.655 -1.218 . . . . 0.0 111.532 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.304 -1.399 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.762 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . 0.422 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 121.175 0.512 . . . . 0.0 110.186 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' R' ' 77' ' ' ALA . . . -34.65 135.33 0.35 Allowed Glycine 0 N--CA 1.495 2.584 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.974 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.878 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -35.6 -35.98 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.057 -0.571 . . . . 0.0 111.103 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.504 ' HB1' ' NH2' ' R' ' 84' ' ' ARG . . . -58.17 -65.83 0.58 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.826 -1.149 . . . . 0.0 110.366 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 53.2 m -40.42 -42.25 1.56 Allowed 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . 0.45 HG21 HD13 ' R' ' 82' ' ' ILE . 2.0 pt -85.71 -6.69 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -78.81 -43.18 25.92 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 118.209 -1.397 . . . . 0.0 111.807 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . 0.504 ' NH2' ' HB1' ' R' ' 80' ' ' ALA . 1.8 ptp180 -67.22 -23.53 65.74 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.653 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.44 3.75 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.229 -1.462 . . . . 0.0 110.194 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 68.0 m -89.4 -32.33 17.32 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.576 -0.85 . . . . 0.0 111.278 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' R' ' 89' ' ' LEU . 5.2 m-20 -86.27 10.66 14.1 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.291 -0.963 . . . . 0.0 110.88 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -40.68 -21.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.698 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' R' ' 87' ' ' ASN . 72.1 mt -58.19 -67.23 0.37 Allowed 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.94 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . 0.406 ' HG3' ' H ' ' R' ' 90' ' ' LYS . 0.0 OUTLIER -91.8 -27.09 18.21 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.136 -1.026 . . . . 0.0 113.466 -179.812 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -50.84 72.08 Favored 'General case' 0 C--N 1.284 -2.271 0 C-N-CA 118.72 -1.192 . . . . 0.0 112.827 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.57 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -91.66 162.46 31.3 Favored Pre-proline 0 N--CA 1.489 1.521 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . 0.57 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.8 Cg_exo -51.53 142.13 40.19 Favored 'Trans proline' 0 C--N 1.323 -0.781 0 C-N-CA 121.628 1.552 . . . . 0.0 112.038 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 23.6 t -92.61 -15.63 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.541 -0.864 . . . . 0.0 111.122 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -70.9 -3.8 21.1 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.04 -1.064 . . . . 0.0 110.284 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . 0.57 HD11 HD22 ' S' ' 38' ' ' LEU . 1.6 tp -67.6 -44.11 78.9 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.043 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.81 -19.15 0.89 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.382 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -70.59 -34.25 71.97 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.037 -1.065 . . . . 0.0 110.704 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.65 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 15.7 t90 -100.38 -57.46 2.11 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.524 HD13 ' HB ' ' R' ' 103' ' ' VAL . 2.0 mm? -41.54 -34.97 0.63 Allowed 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.556 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' R' ' 100' ' ' LEU . 0.5 OUTLIER -44.48 -31.0 0.96 Allowed 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 117.851 -1.54 . . . . 0.0 108.449 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' C ' ' R' ' 100' ' ' LEU . 1.8 mt-10 -95.53 -29.5 14.33 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 114.081 -1.418 . . . . 0.0 111.803 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.65 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 4.2 t -81.16 -20.92 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 116.792 -1.963 . . . . 0.0 110.678 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.45 -55.35 3.44 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.158 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tp -50.78 -41.91 57.44 Favored 'General case' 0 C--N 1.308 -1.197 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.291 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 tttt . . . . . 0 N--CA 1.494 1.755 0 C-N-CA 119.688 -0.805 . . . . 0.0 111.297 -179.992 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 120.897 0.38 . . . . 0.0 110.706 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -129.26 -11.79 4.59 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.321 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.525 ' OE1' ' N ' ' S' ' 17' ' ' GLN . 4.7 mp0 -89.83 -76.94 0.41 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.627 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.5 mt-10 -42.13 -30.99 0.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 122.721 1.248 . . . . 0.0 108.328 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . 0.472 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.254 56.0 t-105 -49.76 -56.04 11.75 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.809 179.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 5.3 tp -52.43 -40.21 61.93 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 113.841 -1.527 . . . . 0.0 112.045 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.639 ' HE ' ' NH1' ' R' ' 56' ' ' ARG . 4.3 mtt-85 -59.21 -72.64 0.1 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.14 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.552 ' CD2' HD12 ' R' ' 51' ' ' LEU . 0.0 OUTLIER -32.1 -44.47 0.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.17 179.62 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.464 ' O ' ' N ' ' S' ' 26' ' ' LEU . 71.0 t -63.28 -61.9 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.481 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.414 ' C ' ' O ' ' S' ' 23' ' ' VAL . 41.9 t0 -32.55 -55.37 0.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.137 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.479 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.7 OUTLIER -60.78 -42.23 97.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.802 -1.159 . . . . 0.0 110.351 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.464 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -54.2 -56.38 18.86 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 119.668 -0.813 . . . . 0.0 112.06 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -58.46 -56.86 16.7 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -60.9 -49.87 75.72 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.269 -0.973 . . . . 0.0 112.385 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -52.99 -37.93 61.81 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 118.714 -1.194 . . . . 0.0 111.383 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -52.1 -43.42 63.92 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 118.456 -1.297 . . . . 0.0 109.807 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -37.72 74.63 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -89.68 -12.13 40.41 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.366 179.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' S' ' 29' ' ' ALA . 3.1 t70 78.57 3.91 2.59 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.3 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.95 -0.06 33.55 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.714 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . 0.464 ' N ' ' ND1' ' S' ' 35' ' ' HIS . 0.8 OUTLIER -56.91 -15.77 5.52 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.666 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.454 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 9.0 mt -76.68 -63.88 0.52 Allowed Pre-proline 0 C--N 1.304 -1.373 0 C-N-CA 118.37 -1.332 . . . . 0.0 110.299 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.7 Cg_endo -52.32 -37.71 71.71 Favored 'Trans proline' 0 C--N 1.319 -0.991 0 N-CA-C 109.716 -0.917 . . . . 0.0 109.716 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . 0.57 HD22 HD11 ' R' ' 96' ' ' LEU . 3.8 mm? -66.65 -41.76 87.71 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.405 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.514 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -59.08 -14.37 9.7 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . 0.411 ' HA ' ' HG1' ' S' ' 44' ' ' THR . 0.6 OUTLIER -91.21 -11.51 38.07 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 114.886 -1.052 . . . . 0.0 112.423 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -101.61 -65.82 0.96 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 119.563 -0.855 . . . . 0.0 112.668 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.16 37.54 0.73 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.38 -1.328 . . . . 0.0 110.29 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . 0.765 HD11 ' OE1' ' R' ' 47' ' ' GLU . 1.9 tp 172.5 132.51 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 CA-C-N 114.614 -1.175 . . . . 0.0 107.995 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.437 ' CB ' ' O ' ' S' ' 43' ' ' LEU . 0.7 OUTLIER -176.47 -48.13 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.335 0 C-N-CA 114.927 -2.709 . . . . 0.0 117.569 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.2 -101.81 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.223 0 N-CA-C 115.284 1.225 . . . . 0.0 115.284 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -52.79 -23.36 6.73 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.837 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . 0.554 ' CD ' ' N ' ' S' ' 47' ' ' GLU . 0.0 OUTLIER -62.78 -55.23 28.34 Favored 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.815 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . 0.441 ' CD ' ' CZ3' ' R' ' 19' ' ' TRP . 14.7 mmm-85 -52.47 -39.78 61.55 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.505 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -71.75 0.23 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.422 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.31 -25.53 1.61 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.557 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.14 -63.95 1.05 Allowed 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 119.383 -0.927 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.26 -40.91 11.04 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.632 -1.747 . . . . 0.0 109.153 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.444 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -54.38 -82.2 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.831 -0.748 . . . . 0.0 112.943 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . . . . . . . . . 5.3 ptt180 -43.46 -40.79 3.99 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.668 -179.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.61 -34.07 67.34 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.267 0 C-N-CA 117.73 -1.588 . . . . 0.0 110.588 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.6 OUTLIER -82.98 -36.03 25.41 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 118.023 -1.471 . . . . 0.0 112.578 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 0.702 ' C ' HD12 ' S' ' 57' ' ' ILE . 0.3 OUTLIER -64.67 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 115.861 -2.336 . . . . 0.0 106.597 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 38.5 t -62.63 -67.76 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 118.512 -1.275 . . . . 0.0 109.218 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . 0.452 ' O ' ' OE1' ' S' ' 59' ' ' GLU . 0.0 OUTLIER -45.34 -41.89 9.39 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.287 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . 0.425 ' O ' ' N ' ' S' ' 63' ' ' ARG . 16.6 mm-40 -58.75 -45.52 89.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.931 -1.108 . . . . 0.0 111.074 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 16.2 mt -51.31 -47.63 62.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 118.273 -1.371 . . . . 0.0 108.83 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.52 -23.56 58.46 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.653 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . 0.425 ' N ' ' O ' ' S' ' 60' ' ' GLU . 4.3 tpt180 . . . . . 0 N--CA 1.486 1.329 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.941 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.497 1.912 0 N-CA-C 113.919 1.081 . . . . 0.0 113.919 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' S' ' 75' ' ' LEU . 29.2 t30 -93.97 18.29 10.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 122.231 1.015 . . . . 0.0 108.866 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 43.04 8.47 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 112.382 -2.19 . . . . 0.0 113.449 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' S' ' 73' ' ' ASN . 8.8 mt -128.99 -46.29 1.25 Allowed 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.284 -0.967 . . . . 0.0 111.465 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -66.62 -31.41 78.49 Favored Glycine 0 N--CA 1.492 2.43 0 C-N-CA 119.7 -1.238 . . . . 0.0 112.451 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' S' ' 78' ' ' GLY . . . -176.74 99.75 0.05 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 118.64 -1.224 . . . . 0.0 111.033 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -36.35 142.05 0.18 Allowed Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.427 -0.892 . . . . 0.0 111.791 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.76 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -36.75 -30.77 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -45.98 -66.9 0.33 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.74 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 1.5 m -40.11 -69.53 0.13 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . 0.578 ' HA ' HD13 ' S' ' 57' ' ' ILE . 19.4 pt -52.62 -14.23 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -179.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.537 ' O ' ' N ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -94.28 -60.39 1.74 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.367 -1.333 . . . . 0.0 112.792 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -50.16 -5.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.014 -1.074 . . . . 0.0 111.55 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' S' ' 83' ' ' THR . . . -48.6 -58.05 7.83 Favored Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.584 -1.293 . . . . 0.0 110.845 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . 0.424 ' O ' ' OG ' ' S' ' 86' ' ' SER . 17.3 p -174.25 46.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.063 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -98.56 -27.17 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.267 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . 0.463 ' C ' ' H ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -129.79 -38.35 1.49 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.877 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.0 -2.42 1.22 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.306 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . 0.463 ' H ' ' C ' ' S' ' 88' ' ' SER . 0.8 OUTLIER -68.89 -40.68 79.05 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.017 -0.992 . . . . 0.0 113.026 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.69 -22.66 24.53 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . 0.755 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . -52.02 -56.39 22.16 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 117.836 -1.546 . . . . 0.0 112.084 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . 0.755 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 31.4 Cg_endo -83.05 126.41 4.37 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 120.802 1.001 . . . . 0.0 110.03 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . 0.534 ' C ' ' H ' ' S' ' 96' ' ' LEU . 15.4 t -86.44 -37.3 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 118.594 -1.242 . . . . 0.0 111.829 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -3.14 0.27 Allowed 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.901 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' S' ' 94' ' ' VAL . 0.2 OUTLIER -85.83 -29.84 23.44 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.486 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -8.43 25.25 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -103.79 -6.12 21.76 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.336 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -113.22 -64.43 1.31 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 1.048 HD22 ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -9.2 -84.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 120.865 3.654 . . . . 0.0 120.865 -179.581 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 1.048 ' H ' HD22 ' S' ' 100' ' ' LEU . 3.5 mm-40 -92.71 -37.52 12.33 Favored 'General case' 0 C--N 1.278 -2.507 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.462 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . 0.419 ' C ' ' O ' ' S' ' 101' ' ' GLU . 2.0 tt0 -53.57 -19.06 3.39 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.591 ' N ' ' C ' ' S' ' 101' ' ' GLU . 95.2 t -108.15 -67.13 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.161 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 9.7 mt -43.93 -55.52 4.54 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 117.936 -1.506 . . . . 0.0 111.331 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . 0.408 ' HA ' HD12 ' S' ' 105' ' ' LEU . 12.9 tp -56.85 -71.05 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.836 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 mmtt -48.45 -38.12 19.0 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.97 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 116.398 -1.763 . . . . 0.0 110.851 179.929 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 60.0 mtt85 . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 120.954 0.407 . . . . 0.0 110.961 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -147.25 -6.04 0.49 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.572 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' R' ' 20' ' ' LEU . 1.5 mt-30 -97.61 -79.59 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.648 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . 0.552 ' H ' ' CD ' ' R' ' 18' ' ' GLU . 1.9 mp0 -47.21 -28.69 1.98 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . 0.48 ' N ' ' C ' ' R' ' 17' ' ' GLN . 10.9 t-105 -62.56 -53.23 57.78 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.308 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' R' ' 17' ' ' GLN . 0.8 OUTLIER -56.77 -38.06 71.94 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.249 179.708 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.518 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mtt180 -52.59 -70.07 0.1 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 118.352 -1.339 . . . . 0.0 108.625 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.518 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -28.55 -47.65 0.05 Allowed 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.552 0.532 . . . . 0.0 110.698 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 22.6 t -68.94 -49.18 65.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.675 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' R' ' 21' ' ' ARG . 21.6 t70 -46.45 -76.45 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.83 -0.748 . . . . 0.0 110.94 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.618 HD12 ' SD ' ' R' ' 42' ' ' MET . 0.4 OUTLIER -41.49 -41.53 2.11 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.828 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.35 -59.25 4.17 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.052 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -71.5 -38.21 71.17 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.693 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -15.22 23.01 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.997 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.73 -43.35 5.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.463 -0.895 . . . . 0.0 112.013 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -43.35 -27.76 0.28 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.207 -0.997 . . . . 0.0 110.906 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -51.54 -42.96 62.16 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.524 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . 0.41 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 9.7 m-80 -102.18 -72.14 0.7 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.494 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . 0.718 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.5 OUTLIER 169.77 18.12 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.39 -0.924 . . . . 0.0 112.425 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . 1.023 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.1 OUTLIER -92.29 -7.97 46.48 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.126 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -51.72 -13.21 0.24 Allowed 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 119.385 -0.926 . . . . 0.0 111.981 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.5 mt -81.41 -65.55 0.25 Allowed Pre-proline 0 N--CA 1.482 1.131 0 C-N-CA 118.141 -1.424 . . . . 0.0 110.1 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -49.51 -27.62 14.62 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 N-CA-C 109.968 -0.82 . . . . 0.0 109.968 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . 0.538 HD21 ' CZ3' ' S' ' 99' ' ' TRP . 8.0 mp -76.41 -41.87 46.21 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.796 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' R' ' 39' ' ' LEU . 1.3 tp -50.17 -47.68 54.33 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.464 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.1 m120 -70.78 3.13 3.44 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.056 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 mt -110.76 -62.08 1.59 Allowed 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.764 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . 0.618 ' SD ' HD12 ' R' ' 25' ' ' LEU . 0.1 OUTLIER -82.57 29.79 0.43 Allowed 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.08 -179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . 0.465 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.8 OUTLIER 163.39 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.537 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.638 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.6 OUTLIER -176.82 -41.22 0.0 OUTLIER Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 117.937 -1.505 . . . . 0.0 114.026 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.638 ' HD2' ' H ' ' R' ' 44' ' ' THR . 14.6 Cg_endo -78.85 -102.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.826 1.017 . . . . 0.0 112.337 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.05 -14.21 2.46 Favored 'General case' 0 C--N 1.308 -1.224 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.172 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.624 ' O ' HD13 ' R' ' 51' ' ' LEU . 0.7 OUTLIER -77.64 -55.65 5.17 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.127 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -49.06 -37.83 22.32 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.253 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . 0.401 ' O ' ' OG1' ' R' ' 53' ' ' THR . 6.5 mt-10 -65.52 -67.74 0.42 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.614 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.45 -34.06 15.79 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.036 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . 0.624 HD13 ' O ' ' R' ' 47' ' ' GLU . 4.2 mp -53.71 -77.65 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.46 -0.896 . . . . 0.0 111.54 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.16 -51.25 11.66 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.784 -1.198 . . . . 0.0 111.548 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' R' ' 50' ' ' ALA . 0.1 OUTLIER -42.08 -81.23 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 121.754 0.788 . . . . 0.0 111.458 -179.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.449 ' C ' ' CD ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -34.36 -52.1 0.47 Allowed 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.036 -1.438 . . . . 0.0 112.823 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.7 t -60.62 -32.91 52.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 C-N-CA 119.191 -1.004 . . . . 0.0 112.519 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.35 -33.09 32.64 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.899 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 0.743 ' O ' HD12 ' R' ' 57' ' ' ILE . 0.0 OUTLIER -78.06 -47.59 24.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 C-N-CA 118.67 -1.212 . . . . 0.0 107.763 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . . . . . . . . . 42.9 t -53.77 -63.26 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 119.077 -1.049 . . . . 0.0 110.325 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.13 -38.31 57.09 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 119.581 -0.847 . . . . 0.0 111.875 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -63.24 -30.57 71.68 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.481 -0.887 . . . . 0.0 112.979 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . 0.65 ' C ' HD12 ' R' ' 61' ' ' LEU . 0.4 OUTLIER -85.14 -27.55 26.14 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.413 -1.315 . . . . 0.0 111.451 -179.841 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.304 -1.407 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.184 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . . . . . . 0 N--CA 1.484 1.272 0 CA-C-O 120.861 0.362 . . . . 0.0 110.404 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . -34.71 129.33 0.59 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.439 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.913 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -35.91 -29.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-N 115.391 -0.404 . . . . 0.0 111.289 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -52.83 -1.17 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.328 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . 0.52 ' H ' ' C ' ' R' ' 79' ' ' ILE . 2.2 t -101.11 -36.68 8.88 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.665 -0.814 . . . . 0.0 112.583 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . 0.424 HG21 HD13 ' R' ' 82' ' ' ILE . 12.7 pt -79.99 3.77 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.711 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.527 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.2 OUTLIER -77.25 -51.5 10.8 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.051 -1.06 . . . . 0.0 110.148 179.865 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . 0.401 ' N ' ' OG1' ' R' ' 83' ' ' THR . 3.6 ptm180 -81.33 -12.09 59.13 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.477 -0.889 . . . . 0.0 110.685 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.28 -42.66 4.23 Favored Glycine 0 N--CA 1.488 2.158 0 C-N-CA 119.46 -1.352 . . . . 0.0 110.161 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 10.1 t -54.59 -50.81 67.15 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.468 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.1 OUTLIER -93.18 -78.72 0.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.42 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . 0.479 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.2 OUTLIER 73.57 -40.57 0.47 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.409 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . 0.462 ' H ' ' C ' ' R' ' 87' ' ' ASN . 8.4 mt -49.64 -21.23 0.96 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.141 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . 0.404 ' N ' ' C ' ' R' ' 88' ' ' SER . 4.5 mmtp -45.09 -62.56 1.19 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.894 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.36 -26.99 65.86 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.037 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' R' ' 89' ' ' LEU . . . 41.57 65.54 4.55 Favored Pre-proline 0 C--N 1.302 -1.459 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.324 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' R' ' 95' ' ' GLU . 11.9 Cg_endo -78.67 100.24 1.34 Allowed 'Trans proline' 0 C--N 1.314 -1.259 0 C-N-CA 121.591 1.528 . . . . 0.0 110.33 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . 0.537 HG12 ' NE2' ' R' ' 98' ' ' GLN . 2.9 t -67.17 10.69 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.63 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . 0.484 ' H ' ' C ' ' R' ' 93' ' ' PRO . 6.6 mt-10 -89.08 -37.64 14.95 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.749 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.12 -56.11 11.37 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.563 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -50.06 -18.0 0.49 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.425 -0.91 . . . . 0.0 111.086 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . 0.537 ' NE2' HG12 ' R' ' 94' ' ' VAL . 44.0 mt-30 -93.12 -26.61 17.37 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.574 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.68 ' CE3' HG21 ' R' ' 103' ' ' VAL . 4.9 t90 -110.62 -62.43 1.53 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.643 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.472 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.98 -30.3 0.26 Allowed 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.46 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' R' ' 100' ' ' LEU . 18.9 pt-20 -47.08 -36.65 8.43 Favored 'General case' 0 C--N 1.293 -1.861 0 C-N-CA 117.468 -1.693 . . . . 0.0 106.978 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . 0.472 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 4.5 mt-10 -92.04 -28.7 17.01 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.385 -1.734 . . . . 0.0 112.533 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.68 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.2 t -89.74 -7.21 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 C-N-CA 117.423 -1.711 . . . . 0.0 110.417 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' R' ' 104' ' ' LEU . 21.1 tp -99.19 -53.18 3.31 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.907 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . 0.47 ' N ' HD22 ' R' ' 105' ' ' LEU . 4.0 mm? -71.22 -66.16 0.65 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.874 -1.13 . . . . 0.0 110.207 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 24.6 tttt . . . . . 0 N--CA 1.487 1.392 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.538 179.961 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 16' ' ' HIS . 14.5 ttm-85 . . . . . 0 N--CA 1.483 1.213 0 CA-C-O 120.856 0.36 . . . . 0.0 111.255 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . 0.419 ' C ' ' O ' ' S' ' 15' ' ' ARG . 20.8 t-160 33.75 66.57 0.24 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.654 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -117.56 -85.09 0.64 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.042 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' S' ' 21' ' ' ARG . 47.4 mt-10 -75.13 -21.4 58.87 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 122.852 1.311 . . . . 0.0 107.639 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.281 32.0 t-105 -42.19 -43.94 3.55 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 112.803 -1.999 . . . . 0.0 108.294 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.43 -44.98 92.81 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 112.213 -2.267 . . . . 0.0 109.6 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' S' ' 23' ' ' VAL . 3.1 mmm180 -49.96 -69.11 0.12 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 118.393 -1.323 . . . . 0.0 109.925 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.488 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.48 -36.2 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.82 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.496 ' N ' ' O ' ' S' ' 21' ' ' ARG . 31.3 t -78.99 -64.99 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.852 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.412 ' C ' ' O ' ' S' ' 23' ' ' VAL . 25.2 t0 -34.29 -48.08 0.32 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.665 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.408 ' N ' HD23 ' S' ' 25' ' ' LEU . 3.3 mt -74.69 -49.11 22.48 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.951 -1.1 . . . . 0.0 110.237 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.428 HD12 HD11 ' S' ' 39' ' ' LEU . 4.2 tt -44.83 -28.59 0.66 Allowed 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.248 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -90.11 -68.94 0.75 Allowed 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.913 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . 0.637 HD22 ' N ' ' S' ' 28' ' ' ASN . 1.5 m120 -41.38 -29.03 0.13 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.75 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . 0.464 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -86.11 -31.98 21.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.675 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -43.73 -44.86 6.84 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 119.085 -1.046 . . . . 0.0 110.566 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -32.48 63.11 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.464 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.571 ' ND2' ' NE1' ' R' ' 99' ' ' TRP . 3.8 t-20 -79.05 -10.33 59.8 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.937 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.4 m-20 72.95 9.92 5.39 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.383 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -0.62 57.78 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 118.933 -1.107 . . . . 0.0 109.977 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . 0.459 ' O ' HD13 ' S' ' 39' ' ' LEU . 3.8 p-80 -57.23 -23.96 51.48 Favored 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.755 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.463 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.6 mt -70.44 -63.51 1.67 Allowed Pre-proline 0 C--N 1.306 -1.297 0 C-N-CA 118.534 -1.266 . . . . 0.0 110.608 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -51.3 -31.29 36.85 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 120.951 1.101 . . . . 0.0 110.63 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . 0.435 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.4 mp -78.44 -36.89 44.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.432 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.459 HD13 ' O ' ' S' ' 35' ' ' HIS . 0.3 OUTLIER -62.25 -20.92 64.74 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.241 179.842 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -2.94 49.68 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.224 -0.991 . . . . 0.0 109.591 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . 0.509 ' C ' ' H ' ' S' ' 43' ' ' LEU . 7.4 mp -106.78 -70.94 0.77 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.854 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . 0.435 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.0 OUTLIER -78.87 43.68 0.51 Allowed 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.832 -1.147 . . . . 0.0 108.843 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' S' ' 41' ' ' LEU . 0.1 OUTLIER 177.38 124.01 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 105.334 -2.098 . . . . 0.0 105.334 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.581 ' HB ' ' CD ' ' S' ' 45' ' ' PRO 0.316 13.7 m -121.29 -96.15 0.0 OUTLIER Pre-proline 0 CA--C 1.587 2.368 0 CA-C-O 115.731 -2.08 . . . . 0.0 113.485 -179.426 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.581 ' CD ' ' HB ' ' S' ' 44' ' ' THR . 57.3 Cg_endo -107.3 -64.78 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.485 0 CA-C-N 125.235 2.905 . . . . 0.0 111.766 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . 0.511 ' H ' ' CG ' ' S' ' 45' ' ' PRO . 0.1 OUTLIER -50.7 -27.66 7.49 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.037 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . 0.662 ' O ' HD13 ' S' ' 51' ' ' LEU . 21.0 mp0 -66.79 -45.83 77.21 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.41 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -71.19 -37.32 72.13 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.202 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.12 -68.94 0.22 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.573 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -46.6 -38.62 9.83 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.266 -0.973 . . . . 0.0 110.518 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . 0.662 HD13 ' O ' ' S' ' 47' ' ' GLU . 1.7 mp -53.54 -51.56 62.49 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.433 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -46.27 93.82 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 118.842 -1.647 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -44.89 -79.82 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.544 0.688 . . . . 0.0 111.113 179.893 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.678 ' HE ' ' N ' ' S' ' 55' ' ' VAL . 0.1 OUTLIER -44.8 -47.18 10.94 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 115.133 -0.939 . . . . 0.0 112.182 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . 0.678 ' N ' ' HE ' ' S' ' 54' ' ' ARG . 54.7 t -56.5 -28.87 27.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 C-N-CA 117.76 -1.576 . . . . 0.0 109.281 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' S' ' 53' ' ' THR . 36.1 mtp85 -84.51 -36.48 22.18 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.805 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 1.018 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -70.57 -32.28 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 C-N-CA 116.032 -2.267 . . . . 0.0 106.695 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . 1.018 ' N ' HD13 ' S' ' 57' ' ' ILE . 7.1 t -59.95 -63.36 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 118.982 -1.087 . . . . 0.0 108.521 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . 0.471 ' OE2' ' CZ ' ' R' ' 21' ' ' ARG . 23.1 mt-10 -49.07 -29.56 5.26 Favored 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.294 -0.963 . . . . 0.0 110.215 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -34.68 44.36 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.472 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . 0.516 ' C ' ' H ' ' S' ' 63' ' ' ARG . 17.3 mt -57.4 -33.31 67.72 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.221 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 49.3 tp -60.95 -7.92 2.8 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 119.289 -0.964 . . . . 0.0 108.468 179.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . 0.516 ' H ' ' C ' ' S' ' 61' ' ' LEU . 4.0 ptt180 . . . . . 0 N--CA 1.507 2.413 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -179.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . 0.463 ' O ' ' CG ' ' S' ' 72' ' ' LYS . 6.7 ptmm? . . . . . 0 N--CA 1.486 1.355 0 CA-C-O 120.856 0.36 . . . . 0.0 111.033 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' S' ' 74' ' ' GLU . 38.0 t-20 -125.62 -99.71 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.896 0.855 . . . . 0.0 110.885 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . 0.455 ' N ' ' OD1' ' S' ' 73' ' ' ASN . 0.0 OUTLIER -140.04 -23.35 0.84 Allowed 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.008 -1.451 . . . . 0.0 110.98 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 tp -111.12 -14.51 13.87 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.317 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -53.91 -80.73 0.07 OUTLIER Glycine 0 N--CA 1.49 2.269 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.47 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -178.35 -91.31 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.386 -0.925 . . . . 0.0 111.003 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . 0.481 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -167.94 136.11 3.95 Favored Glycine 0 N--CA 1.491 2.316 0 C-N-CA 119.196 -1.478 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.903 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.43 -28.35 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.434 -0.383 . . . . 0.0 111.289 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -67.46 -65.82 0.64 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.701 -0.8 . . . . 0.0 112.588 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . 0.487 HG22 HG23 ' S' ' 82' ' ' ILE . 0.6 OUTLIER -48.13 -27.56 2.42 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . 0.487 HG23 HG22 ' S' ' 81' ' ' THR . 15.7 pt -92.48 -21.61 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 C-N-CA 118.701 -1.199 . . . . 0.0 112.706 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.418 ' O ' ' OD1' ' S' ' 87' ' ' ASN . 0.0 OUTLIER -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.479 -1.288 . . . . 0.0 110.584 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . 0.772 ' HE ' ' H ' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -76.34 -28.46 56.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.64 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.66 -4.5 4.15 Favored Glycine 0 N--CA 1.485 1.922 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . 0.469 ' H ' ' C ' ' S' ' 84' ' ' ARG . 0.4 OUTLIER -138.38 -63.33 0.55 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.759 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . 0.521 ' O ' ' N ' ' S' ' 89' ' ' LEU . 32.5 m120 -48.04 -16.66 0.09 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.345 -0.942 . . . . 0.0 110.756 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . 0.543 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -41.07 -21.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.991 -0.684 . . . . 0.0 111.372 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' S' ' 87' ' ' ASN . 5.4 mt -39.56 -21.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.713 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . 0.543 ' N ' ' O ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -75.36 -61.76 1.79 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.812 -1.155 . . . . 0.0 110.51 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -46.69 -62.1 1.53 Allowed 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.689 -1.142 . . . . 0.0 110.752 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 46.03 68.18 3.63 Favored Pre-proline 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.266 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . 0.4 ' HB2' HD12 ' S' ' 96' ' ' LEU . 1.9 Cg_endo -66.01 107.16 1.08 Allowed 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 121.532 1.488 . . . . 0.0 111.267 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . 0.4 ' C ' ' N ' ' S' ' 96' ' ' LEU . 57.4 t -77.45 -35.76 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -54.84 -10.22 0.44 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.904 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . 0.498 ' HB3' HD23 ' S' ' 100' ' ' LEU . 79.3 mt -103.46 -21.9 13.72 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.205 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.06 -29.04 27.76 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.254 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -94.74 -16.68 22.85 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.674 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 10.6 t90 -91.41 -58.87 2.3 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.827 -0.749 . . . . 0.0 111.143 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.536 HD12 HD13 ' S' ' 104' ' ' LEU . 1.8 mm? -38.41 -34.07 0.12 Allowed 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.467 ' C ' ' O ' ' S' ' 100' ' ' LEU . 31.2 mt-10 -45.43 -38.66 6.26 Favored 'General case' 0 C--N 1.297 -1.713 0 C-N-CA 117.661 -1.616 . . . . 0.0 107.177 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -86.29 -29.43 23.06 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.506 -1.679 . . . . 0.0 112.579 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.674 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 4.0 t -83.31 -18.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 116.787 -1.965 . . . . 0.0 111.862 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . 0.536 HD13 HD12 ' S' ' 100' ' ' LEU . 1.4 tp -101.09 -61.67 1.34 Allowed 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.314 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 34.9 mt -57.58 -74.57 0.05 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.111 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 40.5 tttt -42.0 -50.66 4.59 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.904 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 43.6 t . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 116.375 -1.774 . . . . 0.0 110.704 179.968 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 121.125 0.488 . . . . 0.0 111.06 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . 0.411 ' H ' ' H ' ' R' ' 17' ' ' GLN . 0.4 OUTLIER -159.08 -15.89 0.06 Allowed 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.565 179.973 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.411 ' H ' ' H ' ' R' ' 16' ' ' HIS . 9.7 tt0 -86.23 -85.7 0.15 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.879 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . 0.407 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.4 OUTLIER -45.27 -34.32 2.82 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.628 1.204 . . . . 0.0 108.122 179.762 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CH2' ' CD ' ' S' ' 47' ' ' GLU . 22.7 t-105 -55.04 -55.13 34.36 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.151 -1.84 . . . . 0.0 108.59 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . 0.733 ' C ' HD13 ' R' ' 20' ' ' LEU . 2.4 tm? -57.25 -38.68 74.21 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.432 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.512 ' O ' ' C ' ' R' ' 22' ' ' PHE . 17.7 mmt180 -50.42 -73.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.416 -1.314 . . . . 0.0 110.553 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.512 ' C ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t80 -31.02 -41.91 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.087 -1.045 . . . . 0.0 111.842 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' R' ' 21' ' ' ARG . 10.9 t -69.76 -57.91 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.403 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.477 ' OD2' HD23 ' R' ' 25' ' ' LEU . 1.4 t70 -39.71 -60.21 1.02 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.633 -0.827 . . . . 0.0 111.522 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.687 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -52.72 -53.01 53.68 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.234 -1.386 . . . . 0.0 109.585 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . 0.436 ' C ' HD23 ' R' ' 26' ' ' LEU . 1.2 tt -39.83 -64.43 0.49 Allowed 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.351 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . 0.575 ' NZ ' ' CD1' ' S' ' 30' ' ' TYR . 0.4 OUTLIER -53.44 -76.11 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.868 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . 0.537 ' H ' HD22 ' R' ' 28' ' ' ASN . 5.5 m-80 -34.85 -49.33 0.43 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.436 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -63.48 -55.35 24.78 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.409 -0.916 . . . . 0.0 113.078 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . 0.465 ' CE2' HG11 ' S' ' 23' ' ' VAL . 4.9 t80 -40.7 -37.62 0.77 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.774 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -47.37 -43.8 23.55 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.792 -1.163 . . . . 0.0 109.951 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -95.62 -78.25 0.46 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.9 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 169.81 24.71 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.965 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 1.0 OUTLIER -95.85 -9.66 30.92 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.074 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . 0.491 ' O ' HD22 ' R' ' 39' ' ' LEU . 11.1 p-80 -54.02 -30.85 49.27 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.476 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.476 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 9.0 mt -68.28 -58.69 7.08 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 117.878 -1.529 . . . . 0.0 110.318 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.6 Cg_exo -55.18 -43.28 60.54 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 120.563 0.842 . . . . 0.0 110.685 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' R' ' 38' ' ' LEU . 0.6 OUTLIER -61.49 -43.45 98.84 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.651 0.739 . . . . 0.0 110.387 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.527 HD23 ' HZ2' ' S' ' 19' ' ' TRP . 0.1 OUTLIER -52.3 -48.43 65.37 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.141 179.787 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.57 -5.85 0.25 Allowed 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.656 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 7.9 mp -102.58 -60.18 1.58 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.726 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.14 50.98 1.19 Allowed 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 118.715 -1.194 . . . . 0.0 109.399 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . 0.422 HD23 ' C ' ' R' ' 43' ' ' LEU . 0.2 OUTLIER 173.22 144.89 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.561 -1.199 . . . . 0.0 108.057 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -169.21 -43.42 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 115.396 -2.522 . . . . 0.0 117.051 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -104.2 -98.19 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 115.338 1.246 . . . . 0.0 115.338 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.84 -26.19 2.28 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.833 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.787 ' O ' HD13 ' R' ' 51' ' ' LEU . 6.6 mm-40 -51.8 -66.18 0.43 Allowed 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.858 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mmm-85 -58.19 -38.45 76.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.79 -0.764 . . . . 0.0 112.009 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -71.6 -67.18 0.54 Allowed 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.928 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.606 ' HB1' ' NH1' ' R' ' 54' ' ' ARG . . . -47.9 -30.28 4.03 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.994 -0.683 . . . . 0.0 112.731 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . 0.787 HD13 ' O ' ' R' ' 47' ' ' GLU . 4.6 mp -63.88 -67.43 0.43 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 119.237 -0.985 . . . . 0.0 111.65 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.74 -29.55 4.3 Favored Glycine 0 N--CA 1.487 2.089 0 C-N-CA 118.982 -1.58 . . . . 0.0 110.233 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.462 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -65.1 -81.69 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.803 -179.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.606 ' NH1' ' HB1' ' R' ' 50' ' ' ALA . 10.7 ptp180 -43.31 -43.9 5.21 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.733 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.2 t -62.8 -30.43 49.42 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 C-N-CA 118.341 -1.344 . . . . 0.0 110.296 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' R' ' 53' ' ' THR . 21.1 mtp85 -79.53 -39.62 31.52 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.08 -1.048 . . . . 0.0 111.357 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 1.03 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.47 -32.77 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 117.008 -1.877 . . . . 0.0 108.289 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 1.03 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.7 t -59.23 -61.21 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 118.75 -1.18 . . . . 0.0 108.484 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.437 ' N ' HG12 ' R' ' 58' ' ' VAL . 28.5 mt-10 -52.12 -30.93 28.61 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.962 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.18 -33.08 75.15 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.416 -0.913 . . . . 0.0 111.471 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . 0.654 ' C ' HD12 ' R' ' 61' ' ' LEU . 0.4 OUTLIER -75.1 -28.93 60.47 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.731 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mt . . . . . 0 N--CA 1.486 1.33 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.677 179.842 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.508 0 CA-C-O 120.698 0.285 . . . . 0.0 110.869 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 172.73 158.54 17.27 Favored Glycine 0 N--CA 1.492 2.407 0 C-N-CA 118.994 -1.574 . . . . 0.0 111.069 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.907 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -36.59 -27.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 CA-C-N 115.345 -0.428 . . . . 0.0 111.753 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.518 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -65.35 -78.39 0.05 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.401 -0.92 . . . . 0.0 112.683 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . 0.444 HG22 HG23 ' R' ' 82' ' ' ILE . 0.5 OUTLIER -37.47 -31.31 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -179.724 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . 0.489 HD11 ' HA ' ' R' ' 79' ' ' ILE . 22.1 pt -87.06 -28.91 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 C-N-CA 118.418 -1.313 . . . . 0.0 112.85 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.464 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -54.63 -63.69 1.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 118.343 -1.343 . . . . 0.0 110.605 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . 0.77 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -62.58 -24.86 67.77 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 119.323 -0.951 . . . . 0.0 110.312 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.05 4.3 3.43 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.331 -1.414 . . . . 0.0 109.76 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . 0.486 ' H ' ' C ' ' R' ' 84' ' ' ARG . 33.9 t -138.77 -43.54 0.48 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.618 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -92.96 10.33 31.75 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -42.21 -40.15 2.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.297 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.13 -74.85 0.06 Allowed 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.664 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' R' ' 91' ' ' ALA . 10.9 tptm -41.1 -50.07 3.43 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.525 0.678 . . . . 0.0 111.761 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.64 -62.32 0.36 Allowed 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 113.911 -1.495 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.688 ' HB3' ' HD3' ' R' ' 93' ' ' PRO . . . -174.34 -54.21 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 118.514 -1.274 . . . . 0.0 113.241 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . 0.688 ' HD3' ' HB3' ' R' ' 92' ' ' ALA . 5.4 Cg_exo -57.25 89.38 0.05 OUTLIER 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 120.196 0.597 . . . . 0.0 111.0 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . 0.595 HG23 ' O ' ' R' ' 92' ' ' ALA . 61.8 t -110.65 -45.59 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.442 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -67.73 -18.1 64.78 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.291 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.15 -43.45 61.24 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.943 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -35.57 59.62 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.296 -0.961 . . . . 0.0 110.707 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.47 -23.18 5.71 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.503 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.655 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.8 t90 -106.29 -62.19 1.42 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.179 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.471 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -40.74 -30.85 0.13 Allowed 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.104 -1.038 . . . . 0.0 113.704 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.503 ' O ' HD22 ' R' ' 105' ' ' LEU . 11.0 pt-20 -46.46 -36.32 6.5 Favored 'General case' 0 C--N 1.297 -1.712 0 C-N-CA 117.529 -1.669 . . . . 0.0 107.121 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . 0.476 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 3.6 mt-10 -91.37 -28.45 17.69 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-N 113.235 -1.802 . . . . 0.0 112.282 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.655 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.1 t -93.15 -1.34 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 117.601 -1.64 . . . . 0.0 110.67 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . 0.467 ' N ' ' O ' ' R' ' 100' ' ' LEU . 26.4 tp -105.6 -51.55 2.98 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.757 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . 0.85 HD23 ' N ' ' R' ' 106' ' ' LYS . 0.1 OUTLIER -72.79 -10.15 59.47 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 119.285 -0.966 . . . . 0.0 111.18 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . 0.85 ' N ' HD23 ' R' ' 105' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.519 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.015 -179.994 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 11.3 ptt180 . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 121.129 0.49 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -146.82 -20.21 0.41 Allowed 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.043 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.453 ' C ' ' N ' ' S' ' 19' ' ' TRP . 0.9 OUTLIER -92.51 -82.99 0.31 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.389 179.808 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -45.4 -29.32 1.05 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.822 1.296 . . . . 0.0 108.194 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . 0.527 ' HZ2' HD23 ' R' ' 39' ' ' LEU . 24.4 t-105 -58.62 -59.87 4.72 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 112.862 -1.972 . . . . 0.0 109.911 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . 0.848 ' O ' HD12 ' S' ' 20' ' ' LEU . 0.3 OUTLIER -58.99 -19.03 39.7 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.968 -1.469 . . . . 0.0 111.081 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' S' ' 22' ' ' PHE . 12.1 mmt180 -67.82 -65.14 0.73 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.003 -1.479 . . . . 0.0 108.974 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.438 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.6 t80 -39.5 -41.69 1.03 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.303 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.465 HG11 ' CE2' ' R' ' 30' ' ' TYR . 85.5 t -71.09 -48.36 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.794 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -40.28 -64.44 0.51 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.492 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.52 HD23 ' N ' ' S' ' 25' ' ' LEU . 1.9 mt -53.02 -53.4 50.64 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 118.73 -1.188 . . . . 0.0 109.184 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.68 -1.08 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.297 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . 0.468 ' H ' ' C ' ' S' ' 25' ' ' LEU . 25.0 tttm -88.05 -68.48 0.76 Allowed 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.389 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.88 -3.2 50.46 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.363 -0.935 . . . . 0.0 112.139 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . 0.466 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -74.32 -53.27 10.01 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.919 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . 0.575 ' CD1' ' NZ ' ' R' ' 27' ' ' LYS . 14.6 t80 -41.65 -42.14 2.42 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.25 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -45.58 -42.3 10.96 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.57 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.414 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 0.0 OUTLIER -97.37 -77.65 0.49 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.177 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' S' ' 32' ' ' ASN . 0.5 OUTLIER 169.66 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 0.8 OUTLIER -92.82 -15.35 26.61 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.062 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -51.15 -20.75 1.63 Allowed 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.186 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.466 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.0 mt -80.21 -65.03 0.29 Allowed Pre-proline 0 C--N 1.306 -1.302 0 C-N-CA 118.335 -1.346 . . . . 0.0 110.647 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.526 ' O ' ' ND2' ' S' ' 40' ' ' ASN . 2.6 Cg_endo -51.88 -21.32 11.64 Favored 'Trans proline' 0 C--N 1.32 -0.938 0 N-CA-C 109.775 -0.894 . . . . 0.0 109.775 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 49.1 mt -79.87 -38.7 32.13 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.609 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.3 OUTLIER -59.7 -24.75 64.23 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.758 179.696 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . 0.526 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.0 OUTLIER -97.06 10.37 39.49 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.744 179.747 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tp -108.47 -67.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -99.33 36.79 1.67 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 119.019 -1.073 . . . . 0.0 112.143 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . 0.612 HD21 ' HG3' ' S' ' 47' ' ' GLU . 24.1 tp 172.74 146.04 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.52 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.7 OUTLIER 177.98 -46.94 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 117.169 -1.812 . . . . 0.0 114.921 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.52 ' HD2' ' H ' ' S' ' 44' ' ' THR . 6.0 Cg_endo -68.42 -83.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 120.361 0.707 . . . . 0.0 111.584 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . 0.701 ' O ' ' HB3' ' S' ' 50' ' ' ALA . 3.0 p-10 -49.73 -14.42 0.13 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 119.005 -1.078 . . . . 0.0 109.715 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . 0.612 ' HG3' HD21 ' S' ' 43' ' ' LEU . 10.5 tt0 -71.77 -74.94 0.14 Allowed 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.281 -0.967 . . . . 0.0 111.284 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.77 -25.03 0.15 Allowed 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 119.592 -0.843 . . . . 0.0 110.945 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' O ' ' S' ' 47' ' ' GLU . 4.2 mm-40 -100.51 -65.03 0.99 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.978 -1.089 . . . . 0.0 112.786 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' S' ' 46' ' ' ASP . . . -61.82 -42.19 98.71 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.075 -1.05 . . . . 0.0 112.985 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . 0.487 HD12 HH21 ' S' ' 54' ' ' ARG . 1.8 tp -54.45 -49.73 69.36 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.761 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.82 -35.76 83.9 Favored Glycine 0 N--CA 1.492 2.373 0 C-N-CA 118.797 -1.668 . . . . 0.0 109.744 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.467 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -64.83 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 115.006 -0.597 . . . . 0.0 112.563 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.501 ' O ' HG23 ' S' ' 58' ' ' VAL . 4.5 ptt180 -42.41 -29.4 0.27 Allowed 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.834 -0.746 . . . . 0.0 112.393 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . 0.407 HG23 ' O ' ' S' ' 51' ' ' LEU . 71.7 t -76.47 -31.78 20.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 117.817 -1.553 . . . . 0.0 109.407 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' S' ' 53' ' ' THR . 10.8 mtp180 -63.6 -46.7 84.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 118.894 -1.123 . . . . 0.0 109.825 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 0.42 HD13 ' N ' ' S' ' 57' ' ' ILE . 0.0 OUTLIER -71.68 -57.33 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 C-N-CA 118.024 -1.47 . . . . 0.0 110.219 179.918 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . 0.501 HG23 ' O ' ' S' ' 54' ' ' ARG . 84.8 t -47.26 -64.58 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 C-N-CA 118.288 -1.365 . . . . 0.0 111.459 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.63 -28.72 22.6 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.48 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -80.94 -47.24 13.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 118.474 -1.29 . . . . 0.0 112.789 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . 0.454 HD22 ' O ' ' S' ' 85' ' ' GLY . 2.1 pp -70.09 -5.23 25.42 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 117.859 -1.536 . . . . 0.0 110.613 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . 0.423 ' HA ' HD22 ' S' ' 62' ' ' LEU . 0.2 OUTLIER -71.06 -61.97 1.57 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.429 179.748 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 . . . . . 0 N--CA 1.493 1.714 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.508 179.891 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.982 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . 0.484 ' CG ' ' N ' ' S' ' 74' ' ' GLU . 1.1 t-20 -97.25 -95.7 0.21 Allowed 'General case' 0 C--N 1.297 -1.701 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.551 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' S' ' 73' ' ' ASN . 18.2 mt-10 -163.31 -43.1 0.03 OUTLIER 'General case' 0 C--N 1.278 -2.538 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.36 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . 0.458 ' HA ' HD13 ' S' ' 75' ' ' LEU . 0.1 OUTLIER -114.72 -30.74 6.38 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.56 -1.655 . . . . 0.0 111.181 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -36.79 -73.59 0.12 Allowed Glycine 0 N--CA 1.497 2.745 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.208 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . 0.542 ' O ' ' O ' ' S' ' 78' ' ' GLY . . . -166.69 64.8 0.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.075 -1.05 . . . . 0.0 111.429 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' S' ' 77' ' ' ALA . . . 29.96 -162.89 0.0 OUTLIER Glycine 0 N--CA 1.5 2.928 0 CA-C-N 114.933 -1.031 . . . . 0.0 112.628 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.709 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.2 OUTLIER -110.63 -18.92 7.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-N 114.679 -0.761 . . . . 0.0 111.96 179.873 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.28 86.27 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.338 -1.345 . . . . 0.0 111.135 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 47.1 m -46.68 -61.94 1.61 Allowed 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 8.0 pt -64.75 -2.58 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.27 -41.62 8.57 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.398 -1.321 . . . . 0.0 113.511 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -62.95 -12.98 29.2 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . 0.454 ' O ' HD22 ' S' ' 61' ' ' LEU . . . -99.75 25.52 27.94 Favored Glycine 0 N--CA 1.5 2.921 0 C-N-CA 119.148 -1.501 . . . . 0.0 111.023 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -119.44 -31.34 4.64 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.432 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . 0.433 ' ND2' ' N ' ' S' ' 87' ' ' ASN . 0.0 OUTLIER -100.08 -21.01 15.75 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.689 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.35 -23.59 0.97 Allowed 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.683 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 34.9 mt -63.65 -39.01 93.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.361 -0.935 . . . . 0.0 112.113 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.76 -28.32 17.46 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 118.666 -1.214 . . . . 0.0 111.282 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -43.47 -57.77 2.93 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 114.972 -1.013 . . . . 0.0 112.888 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . 0.672 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . -158.8 -58.79 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.766 0 C-N-CA 118.556 -1.258 . . . . 0.0 114.014 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . 0.672 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 6.5 Cg_exo -45.98 89.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.325 -0.684 0 C-N-CA 120.607 0.871 . . . . 0.0 112.224 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . 0.519 ' N ' ' O ' ' S' ' 92' ' ' ALA . 2.4 t -111.2 -28.83 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.479 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.19 -25.31 68.28 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.91 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' S' ' 97' ' ' ARG . 8.7 mp -45.91 -48.78 16.12 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.746 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' S' ' 96' ' ' LEU . 0.3 OUTLIER -42.64 -47.14 5.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.57 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -61.28 -46.11 91.71 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.915 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.654 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 9.6 t90 -74.42 -62.04 1.66 Allowed 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.925 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.473 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -34.64 -39.67 0.09 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' S' ' 100' ' ' LEU . 2.0 mm-40 -42.27 -42.87 3.23 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.048 -1.461 . . . . 0.0 107.135 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -82.86 -27.06 31.03 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.894 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.654 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 8.0 t -83.4 -39.14 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 C-N-CA 116.66 -2.016 . . . . 0.0 112.962 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.55 -50.17 7.03 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 118.743 -1.183 . . . . 0.0 111.35 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . 0.58 HD22 ' H ' ' S' ' 105' ' ' LEU . 1.0 OUTLIER -87.15 11.74 13.25 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.913 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' S' ' 105' ' ' LEU . 21.2 tttm -32.3 -41.87 0.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.598 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.873 -179.977 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.825 0.345 . . . . 0.0 110.825 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 9.75 10.39 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.125 -1.03 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.425 ' C ' ' N ' ' R' ' 19' ' ' TRP . 6.2 tt0 -85.7 -84.36 0.16 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.66 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . 0.4 ' H ' ' HB3' ' R' ' 17' ' ' GLN . 0.8 OUTLIER -44.63 -30.84 0.99 Allowed 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 122.897 1.332 . . . . 0.0 109.008 179.791 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . 0.425 ' N ' ' C ' ' R' ' 17' ' ' GLN . 54.3 t-105 -55.12 -56.75 16.33 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.804 -1.998 . . . . 0.0 109.059 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.3 tp -51.85 -38.16 54.87 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.898 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' R' ' 22' ' ' PHE . 21.9 mtp180 -56.82 -64.34 0.91 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.781 -1.168 . . . . 0.0 111.195 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.474 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -35.82 -48.12 0.54 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 118.813 -1.155 . . . . 0.0 111.435 179.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . 0.471 ' O ' ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -76.61 -68.44 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.975 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 9.0 t70 -39.84 -28.49 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.112 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.471 ' N ' ' O ' ' R' ' 23' ' ' VAL . 10.2 tp -77.73 -56.77 4.24 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.347 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 tt -41.09 -59.43 1.49 Allowed 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . 0.426 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.1 OUTLIER -54.45 -60.9 2.72 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.287 -0.965 . . . . 0.0 111.088 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -43.21 -24.29 0.08 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.401 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -97.9 -31.89 11.96 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.197 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -50.73 -38.08 45.45 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 118.794 -1.163 . . . . 0.0 110.105 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -27.37 69.09 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.082 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . 0.437 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.4 m120 -101.61 -10.15 20.32 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.087 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . 0.437 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.5 m-20 75.71 17.32 2.35 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.413 0.625 . . . . 0.0 110.291 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -85.27 -15.33 43.81 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.621 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . 0.416 ' O ' HD13 ' R' ' 39' ' ' LEU . 9.5 p-80 -52.24 -13.94 0.39 Allowed 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.797 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 8.2 mt -79.27 -66.01 0.28 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 117.504 -1.679 . . . . 0.0 110.147 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.2 Cg_endo -53.98 -26.97 42.92 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 N-CA-C 109.501 -1.0 . . . . 0.0 109.501 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 1.5 tp -77.48 -35.53 53.6 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.947 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.424 ' HA ' HD12 ' R' ' 39' ' ' LEU . 0.3 OUTLIER -55.68 -33.74 64.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.602 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -74.64 5.18 5.12 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.256 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mt -113.23 -58.08 2.2 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 119.817 -0.753 . . . . 0.0 112.812 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.91 36.29 0.72 Allowed 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 118.381 -1.328 . . . . 0.0 112.876 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 165.24 140.64 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 114.719 -1.128 . . . . 0.0 108.591 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.649 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -33.35 0.0 OUTLIER Pre-proline 0 N--CA 1.496 1.838 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.649 ' CD ' ' H ' ' R' ' 44' ' ' THR . 34.9 Cg_endo -88.99 -103.16 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.146 0 C-N-CA 121.054 1.169 . . . . 0.0 112.16 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . 0.709 ' O ' ' HB3' ' R' ' 50' ' ' ALA . 0.6 OUTLIER -52.21 -13.56 0.34 Allowed 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.411 -179.883 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.475 ' N ' ' C ' ' R' ' 45' ' ' PRO . 7.1 mm-40 -69.79 -61.67 1.69 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.079 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -21.92 13.14 Favored 'General case' 0 C--N 1.299 -1.604 0 C-N-CA 118.94 -1.104 . . . . 0.0 110.39 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -108.08 -71.68 0.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.595 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' R' ' 46' ' ' ASP . . . -48.86 -36.99 18.25 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . 0.443 ' HG ' ' N ' ' R' ' 52' ' ' GLY . 0.2 OUTLIER -69.57 -38.67 77.48 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.932 -179.892 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . 0.443 ' N ' ' HG ' ' R' ' 51' ' ' LEU . . . -65.99 -28.14 73.42 Favored Glycine 0 N--CA 1.485 1.901 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.552 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -63.61 -79.45 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.54 -0.83 . . . . 0.0 110.594 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.45 ' HA ' HG23 ' R' ' 57' ' ' ILE . 1.2 ptp180 -36.02 -50.5 0.69 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 123.796 0.685 . . . . 0.0 111.286 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.69 -36.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 118.04 -1.464 . . . . 0.0 110.314 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' R' ' 53' ' ' THR . 2.8 mtm180 -75.37 -40.44 58.04 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.533 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 1.045 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -70.34 -38.99 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 116.869 -1.933 . . . . 0.0 109.532 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 1.045 ' N ' HD13 ' R' ' 57' ' ' ILE . 54.3 t -59.82 -59.28 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 117.73 -1.588 . . . . 0.0 109.33 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.59 -24.73 5.78 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.781 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.77 -50.73 16.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.942 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.89 -31.6 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.368 -0.933 . . . . 0.0 112.562 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tp . . . . . 0 N--CA 1.494 1.754 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.327 -179.946 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 87.56 97.34 0.9 Allowed Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.047 -1.549 . . . . 0.0 109.927 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.574 HD12 ' OG1' ' R' ' 83' ' ' THR . 0.1 OUTLIER -20.71 -44.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.499 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -50.01 -12.83 0.09 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.285 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . 0.426 ' N ' ' O ' ' R' ' 79' ' ' ILE . 17.0 m -88.95 -51.13 5.78 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . 0.424 ' H ' HG23 ' R' ' 82' ' ' ILE . 0.8 OUTLIER -80.5 6.83 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.574 ' OG1' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -105.34 -13.55 15.62 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.649 -1.22 . . . . 0.0 112.737 -179.92 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -96.73 -33.52 11.68 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.408 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.35 -29.34 2.51 Favored Glycine 0 N--CA 1.484 1.89 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.729 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.41 -50.69 4.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 118.629 -1.229 . . . . 0.0 112.219 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . 0.539 ' N ' ' OD1' ' R' ' 87' ' ' ASN . 0.7 OUTLIER -68.14 5.83 0.87 Allowed 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.651 -0.82 . . . . 0.0 112.489 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 42.5 m -116.45 -46.9 2.76 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.401 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.2 tt -46.65 -36.4 6.98 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.199 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -66.14 -70.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 122.062 0.935 . . . . 0.0 112.393 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 92' ' ' ALA . . . -58.86 -82.52 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 113.813 -1.54 . . . . 0.0 112.781 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 91' ' ' ALA . . . 58.1 150.27 0.07 OUTLIER Pre-proline 0 N--CA 1.492 1.634 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.037 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -54.3 152.88 23.99 Favored 'Trans proline' 0 C--O 1.214 -0.701 0 C-N-CA 121.079 1.186 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 33.5 t -74.51 -61.49 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 C-N-CA 119.36 -0.936 . . . . 0.0 112.992 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.46 -16.98 41.85 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.466 -0.893 . . . . 0.0 112.997 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . 0.525 ' C ' HD13 ' R' ' 96' ' ' LEU . 3.1 tm? -79.6 -35.72 39.15 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 118.775 -1.17 . . . . 0.0 111.308 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.85 -24.97 55.8 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 118.892 -1.123 . . . . 0.0 109.918 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -65.69 -19.3 65.85 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.053 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.652 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 21.0 t90 -97.16 -55.02 2.98 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.99 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.581 HD13 ' HB ' ' R' ' 103' ' ' VAL . 2.0 mm? -39.59 -28.84 0.05 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.02 -1.072 . . . . 0.0 113.542 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' R' ' 100' ' ' LEU . 10.2 mm-40 -47.1 -39.02 12.41 Favored 'General case' 0 C--N 1.292 -1.93 0 C-N-CA 117.717 -1.593 . . . . 0.0 107.519 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -89.47 -28.55 19.61 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 113.936 -1.483 . . . . 0.0 112.415 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.652 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 10.4 t -78.82 -34.0 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.16 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.0 -48.86 16.78 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.315 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . 0.739 ' C ' HD13 ' R' ' 105' ' ' LEU . 2.4 tm? -58.05 -44.04 87.22 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.837 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt . . . . . 0 N--CA 1.488 1.434 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.3 -179.979 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.369 0 CA-C-O 121.602 0.715 . . . . 0.0 110.684 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -117.46 12.6 14.23 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.447 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.478 ' C ' ' N ' ' S' ' 19' ' ' TRP . 1.2 mt-30 -89.62 -81.41 0.28 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.115 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 3.1 mp0 -42.12 -30.61 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 122.942 1.353 . . . . 0.0 108.158 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . 0.478 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.26 72.2 t-105 -56.44 -56.09 25.5 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.269 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' S' ' 17' ' ' GLN . 5.9 tp -58.87 -27.34 65.08 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.845 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.457 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.9 mtt85 -66.49 -74.42 0.11 Allowed 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.48 -1.288 . . . . 0.0 109.65 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.457 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -36.34 -42.45 0.32 Allowed 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.172 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.416 ' O ' ' C ' ' S' ' 24' ' ' ASP . 3.0 t -69.79 -56.03 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.7 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' S' ' 23' ' ' VAL . 22.6 t0 -35.94 -73.31 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.725 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.527 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.1 OUTLIER -49.97 -46.16 52.15 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.584 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.709 HD11 ' CD1' ' S' ' 39' ' ' LEU . 2.1 tp -45.18 -30.5 1.19 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.057 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.25 -71.77 0.34 Allowed 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.464 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -50.62 -27.04 6.11 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . 0.506 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -78.59 -50.1 12.1 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.94 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . 0.443 ' CD1' ' C ' ' S' ' 30' ' ' TYR . 11.2 t80 -44.55 -38.24 4.07 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.247 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -46.38 -37.23 7.29 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.711 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.65 -79.34 0.54 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.788 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 172.73 35.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.953 0.882 . . . . 0.0 109.322 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . 0.527 HD23 ' CD2' ' R' ' 99' ' ' TRP . 0.3 OUTLIER -100.95 -19.37 15.9 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.767 -179.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -57.08 -17.98 12.58 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.544 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.2 mt -76.84 -63.33 0.54 Allowed Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 118.263 -1.375 . . . . 0.0 110.304 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 5.4 Cg_exo -50.98 -32.0 36.66 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 N-CA-C 109.863 -0.861 . . . . 0.0 109.863 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 mt -67.85 -43.54 79.25 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.709 ' CD1' HD11 ' S' ' 26' ' ' LEU . 0.3 OUTLIER -54.78 -34.06 62.17 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.101 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -83.89 10.69 9.1 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.81 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.38 -63.58 1.39 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.929 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mtt -91.39 33.58 0.99 Allowed 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.709 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . 0.458 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.6 OUTLIER 164.91 142.23 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 O-C-N 123.439 0.462 . . . . 0.0 110.021 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.603 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.25 -42.41 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.313 0 C-N-CA 117.196 -1.802 . . . . 0.0 115.238 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.603 ' HD2' ' H ' ' S' ' 44' ' ' THR . 16.0 Cg_endo -76.64 -110.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 121.12 1.213 . . . . 0.0 113.403 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . 0.426 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 1.0 OUTLIER -51.28 -16.95 0.6 Allowed 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.49 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . 0.401 ' N ' ' C ' ' S' ' 45' ' ' PRO . 5.9 mm-40 -65.76 -66.99 0.48 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.016 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -51.82 -42.2 62.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.113 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.08 -68.9 0.31 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.051 -1.06 . . . . 0.0 112.208 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.44 -22.57 21.01 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.191 -1.004 . . . . 0.0 111.257 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . 0.436 HD11 ' CG ' ' R' ' 22' ' ' PHE . 5.7 tt -67.68 -53.27 29.08 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.87 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.69 -52.1 52.67 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.684 -1.766 . . . . 0.0 108.684 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.551 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.1 OUTLIER -39.83 -74.46 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.982 0.896 . . . . 0.0 111.071 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.569 ' HE ' ' CG2' ' S' ' 55' ' ' VAL . 0.0 OUTLIER -41.76 -39.03 1.61 Allowed 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 113.868 -1.514 . . . . 0.0 112.638 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . 0.569 ' CG2' ' HE ' ' S' ' 54' ' ' ARG . 13.4 t -73.6 -27.68 23.63 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 C-N-CA 117.874 -1.53 . . . . 0.0 108.209 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.1 OUTLIER -80.97 -35.28 32.33 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.91 -1.041 . . . . 0.0 112.306 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 1.009 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -73.08 -35.98 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 116.662 -2.015 . . . . 0.0 106.997 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . 1.009 ' N ' HD13 ' S' ' 57' ' ' ILE . 9.9 t -62.25 -63.32 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 C-N-CA 118.68 -1.208 . . . . 0.0 109.536 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -50.57 -32.01 17.41 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.926 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -73.76 -54.17 8.65 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.859 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 15.6 mt -46.68 -26.5 0.93 Allowed 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.934 -1.106 . . . . 0.0 109.903 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.16 -35.62 64.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.841 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 7.8 mtt-85 . . . . . 0 N--CA 1.491 1.584 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.167 179.921 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 tttm . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 121.044 0.449 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . 0.533 ' O ' ' N ' ' S' ' 75' ' ' LEU . 1.0 OUTLIER -110.16 21.73 16.4 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.885 0.85 . . . . 0.0 110.088 -179.947 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 58.69 -66.64 0.03 OUTLIER 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 112.901 -1.954 . . . . 0.0 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' S' ' 73' ' ' ASN . 4.0 mt -75.1 -15.5 60.6 Favored 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.957 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -74.46 -28.54 63.42 Favored Glycine 0 N--CA 1.491 2.317 0 C-N-CA 119.635 -1.269 . . . . 0.0 110.868 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -159.85 -77.65 0.06 Allowed 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.727 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' S' ' 81' ' ' THR . . . 140.85 109.76 0.8 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.618 -1.793 . . . . 0.0 108.618 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.727 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.0 OUTLIER -29.46 -45.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -179.777 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.42 ' N ' HG13 ' S' ' 79' ' ' ILE . . . -59.54 -46.84 87.7 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.982 -1.087 . . . . 0.0 111.077 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . 0.471 ' N ' ' O ' ' S' ' 78' ' ' GLY . 61.0 m -53.57 -45.01 69.78 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 pt -84.74 10.15 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 118.71 -1.196 . . . . 0.0 113.986 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -108.06 -52.71 2.73 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.324 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -63.17 0.38 0.63 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.466 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . 0.478 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -70.86 -9.82 66.74 Favored Glycine 0 N--CA 1.487 2.038 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.212 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . 0.443 ' C ' ' H ' ' S' ' 88' ' ' SER . 9.4 p -126.72 -42.92 1.74 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.028 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . 0.436 ' N ' ' OG ' ' S' ' 86' ' ' SER . 0.9 OUTLIER -57.95 -7.19 0.7 Allowed 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.026 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . 0.443 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -66.29 -31.16 71.8 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.946 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 4.5 mt -45.68 -28.27 0.97 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.018 -1.073 . . . . 0.0 109.758 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' S' ' 92' ' ' ALA . 60.6 mttt -92.25 -75.73 0.48 Allowed 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.122 0.963 . . . . 0.0 110.385 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -40.21 -27.08 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.921 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . 0.444 ' N ' ' O ' ' S' ' 90' ' ' LYS . . . -91.1 149.71 40.41 Favored Pre-proline 0 N--CA 1.489 1.488 0 C-N-CA 118.972 -1.091 . . . . 0.0 111.707 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -54.8 160.68 7.18 Favored 'Trans proline' 0 C--O 1.215 -0.673 0 C-N-CA 121.403 1.402 . . . . 0.0 111.699 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 83.6 t -88.42 -26.57 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 118.774 -1.171 . . . . 0.0 109.63 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -58.87 -8.82 1.5 Allowed 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.732 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 mt -66.1 -51.66 55.95 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.817 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.21 -50.38 3.59 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.041 -0.663 . . . . 0.0 111.911 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -55.98 -30.12 61.31 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.837 -0.745 . . . . 0.0 112.791 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.4 ' CH2' HG11 ' S' ' 103' ' ' VAL . 7.8 t90 -86.07 -54.13 4.66 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.808 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.617 HD13 HG23 ' S' ' 103' ' ' VAL . 2.1 mm? -40.14 -41.49 1.28 Allowed 'General case' 0 C--N 1.293 -1.871 0 C-N-CA 118.802 -1.159 . . . . 0.0 113.663 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' S' ' 100' ' ' LEU . 4.5 mt-10 -46.11 -30.33 1.86 Allowed 'General case' 0 C--N 1.289 -2.064 0 C-N-CA 118.26 -1.376 . . . . 0.0 108.229 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . 0.412 ' N ' ' C ' ' S' ' 100' ' ' LEU . 3.9 mm-40 -87.79 -39.25 15.05 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.319 -1.31 . . . . 0.0 114.026 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.617 HG23 HD13 ' S' ' 100' ' ' LEU . 0.2 OUTLIER -82.77 -18.8 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 C-N-CA 114.826 -2.749 . . . . 0.0 111.192 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . 0.455 HD23 HD12 ' S' ' 100' ' ' LEU . 0.0 OUTLIER -87.28 -50.92 6.26 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.732 179.866 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.77 -53.26 58.81 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.46 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -56.31 -59.94 4.23 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.976 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 116.431 -1.747 . . . . 0.0 110.344 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.486 1.333 0 CA-C-O 120.667 0.27 . . . . 0.0 110.479 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -158.87 27.11 0.22 Allowed 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.604 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -110.44 -79.15 0.58 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -61.41 -30.69 70.72 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 9.6 t-105 -62.02 -55.0 33.73 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.146 -1.843 . . . . 0.0 107.417 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . 0.728 ' C ' HD13 ' R' ' 20' ' ' LEU . 1.9 tm? -56.05 -39.67 72.38 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 112.681 -2.054 . . . . 0.0 109.544 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.479 ' O ' ' C ' ' R' ' 22' ' ' PHE . 4.6 mtt-85 -50.47 -69.68 0.11 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 117.858 -1.537 . . . . 0.0 109.044 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.546 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -32.77 -47.05 0.16 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 119.811 -0.755 . . . . 0.0 111.009 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . 0.518 HG21 HD21 ' S' ' 39' ' ' LEU . 77.2 t -66.84 -59.23 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.378 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.534 ' OD2' HD23 ' R' ' 25' ' ' LEU . 1.5 t0 -37.66 -63.47 0.46 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.713 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -65.14 -41.94 94.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.253 -1.379 . . . . 0.0 112.205 -179.838 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . 0.709 HD13 ' C ' ' R' ' 26' ' ' LEU . 2.8 tm? -47.41 -54.65 10.75 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.145 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . 0.468 ' N ' HD13 ' R' ' 26' ' ' LEU . 0.0 OUTLIER -78.66 -24.35 45.23 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.046 -1.062 . . . . 0.0 112.203 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.71 -14.09 59.0 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.891 -1.124 . . . . 0.0 110.891 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.543 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -98.49 -45.85 5.97 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.462 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -42.69 -27.4 0.17 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.467 -0.893 . . . . 0.0 110.855 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -56.4 -43.58 79.44 Favored 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.037 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -96.4 -79.66 0.44 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.62 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 172.56 27.74 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.693 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . 0.564 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 0.8 OUTLIER -95.03 -14.27 24.46 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.816 -179.889 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . 0.427 ' O ' HD13 ' R' ' 39' ' ' LEU . 16.7 p-80 -52.14 -24.84 7.63 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.12 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.438 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -74.33 -62.75 0.95 Allowed Pre-proline 0 C--N 1.301 -1.517 0 C-N-CA 117.965 -1.494 . . . . 0.0 110.538 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.0 Cg_endo -54.31 -22.12 25.42 Favored 'Trans proline' 0 C--N 1.32 -0.949 0 C-N-CA 120.544 0.829 . . . . 0.0 110.469 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.41 -30.13 23.83 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.889 -0.724 . . . . 0.0 110.257 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.487 ' O ' ' CD1' ' R' ' 43' ' ' LEU . 0.1 OUTLIER -64.41 -29.36 70.42 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.166 -1.013 . . . . 0.0 108.393 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . 0.438 ' O ' ' OD1' ' R' ' 40' ' ' ASN . 0.0 OUTLIER -82.23 6.49 16.54 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.495 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . 0.465 HD23 HH12 ' S' ' 84' ' ' ARG . 1.9 mt -106.91 -55.48 2.32 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 119.975 -0.69 . . . . 0.0 112.509 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -96.65 34.2 1.71 Allowed 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.074 -1.051 . . . . 0.0 112.762 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . 0.487 ' CD1' ' O ' ' R' ' 39' ' ' LEU . 0.7 OUTLIER 169.21 150.41 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 179.893 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.425 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -166.12 -40.94 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 116.152 -2.219 . . . . 0.0 115.898 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.425 ' CD ' ' H ' ' R' ' 44' ' ' THR . 56.9 Cg_endo -105.99 -98.96 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.121 1.214 . . . . 0.0 113.954 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -50.18 -24.35 2.76 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.08 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.703 ' O ' HD13 ' R' ' 51' ' ' LEU . 1.0 OUTLIER -61.33 -48.71 80.1 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 118.78 -1.168 . . . . 0.0 110.087 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ttp180 -66.11 -38.0 87.14 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.977 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -62.59 -70.73 0.19 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.906 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.27 -31.73 1.67 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.223 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . 0.703 HD13 ' O ' ' R' ' 47' ' ' GLU . 1.1 mp -58.72 -69.68 0.18 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.565 -0.854 . . . . 0.0 110.591 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.34 -52.59 6.08 Favored Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.697 -1.239 . . . . 0.0 110.104 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.487 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -43.29 -76.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.022 0.915 . . . . 0.0 111.521 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.486 ' HG3' ' N ' ' R' ' 55' ' ' VAL . 0.0 OUTLIER -37.72 -49.0 1.12 Allowed 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.518 -1.674 . . . . 0.0 114.176 -179.878 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . 0.486 ' N ' ' HG3' ' R' ' 54' ' ' ARG . 64.0 t -66.28 -23.12 31.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 C-N-CA 117.561 -1.655 . . . . 0.0 109.489 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' R' ' 53' ' ' THR . 3.0 ptt180 -81.64 -39.57 24.21 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.602 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 0.674 ' C ' HD12 ' R' ' 57' ' ' ILE . 0.4 OUTLIER -71.46 -37.75 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 117.545 -1.662 . . . . 0.0 107.185 179.784 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 0.4 HG12 ' N ' ' R' ' 59' ' ' GLU . 25.6 t -63.15 -69.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 119.111 -1.035 . . . . 0.0 109.905 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.4 ' N ' HG12 ' R' ' 58' ' ' VAL . 9.2 tt0 -48.43 -21.25 0.51 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.389 -0.924 . . . . 0.0 111.363 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -76.29 -53.47 8.17 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.186 -1.006 . . . . 0.0 112.814 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pp -62.43 -24.69 67.56 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 118.228 -1.389 . . . . 0.0 111.204 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mt . . . . . 0 C--N 1.305 -1.351 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.763 179.888 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.5 0 CA-C-O 121.006 0.432 . . . . 0.0 111.303 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 146.44 9.03 Favored Glycine 0 N--CA 1.488 2.156 0 C-N-CA 119.525 -1.322 . . . . 0.0 110.751 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.87 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -39.84 -36.64 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.642 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.531 ' O ' ' NE ' ' R' ' 84' ' ' ARG . . . -52.75 -37.11 58.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.672 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . 0.541 ' CG2' ' N ' ' R' ' 82' ' ' ILE . 3.9 t -68.81 -50.9 46.31 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.388 -0.925 . . . . 0.0 113.129 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . 0.541 ' N ' ' CG2' ' R' ' 81' ' ' THR . 12.2 pt -73.09 10.69 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.334 -1.346 . . . . 0.0 112.447 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -93.52 -68.25 0.81 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.801 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . 0.779 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.51 -23.57 10.78 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.63 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.72 -50.17 55.02 Favored Glycine 0 N--CA 1.49 2.283 0 C-N-CA 119.422 -1.37 . . . . 0.0 110.331 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 56.1 m -93.65 -26.27 17.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -86.07 3.66 41.48 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.435 -0.906 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -26.04 59.73 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.703 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.77 -30.34 61.11 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.146 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.24 -51.69 3.07 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.306 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.18 0.11 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.537 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.579 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -96.74 163.99 19.06 Favored Pre-proline 0 N--CA 1.489 1.518 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.583 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . 0.579 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 13.8 Cg_exo -49.37 152.55 5.66 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 C-N-CA 121.438 1.425 . . . . 0.0 111.507 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.54 10.52 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 119.933 -0.707 . . . . 0.0 111.409 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.62 -11.69 58.74 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.188 -1.005 . . . . 0.0 111.619 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 pp -97.37 -32.9 11.63 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.359 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.39 -29.17 3.74 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.212 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -82.77 -42.03 18.45 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.788 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.632 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 10.0 t90 -62.23 -60.01 4.2 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.602 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.28 -26.5 0.06 Allowed 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.127 -1.029 . . . . 0.0 113.244 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.452 ' C ' ' O ' ' R' ' 100' ' ' LEU . 2.1 mm-40 -48.62 -38.9 22.19 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 117.412 -1.715 . . . . 0.0 106.563 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -88.65 -28.78 20.4 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 113.26 -1.791 . . . . 0.0 112.276 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.632 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.2 t -91.22 -3.45 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 117.489 -1.684 . . . . 0.0 110.813 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' R' ' 100' ' ' LEU . 29.3 tp -101.33 -51.79 3.4 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.692 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . 0.695 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.5 OUTLIER -66.17 -26.57 67.48 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 118.905 -1.118 . . . . 0.0 110.525 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 8.6 tttp . . . . . 0 N--CA 1.487 1.389 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.553 -179.983 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 9.7 mtt180 . . . . . 0 N--CA 1.488 1.443 0 CA-C-O 120.966 0.412 . . . . 0.0 111.431 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -133.68 -4.28 2.9 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' S' ' 18' ' ' GLU . 5.6 mt-30 -87.78 -84.19 0.2 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.977 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 3.1 mp0 -45.54 -35.26 3.78 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -44.44 -53.93 6.43 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.564 -1.653 . . . . 0.0 108.685 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' S' ' 20' ' ' LEU . 7.5 tp -59.78 -46.32 89.54 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 113.758 -1.565 . . . . 0.0 111.758 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.474 ' HD3' ' H ' ' S' ' 21' ' ' ARG . 3.4 mpt_? -44.48 -66.17 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.578 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.577 ' CD2' HD21 ' R' ' 51' ' ' LEU . 0.1 OUTLIER -35.59 -51.03 0.63 Allowed 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.862 179.527 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' S' ' 26' ' ' LEU . 30.7 t -67.76 -68.51 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.815 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' S' ' 23' ' ' VAL . 13.2 t0 -20.86 -54.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 124.248 0.968 . . . . 0.0 113.107 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.794 HD12 ' CE ' ' S' ' 42' ' ' MET . 1.7 mt -74.26 -47.58 34.2 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.778 -1.169 . . . . 0.0 109.695 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.677 HD21 HD12 ' S' ' 39' ' ' LEU . 0.2 OUTLIER -47.42 -16.73 0.06 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.409 -0.916 . . . . 0.0 110.974 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . 0.529 ' O ' ' N ' ' S' ' 29' ' ' ALA . 5.7 tptm -93.95 -73.53 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.591 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -46.33 -9.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.607 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . 0.529 ' N ' ' O ' ' S' ' 27' ' ' LYS . . . -91.72 -42.22 10.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.722 -1.191 . . . . 0.0 112.331 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . 0.425 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 28.1 t80 -43.78 -29.82 0.58 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 118.916 -1.114 . . . . 0.0 110.802 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -36.09 66.13 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.196 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 29.9 m120 -92.78 -7.17 47.27 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.656 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.418 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.7 OUTLIER 76.43 29.58 0.7 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.388 0.613 . . . . 0.0 110.249 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . 0.514 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.3 mm? -95.71 -14.25 23.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.999 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . 0.447 ' O ' HD13 ' S' ' 39' ' ' LEU . 36.8 p-80 -45.56 -33.72 2.93 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 113.813 -1.54 . . . . 0.0 113.334 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.46 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.9 mt -68.24 -64.58 1.77 Allowed Pre-proline 0 C--N 1.304 -1.378 0 C-N-CA 117.442 -1.703 . . . . 0.0 110.12 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.46 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.6 Cg_exo -47.42 -26.83 6.43 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 C-N-CA 120.524 0.816 . . . . 0.0 110.184 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.93 -37.65 34.12 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.429 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.677 HD12 HD21 ' S' ' 26' ' ' LEU . 0.4 OUTLIER -57.38 -27.29 62.18 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.695 179.865 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.4 5.91 39.92 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.45 -63.05 1.46 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . 0.794 ' CE ' HD12 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -89.04 34.13 0.79 Allowed 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 118.578 -1.249 . . . . 0.0 112.397 -179.713 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . 0.482 ' CD1' ' O ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER 170.26 141.54 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.776 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.665 ' H ' ' CD ' ' S' ' 45' ' ' PRO . 0.3 OUTLIER -176.22 -32.19 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 115.972 1.842 . . . . 0.0 115.972 -179.699 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.665 ' CD ' ' H ' ' S' ' 44' ' ' THR . 24.6 Cg_endo -87.64 -102.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 121.609 1.539 . . . . 0.0 112.529 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' S' ' 50' ' ' ALA . 8.7 m-20 -49.74 -34.93 20.46 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 118.556 -1.258 . . . . 0.0 108.047 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -49.61 -61.63 2.0 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.507 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.63 -47.46 14.79 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.891 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -83.79 -65.83 0.96 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.478 -1.289 . . . . 0.0 113.009 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . 0.822 ' HB1' HH11 ' S' ' 54' ' ' ARG . . . -44.57 -46.5 9.98 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.417 -0.913 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 44.3 mt -45.98 -58.04 3.9 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 118.844 -1.142 . . . . 0.0 110.832 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.63 -54.15 18.28 Favored Glycine 0 N--CA 1.483 1.806 0 C-N-CA 118.84 -1.648 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.45 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.1 OUTLIER -43.14 -83.32 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -179.84 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.822 HH11 ' HB1' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -43.76 -63.7 0.8 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 58.8 t -45.13 -29.42 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.968 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.525 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -92.2 -36.9 13.01 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 118.18 -1.408 . . . . 0.0 112.21 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 0.965 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -62.99 -31.35 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 C-N-CA 115.419 -2.513 . . . . 0.0 105.064 179.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . 0.965 ' N ' HD13 ' S' ' 57' ' ' ILE . 31.3 t -62.0 -64.84 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 CA-C-N 114.879 -1.055 . . . . 0.0 108.19 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.8 -33.1 15.58 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.746 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 3.5 tt0 -70.43 -54.11 13.7 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.559 -0.857 . . . . 0.0 111.719 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' S' ' 61' ' ' LEU . 31.5 mt -53.13 -24.18 9.87 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.681 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 tp -57.47 -38.89 75.25 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.045 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 . . . . . 0 N--CA 1.491 1.58 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.972 179.786 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 5.2 tttm . . . . . 0 N--CA 1.486 1.36 0 N-CA-C 110.673 -0.121 . . . . 0.0 110.673 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . 0.408 ' O ' ' CB ' ' S' ' 74' ' ' GLU . 0.2 OUTLIER -113.99 -31.38 6.4 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.541 0.686 . . . . 0.0 109.638 179.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' S' ' 73' ' ' ASN . 2.9 pt-20 153.76 -58.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.042 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . 0.499 ' H ' ' HG ' ' S' ' 75' ' ' LEU . 0.3 OUTLIER -108.93 21.48 17.17 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 119.837 -0.745 . . . . 0.0 109.237 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' S' ' 77' ' ' ALA . . . -97.6 -49.19 1.85 Allowed Glycine 0 N--CA 1.492 2.396 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.436 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' S' ' 76' ' ' GLY . . . 175.94 97.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.517 0.675 . . . . 0.0 110.352 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.71 159.97 8.59 Favored Glycine 0 N--CA 1.482 1.713 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.809 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.503 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.6 OUTLIER -49.33 -38.0 11.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 CA-C-N 114.399 -0.901 . . . . 0.0 110.266 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.442 ' N ' HG13 ' S' ' 79' ' ' ILE . . . -38.44 -44.31 0.92 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.226 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 24.4 m -71.81 -43.75 65.09 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 122.082 0.944 . . . . 0.0 112.211 179.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . 0.408 HG13 ' H ' ' S' ' 82' ' ' ILE . 0.0 OUTLIER -81.33 12.31 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.26 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.503 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -126.25 -18.91 4.83 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 118.934 -1.106 . . . . 0.0 113.508 179.729 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . 0.516 ' C ' ' CD ' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -87.06 -19.99 27.79 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 118.254 -1.378 . . . . 0.0 109.05 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.0 -18.75 49.58 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.274 -1.441 . . . . 0.0 110.102 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t -84.35 -60.34 2.11 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.913 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.49 2.92 20.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.625 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . 0.457 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.2 OUTLIER -55.79 -48.9 74.55 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.768 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 pp -46.88 -14.48 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.386 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . 0.457 ' N ' ' O ' ' S' ' 88' ' ' SER . 17.7 tptt -49.09 -52.89 23.09 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.64 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.49 -38.25 13.5 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.258 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 54.6 60.32 10.44 Favored Pre-proline 0 C--N 1.303 -1.424 0 C-N-CA 119.833 -0.747 . . . . 0.0 111.842 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -63.07 97.49 0.19 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 121.239 1.292 . . . . 0.0 110.667 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . 0.448 ' H ' HG23 ' S' ' 94' ' ' VAL . 2.9 t -56.75 -10.42 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.905 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -83.48 -24.09 31.92 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.548 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . 0.421 ' O ' ' N ' ' S' ' 99' ' ' TRP . 3.7 mp -84.29 -51.31 7.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.211 -0.996 . . . . 0.0 111.181 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.52 -32.82 3.6 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.95 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -82.13 -24.26 35.19 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.387 -0.925 . . . . 0.0 110.584 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.669 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 4.7 t90 -95.09 -63.54 1.16 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.256 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.511 ' O ' ' C ' ' S' ' 101' ' ' GLU . 2.0 mm? -35.58 -39.57 0.14 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.511 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -40.72 -41.47 1.54 Allowed 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 118.155 -1.418 . . . . 0.0 107.571 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.9 -28.09 23.0 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 113.756 -1.565 . . . . 0.0 112.652 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.669 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 3.3 t -84.03 -15.36 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 116.615 -2.034 . . . . 0.0 111.888 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 4.9 mt -99.8 -61.94 1.3 Allowed 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.826 -0.75 . . . . 0.0 111.913 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' S' ' 107' ' ' SER . 4.5 mm? -63.86 -75.21 0.08 Allowed 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.231 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -42.17 -23.44 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.731 -0.787 . . . . 0.0 110.841 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . 0.477 ' N ' ' O ' ' S' ' 105' ' ' LEU . 19.6 p . . . . . 0 C--N 1.304 -1.371 0 CA-C-O 116.253 -1.832 . . . . 0.0 110.83 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 121.099 0.476 . . . . 0.0 110.136 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -80.37 7.56 9.41 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.798 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.421 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.1 mp0 -84.97 -75.6 0.35 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.285 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' R' ' 18' ' ' GLU . 1.5 mp0 -46.16 -30.7 2.05 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 122.804 1.288 . . . . 0.0 108.466 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . 0.421 ' N ' ' C ' ' R' ' 17' ' ' GLN . 67.2 t-105 -55.61 -58.51 7.48 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 112.645 -2.07 . . . . 0.0 110.229 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.9 tp -50.06 -23.6 2.18 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.521 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.541 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mmt85 -71.68 -69.7 0.37 Allowed 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.813 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.541 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.41 -37.39 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.19 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t -74.24 -50.48 27.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.413 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' R' ' 21' ' ' ARG . 38.5 t70 -41.17 -72.87 0.05 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.567 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.445 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.2 OUTLIER -47.5 -44.85 25.81 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.579 -0.848 . . . . 0.0 111.13 -179.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.88 -56.91 7.4 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.149 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -62.54 -35.9 80.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -81.24 -7.58 59.59 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.886 -1.126 . . . . 0.0 112.537 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' R' ' 31' ' ' GLN . . . -99.94 -57.98 2.02 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.105 -1.038 . . . . 0.0 112.83 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . 0.419 ' C ' ' O ' ' R' ' 29' ' ' ALA . 0.2 OUTLIER -34.53 -27.67 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.859 -179.771 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' R' ' 29' ' ' ALA . 1.2 tt0 -54.84 -44.54 74.03 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.801 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -103.43 -76.48 0.59 Allowed 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.965 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . 0.738 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.8 OUTLIER 178.8 27.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.966 -1.094 . . . . 0.0 112.06 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . 0.865 ' N ' HD22 ' R' ' 34' ' ' LEU . 1.0 OUTLIER -99.61 -11.59 20.82 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.249 -0.981 . . . . 0.0 110.869 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 47.0 p-80 -59.25 -24.34 63.13 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.829 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' R' ' 36' ' ' LEU . 8.1 mt -76.13 -59.56 1.09 Allowed Pre-proline 0 C--N 1.303 -1.436 0 C-N-CA 118.018 -1.473 . . . . 0.0 110.81 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.5 Cg_exo -54.88 -36.29 91.2 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 N-CA-C 109.404 -1.037 . . . . 0.0 109.404 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.77 -43.84 95.21 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.619 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.5 OUTLIER -52.55 -34.25 49.37 Favored 'General case' 0 C--O 1.203 -1.344 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.628 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -74.12 5.75 4.09 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.316 -0.953 . . . . 0.0 111.542 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.01 -56.64 2.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.46 12.33 2.53 Favored 'General case' 0 N--CA 1.501 2.098 0 C-N-CA 117.429 -1.709 . . . . 0.0 112.841 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' R' ' 39' ' ' LEU . 2.2 pp 179.95 146.58 0.24 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.601 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -175.44 -38.07 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 116.075 -2.25 . . . . 0.0 116.14 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.601 ' HD2' ' H ' ' R' ' 44' ' ' THR . 41.4 Cg_endo -87.26 -109.43 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 121.444 1.429 . . . . 0.0 113.183 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . 0.43 ' H ' ' HB2' ' R' ' 45' ' ' PRO . 3.7 p-10 -54.48 -32.75 58.43 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 119.721 -0.791 . . . . 0.0 110.275 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.431 ' OE1' ' OE1' ' S' ' 47' ' ' GLU . 30.6 mt-10 -54.6 -64.6 0.78 Allowed 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.081 -1.047 . . . . 0.0 110.49 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.19 -38.32 11.75 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.171 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.52 -68.02 0.4 Allowed 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.351 -1.34 . . . . 0.0 111.938 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.499 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -65.84 -52.54 49.61 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.205 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . 0.499 ' C ' ' O ' ' R' ' 50' ' ' ALA . 3.2 tt -33.77 -48.89 0.3 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.526 -0.87 . . . . 0.0 110.357 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -64.85 -69.37 1.35 Allowed Glycine 0 N--CA 1.482 1.753 0 C-N-CA 119.564 -1.303 . . . . 0.0 110.104 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.449 ' C ' ' O ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -34.02 -69.14 0.1 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 122.319 1.057 . . . . 0.0 110.748 179.764 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.525 ' H ' ' CD ' ' R' ' 54' ' ' ARG . 0.1 OUTLIER -35.18 -63.82 0.31 Allowed 'General case' 0 C--N 1.286 -2.156 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.908 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 12.0 p -60.52 -19.24 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 C-N-CA 116.739 -1.984 . . . . 0.0 111.947 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.4 ' HG3' ' N ' ' R' ' 57' ' ' ILE . 0.0 OUTLIER -83.62 -38.07 22.06 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.38 -0.928 . . . . 0.0 112.422 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 1.029 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -81.83 -34.58 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.872 -179.639 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 1.029 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.8 p -69.31 -39.92 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 118.045 -1.462 . . . . 0.0 111.37 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.482 ' N ' HG13 ' R' ' 58' ' ' VAL . 3.3 pt-20 -72.2 -30.57 65.07 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 118.383 -1.327 . . . . 0.0 110.584 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -74.63 -47.47 31.91 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.609 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.53 -26.71 67.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.015 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . 0.462 HD23 ' O ' ' R' ' 62' ' ' LEU . 0.8 OUTLIER . . . . . 0 N--CA 1.487 1.425 0 C-N-CA 118.918 -1.113 . . . . 0.0 109.537 179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.87 0.366 . . . . 0.0 110.725 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 156.29 122.99 0.77 Allowed Glycine 0 N--CA 1.491 2.357 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.647 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.919 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -37.14 -32.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.622 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.446 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.66 -56.02 14.39 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.962 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 19.7 m -42.89 -50.2 5.79 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . 0.439 HD13 HG21 ' R' ' 82' ' ' ILE . 12.1 pt -71.0 -28.72 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 C-N-CA 119.0 -1.08 . . . . 0.0 113.02 -179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -61.02 -73.15 0.1 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 118.648 -1.221 . . . . 0.0 110.922 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -11.37 1.4 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.102 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . 0.405 ' N ' ' C ' ' R' ' 83' ' ' THR . . . -69.73 -28.76 71.7 Favored Glycine 0 N--CA 1.486 1.999 0 C-N-CA 119.775 -1.203 . . . . 0.0 110.99 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 40.2 t -150.32 57.24 0.95 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 118.603 -1.239 . . . . 0.0 112.197 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . 0.464 ' O ' ' CB ' ' R' ' 88' ' ' SER . 32.1 t-20 -94.36 -13.22 26.58 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER 75.1 -45.36 0.56 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.088 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.73 -25.93 65.89 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.55 -0.86 . . . . 0.0 111.302 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . 0.574 ' C ' ' H ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -48.9 -37.65 20.37 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.526 -1.27 . . . . 0.0 110.797 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' R' ' 92' ' ' ALA . . . -61.03 11.54 0.02 OUTLIER 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.032 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.704 ' HB3' ' HD3' ' R' ' 93' ' ' PRO . . . -31.34 -59.65 0.32 Allowed Pre-proline 0 N--CA 1.493 1.698 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' R' ' 92' ' ' ALA . 5.2 Cg_exo -51.31 95.28 0.03 OUTLIER 'Trans proline' 0 C--N 1.324 -0.763 0 C-N-CA 120.506 0.804 . . . . 0.0 110.725 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.13 -16.95 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.588 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.82 -28.62 67.73 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.362 -0.935 . . . . 0.0 111.274 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 4.3 mt -61.88 -41.05 97.4 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.481 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -55.86 -37.81 69.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.645 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.55 -29.37 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.6 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.436 ' CE3' HG21 ' R' ' 103' ' ' VAL . 3.0 t90 -99.2 -67.49 0.85 Allowed 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.362 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.704 ' CD1' HD13 ' R' ' 104' ' ' LEU . 1.3 mm? -38.6 -55.46 1.43 Allowed 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.545 ' C ' ' O ' ' R' ' 100' ' ' LEU . 12.7 pt-20 -33.24 -33.11 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.85 -1.14 . . . . 0.0 109.51 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' R' ' 100' ' ' LEU . 1.8 tm-20 -92.54 -32.41 14.85 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.802 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.577 ' N ' ' O ' ' R' ' 100' ' ' LEU . 9.8 t -80.81 -15.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 116.959 -1.896 . . . . 0.0 110.883 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . 0.704 HD13 ' CD1' ' R' ' 100' ' ' LEU . 1.8 tp -102.14 -55.25 2.52 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.937 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.16 -66.65 0.35 Allowed 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.983 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 26.2 tttt . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.503 -179.844 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 121.233 0.54 . . . . 0.0 111.221 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -84.92 10.86 10.58 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.588 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.417 ' C ' ' N ' ' S' ' 19' ' ' TRP . 20.8 mt-30 -76.99 -92.11 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.047 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.581 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 0.4 OUTLIER -44.25 -27.45 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 122.164 0.983 . . . . 0.0 109.54 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . 0.417 ' N ' ' C ' ' S' ' 17' ' ' GLN . 32.8 t-105 -53.6 -48.64 69.07 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.627 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' S' ' 17' ' ' GLN . 1.2 tt -59.84 -36.1 76.14 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 113.253 -1.794 . . . . 0.0 111.016 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 1.4 mpt_? -58.17 -73.02 0.08 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.28 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.556 ' C ' ' CD1' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -25.6 -50.67 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.78 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.402 ' N ' ' O ' ' S' ' 21' ' ' ARG . 30.6 t -68.89 -63.05 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.745 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' S' ' 24' ' ' ASP . 21.7 t0 -35.55 -60.65 0.5 Allowed 'General case' 0 N--CA 1.488 1.469 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.838 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.49 HD23 ' N ' ' S' ' 25' ' ' LEU . 2.7 mt -57.24 -57.09 14.16 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.161 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.456 HD11 HD11 ' S' ' 39' ' ' LEU . 0.6 OUTLIER -42.37 -25.05 0.07 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.243 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' S' ' 25' ' ' LEU . 3.3 mtpm? -82.45 -39.28 22.77 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.716 -1.194 . . . . 0.0 113.005 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -83.23 -20.7 34.08 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.42 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . 0.606 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -82.95 -32.78 26.95 Favored 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.703 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . 0.498 ' O ' ' CD1' ' S' ' 30' ' ' TYR . 0.0 OUTLIER -56.59 -32.53 65.33 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.004 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -47.67 77.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.878 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.57 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 1.8 m120 -84.09 -41.96 16.6 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.781 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 22.1 t70 116.56 49.35 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.713 0 O-C-N 125.059 1.474 . . . . 0.0 109.393 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . 0.606 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.4 mm? -112.55 -14.0 13.26 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.996 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . 0.454 ' O ' HD13 ' S' ' 39' ' ' LEU . 15.6 p-80 -52.22 -13.39 0.33 Allowed 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.528 -1.215 . . . . 0.0 112.89 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.481 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.5 mt -80.87 -66.19 0.25 Allowed Pre-proline 0 N--CA 1.486 1.34 0 C-N-CA 118.217 -1.393 . . . . 0.0 110.093 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.481 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.0 Cg_exo -49.55 -29.04 17.82 Favored 'Trans proline' 0 C--N 1.322 -0.862 0 N-CA-C 109.961 -0.823 . . . . 0.0 109.961 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . 0.558 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.2 mp -71.25 -51.49 24.28 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.469 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.456 HD11 HD11 ' S' ' 26' ' ' LEU . 0.4 OUTLIER -44.57 -41.6 6.65 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.678 179.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -18.08 33.44 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.275 -0.97 . . . . 0.0 111.921 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 16.5 mt -94.25 -62.03 1.41 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.527 -0.869 . . . . 0.0 112.918 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . 0.558 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.2 OUTLIER -81.46 10.55 5.6 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 117.927 -1.509 . . . . 0.0 111.781 -179.881 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.53 126.7 7.8 Favored 'General case' 0 N--CA 1.509 2.505 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.536 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.465 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -166.53 -42.53 0.0 OUTLIER Pre-proline 0 N--CA 1.499 2.018 0 C-N-CA 116.456 -2.098 . . . . 0.0 116.506 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' S' ' 44' ' ' THR . 43.7 Cg_endo -89.97 -105.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 120.771 0.98 . . . . 0.0 114.577 -179.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . 0.408 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 0.2 OUTLIER -57.33 -22.79 44.56 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.94 -179.732 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . 0.475 ' OE2' HD12 ' R' ' 51' ' ' LEU . 5.0 mm-40 -56.97 -61.3 2.54 Favored 'General case' 0 C--N 1.296 -1.741 0 C-N-CA 118.534 -1.266 . . . . 0.0 109.315 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 4.8 mmt85 -55.2 -33.07 62.73 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.936 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -82.67 -66.67 0.86 Allowed 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 118.405 -1.318 . . . . 0.0 114.365 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -50.49 -41.15 52.97 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . 0.768 HD12 ' N ' ' S' ' 52' ' ' GLY . 3.7 pp -64.52 -42.25 95.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 117.456 -1.697 . . . . 0.0 111.333 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . 0.768 ' N ' HD12 ' S' ' 51' ' ' LEU . . . -55.45 -44.53 85.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 107.632 -2.187 . . . . 0.0 107.632 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.2 OUTLIER -46.71 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.921 -1.139 . . . . 0.0 113.096 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.681 ' HA ' HG23 ' S' ' 57' ' ' ILE . 3.9 ppt_? -48.39 -37.48 17.03 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 119.17 -1.012 . . . . 0.0 113.442 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . 0.428 HG22 ' NH2' ' S' ' 54' ' ' ARG . 35.2 t -57.6 -28.69 32.46 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.864 0 C-N-CA 117.841 -1.544 . . . . 0.0 109.192 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -83.15 -33.23 26.3 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 1.017 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -82.57 -29.58 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.105 0 C-N-CA 117.489 -1.684 . . . . 0.0 108.041 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . 1.017 ' N ' HD13 ' S' ' 57' ' ' ILE . 10.2 t -63.28 -48.99 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.81 -43.04 98.72 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.91 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.35 -45.76 92.32 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.021 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 97.7 mt -74.72 -31.83 61.96 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.15 -1.02 . . . . 0.0 113.131 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 12.8 tp -77.05 -43.08 35.84 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 118.419 -1.313 . . . . 0.0 112.272 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.492 1.633 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.297 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . 0.429 ' C ' ' H ' ' S' ' 74' ' ' GLU . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.504 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . 0.661 ' O ' ' N ' ' S' ' 75' ' ' LEU . 0.7 OUTLIER -90.5 26.2 2.05 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 122.097 0.951 . . . . 0.0 108.671 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' S' ' 76' ' ' GLY . 1.0 OUTLIER 39.6 -71.22 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 112.586 -2.097 . . . . 0.0 112.722 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . 0.661 ' N ' ' O ' ' S' ' 73' ' ' ASN . 0.8 OUTLIER -40.78 -21.3 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.789 -179.981 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' S' ' 74' ' ' GLU . . . -84.01 -65.44 1.54 Allowed Glycine 0 N--CA 1.487 2.081 0 C-N-CA 119.678 -1.249 . . . . 0.0 110.348 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.03 -103.11 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.897 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . 0.405 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . -164.49 146.49 11.43 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.844 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.0 OUTLIER -37.43 -39.09 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.886 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.9 -84.33 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -45.11 -19.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -179.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . 0.432 HD13 HG21 ' S' ' 82' ' ' ILE . 4.1 pt -102.12 6.34 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 C-N-CA 118.38 -1.328 . . . . 0.0 113.523 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -99.68 -13.41 19.35 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.778 -1.169 . . . . 0.0 112.302 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.56 -36.09 8.9 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.704 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.11 71.69 Favored Glycine 0 N--CA 1.49 2.273 0 C-N-CA 119.66 -1.257 . . . . 0.0 110.83 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.1 p -88.79 -50.03 6.47 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.076 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . 0.501 ' OD1' ' N ' ' S' ' 87' ' ' ASN . 1.4 p30 -87.63 -80.46 0.26 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.414 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' S' ' 87' ' ' ASN . 0.2 OUTLIER 73.09 -37.65 0.39 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.338 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . 0.484 ' H ' ' C ' ' S' ' 87' ' ' ASN . 4.7 mt -64.32 -10.41 23.97 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.149 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . 0.402 ' O ' ' C ' ' S' ' 91' ' ' ALA . 16.3 mmtm -75.0 -58.64 3.16 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.241 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . 0.729 ' O ' ' HB2' ' S' ' 92' ' ' ALA . . . -36.14 -78.42 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.181 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.762 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . 0.729 ' HB2' ' O ' ' S' ' 91' ' ' ALA . . . 161.15 -33.68 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.71 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . 0.617 ' HD2' ' H ' ' S' ' 92' ' ' ALA . 6.2 Cg_exo -58.89 95.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.325 -0.695 0 C-N-CA 120.524 0.816 . . . . 0.0 112.607 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . 0.6 HG23 ' O ' ' S' ' 92' ' ' ALA . 58.4 t -95.13 -18.24 6.79 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.423 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.15 -2.99 6.43 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 3.6 tp -82.53 -36.54 26.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.435 -0.906 . . . . 0.0 111.62 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -1.39 7.34 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.93 -0.708 . . . . 0.0 112.771 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -106.06 -0.41 24.85 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.629 ' CE2' HG21 ' S' ' 103' ' ' VAL . 5.7 t90 -112.53 -64.28 1.32 Allowed 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 114.17 -1.377 . . . . 0.0 113.467 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 1.114 HD22 ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -20.75 -82.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 119.058 2.984 . . . . 0.0 119.058 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 1.114 ' H ' HD22 ' S' ' 100' ' ' LEU . 0.0 OUTLIER -58.58 -43.66 89.53 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 119.15 -1.02 . . . . 0.0 109.071 -179.425 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . 0.416 ' H ' ' HG3' ' S' ' 101' ' ' GLU . 1.6 tm-20 -63.15 -18.39 63.41 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.629 HG21 ' CE2' ' S' ' 99' ' ' TRP . 0.5 OUTLIER -91.22 -54.13 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 C-N-CA 117.154 -1.819 . . . . 0.0 111.036 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . 0.503 ' N ' HG12 ' S' ' 103' ' ' VAL . 17.5 mt -51.98 -69.01 0.12 Allowed 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.442 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 8.1 mt -45.84 -74.46 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.888 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -43.49 -57.82 2.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.725 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 116.257 -1.83 . . . . 0.0 111.252 -179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 . . . . . 0 N--CA 1.486 1.348 0 CA-C-O 121.016 0.436 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -150.37 -3.26 0.36 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.421 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 17' ' ' GLN . . . . . 0.44 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.4 mt-30 -92.42 -79.52 0.39 Allowed 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.855 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 18' ' ' GLU . . . . . 0.674 ' H ' ' CD ' ' R' ' 18' ' ' GLU . 0.0 OUTLIER -48.57 -27.71 2.95 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.888 1.327 . . . . 0.0 107.779 179.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 19' ' ' TRP . . . . . 0.44 ' N ' ' C ' ' R' ' 17' ' ' GLN . 71.8 t-105 -51.62 -60.42 3.18 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 112.912 -1.949 . . . . 0.0 109.127 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -49.5 -31.61 10.47 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.404 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 21' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.3 mmt180 -61.91 -75.68 0.07 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 118.387 -1.325 . . . . 0.0 109.865 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 22' ' ' PHE . . . . . 0.503 ' CD2' HD11 ' S' ' 51' ' ' LEU . 8.7 t80 -36.32 -39.91 0.21 Allowed 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.404 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 23' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' R' ' 25' ' ' LEU . 46.6 t -73.05 -74.39 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.598 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 24' ' ' ASP . . . . . 0.437 ' C ' ' O ' ' R' ' 23' ' ' VAL . 29.8 t70 -37.85 -29.67 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.757 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 25' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' R' ' 23' ' ' VAL . 13.5 tp -70.54 -66.26 0.63 Allowed 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.142 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 26' ' ' LEU . . . . . 0.841 HD21 HG13 ' S' ' 23' ' ' VAL . 5.5 tp -48.11 -56.25 8.27 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.372 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 27' ' ' LYS . . . . . 0.414 ' NZ ' ' CE1' ' S' ' 30' ' ' TYR . 0.1 OUTLIER -41.37 -57.13 2.26 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.256 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -78.35 -5.55 52.52 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.554 -0.858 . . . . 0.0 112.353 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 29' ' ' ALA . . . . . 0.417 ' O ' ' N ' ' R' ' 33' ' ' ASP . . . -83.24 -51.26 7.61 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.829 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 30' ' ' TYR . . . . . 0.418 ' O ' ' N ' ' R' ' 33' ' ' ASP . 24.0 t80 -41.23 -67.3 0.26 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.155 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -45.95 -25.82 0.61 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.653 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 32' ' ' ASN . . . . . 0.518 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 0.3 OUTLIER -93.19 -23.48 18.55 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.296 -179.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 33' ' ' ASP . . . . . 0.518 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 3.3 t0 85.69 23.09 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 123.695 0.622 . . . . 0.0 111.346 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 34' ' ' LEU . . . . . 0.508 HD23 HD22 ' R' ' 32' ' ' ASN . 0.6 OUTLIER -104.27 -13.37 16.18 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.679 0.752 . . . . 0.0 109.003 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 35' ' ' HIS . . . . . 0.413 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 27.1 p-80 -49.38 -24.88 2.13 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 114.301 -1.318 . . . . 0.0 113.007 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.2 mt -77.83 -64.33 0.42 Allowed Pre-proline 0 N--CA 1.484 1.235 0 C-N-CA 118.081 -1.447 . . . . 0.0 110.893 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 37' ' ' PRO . . . . . 0.525 ' O ' HD13 ' R' ' 41' ' ' LEU . 2.2 Cg_endo -53.83 -23.9 28.95 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 N-CA-C 109.978 -0.816 . . . . 0.0 109.978 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 38' ' ' LEU . . . . . 0.468 HD22 HD21 ' R' ' 25' ' ' LEU . 78.0 mt -83.9 -33.09 24.84 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.155 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 39' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 43' ' ' LEU . 1.0 OUTLIER -56.43 -32.53 64.97 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.814 179.752 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -81.77 3.52 25.49 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.792 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 41' ' ' LEU . . . . . 0.525 HD13 ' O ' ' R' ' 37' ' ' PRO . 4.9 mp -105.6 -65.17 1.08 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.255 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 42' ' ' MET . . . . . 0.512 ' N ' ' SD ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -94.65 37.59 1.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.23 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 43' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 39' ' ' LEU . 1.1 tp 179.31 127.06 0.07 Allowed 'General case' 0 N--CA 1.505 2.294 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 44' ' ' THR . . . . . 0.684 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.93 -39.22 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.669 0 C-N-CA 117.639 -1.624 . . . . 0.0 115.251 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 45' ' ' PRO . . . . . 0.684 ' HD2' ' H ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -76.14 -95.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.288 0 C-N-CA 120.814 1.009 . . . . 0.0 112.165 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 46' ' ' ASP . . . . . 0.542 ' O ' ' HB3' ' R' ' 50' ' ' ALA . 0.8 OUTLIER -55.86 -6.89 0.25 Allowed 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 118.804 -1.158 . . . . 0.0 109.454 -179.857 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 47' ' ' GLU . . . . . 0.605 ' OE2' ' CH2' ' S' ' 19' ' ' TRP . 25.2 tt0 -72.11 -79.92 0.07 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.044 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 48' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' R' ' 47' ' ' GLU . 9.7 mmm-85 -43.04 -24.59 0.07 Allowed 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.104 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 49' ' ' GLU . . . . . 0.486 ' N ' ' O ' ' R' ' 47' ' ' GLU . 5.4 mt-10 -88.57 -68.23 0.78 Allowed 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.648 -1.221 . . . . 0.0 111.822 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 50' ' ' ALA . . . . . 0.542 ' HB3' ' O ' ' R' ' 46' ' ' ASP . . . -57.98 -60.55 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 51' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' S' ' 22' ' ' PHE . 2.4 mp -33.48 -62.9 0.27 Allowed 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.439 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.36 -47.38 35.3 Favored Glycine 0 N--CA 1.485 1.929 0 C-N-CA 118.74 -1.695 . . . . 0.0 109.416 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 53' ' ' THR . . . . . 0.523 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -58.99 -81.22 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 54' ' ' ARG . . . . . 0.451 ' HG2' ' H ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -34.04 -60.53 0.39 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.578 -179.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.04 -31.08 35.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 C-N-CA 118.136 -1.426 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 56' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' R' ' 53' ' ' THR . 22.2 mtp85 -80.73 -37.25 30.89 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.655 -1.218 . . . . 0.0 112.396 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 57' ' ' ILE . . . . . 0.955 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.45 -31.9 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 C-N-CA 116.801 -1.96 . . . . 0.0 108.297 -179.862 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 58' ' ' VAL . . . . . 0.955 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.7 t -61.96 -60.17 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 118.679 -1.208 . . . . 0.0 109.176 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 59' ' ' GLU . . . . . 0.443 ' N ' HG12 ' R' ' 58' ' ' VAL . 48.1 mt-10 -52.96 -34.88 57.8 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.808 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.73 -45.89 64.04 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.845 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 61' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' R' ' 61' ' ' LEU . 65.5 mt -84.82 0.24 51.54 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.563 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.486 1.365 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.699 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.366 0 CA-C-O 120.878 0.37 . . . . 0.0 110.965 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.76 145.23 7.27 Favored Glycine 0 N--CA 1.489 2.222 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.476 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 79' ' ' ILE . . . . . 0.901 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -44.75 -36.38 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.855 179.995 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 80' ' ' ALA . . . . . 0.539 ' O ' ' NH1' ' R' ' 84' ' ' ARG . . . -62.26 -31.44 72.01 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.511 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 81' ' ' THR . . . . . 0.508 ' C ' ' H ' ' R' ' 83' ' ' THR . 0.9 OUTLIER -86.6 -50.94 6.46 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.113 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -63.51 7.53 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.899 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 83' ' ' THR . . . . . 0.508 ' H ' ' C ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -91.54 -79.31 0.38 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.077 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 84' ' ' ARG . . . . . 0.814 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.58 -26.8 23.13 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.348 179.86 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.85 -44.69 81.53 Favored Glycine 0 N--CA 1.488 2.143 0 C-N-CA 119.343 -1.408 . . . . 0.0 109.924 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.23 -49.29 5.8 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.527 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 87' ' ' ASN . . . . . 0.552 ' ND2' ' N ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER -75.81 10.6 1.73 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.655 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 88' ' ' SER . . . . . 0.58 ' O ' ' HB3' ' R' ' 92' ' ' ALA . 0.5 OUTLIER -41.51 -27.29 0.09 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.423 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 89' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' R' ' 87' ' ' ASN . 5.6 mt -61.02 -68.6 0.29 Allowed 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.722 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 90' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' R' ' 91' ' ' ALA . 9.4 mmtp -69.5 -75.37 0.11 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.665 0.745 . . . . 0.0 112.622 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 91' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -30.69 -64.83 0.13 Allowed 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.664 -1.607 . . . . 0.0 112.89 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 92' ' ' ALA . . . . . 0.58 ' HB3' ' O ' ' R' ' 88' ' ' SER . . . -68.23 163.08 55.34 Favored Pre-proline 0 N--CA 1.49 1.527 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.774 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 93' ' ' PRO . . . . . 0.555 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.5 Cg_endo -59.23 131.58 41.91 Favored 'Trans proline' 0 C--N 1.32 -0.936 0 C-N-CA 121.656 1.571 . . . . 0.0 111.868 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 94' ' ' VAL . . . . . 0.448 ' C ' ' H ' ' R' ' 96' ' ' LEU . 96.7 t -78.78 -18.74 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.379 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.73 6.36 1.18 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.504 -0.878 . . . . 0.0 110.484 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 96' ' ' LEU . . . . . 0.448 ' H ' ' C ' ' R' ' 94' ' ' VAL . 2.2 tp -80.12 -33.55 38.57 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.717 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -63.63 -25.56 68.28 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.97 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.17 -26.42 68.32 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.863 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 99' ' ' TRP . . . . . 0.617 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.7 t90 -110.48 -62.36 1.53 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.372 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 100' ' ' LEU . . . . . 0.49 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -40.96 -33.03 0.27 Allowed 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 118.999 -1.08 . . . . 0.0 113.334 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 101' ' ' GLU . . . . . 0.49 ' C ' ' O ' ' R' ' 100' ' ' LEU . 6.7 mm-40 -43.76 -37.92 2.95 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 117.668 -1.613 . . . . 0.0 107.366 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 102' ' ' GLU . . . . . 0.405 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.2 mt-10 -90.81 -27.28 18.97 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.567 -1.651 . . . . 0.0 112.05 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 103' ' ' VAL . . . . . 0.617 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.1 t -93.52 -1.25 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 117.651 -1.62 . . . . 0.0 110.79 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 104' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' R' ' 100' ' ' LEU . 20.1 tp -108.22 -51.47 2.89 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.629 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' R' R ' 105' ' ' LEU . . . . . 0.68 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.4 OUTLIER -78.19 -28.52 48.16 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 118.845 -1.142 . . . . 0.0 111.73 -179.894 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttm . . . . . 0 N--CA 1.489 1.522 0 C-N-CA 118.937 -1.105 . . . . 0.0 110.583 -179.99 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 121.075 0.465 . . . . 0.0 110.105 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' S' S ' 16' ' ' HIS . . . . . 0.409 ' H ' ' H ' ' S' ' 17' ' ' GLN . 26.3 t-80 -161.78 -12.54 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.606 -0.837 . . . . 0.0 110.637 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 17' ' ' GLN . . . . . 0.409 ' H ' ' H ' ' S' ' 16' ' ' HIS . 4.3 mt-30 -86.26 -85.69 0.15 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.499 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 18' ' ' GLU . . . . . 0.503 ' N ' ' CD ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -47.28 -33.6 5.77 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.901 -1.12 . . . . 0.0 108.116 179.791 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 19' ' ' TRP . . . . . 0.605 ' CH2' ' OE2' ' R' ' 47' ' ' GLU . 27.7 t-105 -51.34 -61.52 2.19 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.437 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 20' ' ' LEU . . . . . 0.439 ' O ' ' N ' ' S' ' 24' ' ' ASP . 1.3 mt -56.34 -41.72 76.55 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.511 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 21' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' S' ' 22' ' ' PHE . 20.4 mmt180 -44.15 -64.3 0.7 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.523 -1.271 . . . . 0.0 109.64 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 22' ' ' PHE . . . . . 0.549 ' O ' HD13 ' S' ' 26' ' ' LEU . 4.3 t80 -40.27 -40.39 1.13 Allowed 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 119.062 -1.055 . . . . 0.0 109.765 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 23' ' ' VAL . . . . . 0.841 HG13 HD21 ' R' ' 26' ' ' LEU . 45.1 t -80.56 -74.09 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 119.953 -0.699 . . . . 0.0 111.065 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 24' ' ' ASP . . . . . 0.511 ' O ' ' ND2' ' S' ' 28' ' ' ASN . 0.7 OUTLIER -36.63 -32.17 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.097 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 25' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' S' ' 23' ' ' VAL . 63.0 tp -73.54 -49.78 24.72 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.676 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 26' ' ' LEU . . . . . 0.562 HD11 ' CD1' ' S' ' 39' ' ' LEU . 1.4 mp -49.75 -59.78 3.5 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.931 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 27' ' ' LYS . . . . . 0.408 ' O ' ' NE2' ' S' ' 31' ' ' GLN . 0.4 OUTLIER -54.74 -21.39 10.8 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.603 -0.839 . . . . 0.0 113.244 -179.711 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 28' ' ' ASN . . . . . 0.511 ' ND2' ' O ' ' S' ' 24' ' ' ASP . 74.6 m-20 -89.89 -21.15 22.65 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 118.754 -1.179 . . . . 0.0 111.421 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 29' ' ' ALA . . . . . 0.602 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -95.42 -29.8 14.23 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.256 -0.978 . . . . 0.0 111.842 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 30' ' ' TYR . . . . . 0.414 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 6.9 t80 -46.83 -58.26 4.09 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 118.906 -1.118 . . . . 0.0 110.887 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 31' ' ' GLN . . . . . 0.595 ' CD ' ' H ' ' S' ' 31' ' ' GLN . 0.0 OUTLIER -56.6 -18.26 11.36 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.211 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 32' ' ' ASN . . . . . 0.442 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -98.69 -17.38 18.59 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.926 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 33' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.8 OUTLIER 78.73 27.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.608 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 34' ' ' LEU . . . . . 0.602 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.5 mm? -103.9 -13.76 16.25 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.017 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 35' ' ' HIS . . . . . 0.446 ' O ' HD13 ' S' ' 39' ' ' LEU . 24.8 p-80 -51.53 -24.63 5.46 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.387 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 36' ' ' LEU . . . . . 0.485 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.0 mt -70.64 -63.92 1.47 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 117.94 -1.504 . . . . 0.0 110.359 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 37' ' ' PRO . . . . . 0.485 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.6 Cg_endo -52.43 -33.67 57.93 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 120.719 0.946 . . . . 0.0 110.8 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.31 -41.28 63.73 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.02 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 39' ' ' LEU . . . . . 0.562 ' CD1' HD11 ' S' ' 26' ' ' LEU . 0.3 OUTLIER -51.55 -44.62 62.75 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.443 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -71.86 10.92 0.6 Allowed 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.608 -179.996 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 41' ' ' LEU . . . . . 0.472 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.2 tp -106.87 -61.68 1.5 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.983 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 42' ' ' MET . . . . . 0.453 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 0.1 OUTLIER -100.16 39.34 1.35 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.196 -179.792 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 43' ' ' LEU . . . . . 0.479 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.3 OUTLIER 163.08 129.88 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 44' ' ' THR . . . . . 0.653 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.3 OUTLIER 178.7 -35.72 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.665 0 C-N-CA 117.469 -1.693 . . . . 0.0 115.298 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 45' ' ' PRO . . . . . 0.653 ' HD2' ' H ' ' S' ' 44' ' ' THR . 18.8 Cg_endo -78.89 -109.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 120.81 1.006 . . . . 0.0 112.793 -179.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.57 -15.97 43.7 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.016 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 47' ' ' GLU . . . . . 0.408 ' O ' ' CB ' ' S' ' 51' ' ' LEU . 45.5 mt-10 -70.48 -57.4 4.82 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 119.334 -0.947 . . . . 0.0 110.298 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -55.09 -40.38 70.36 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.724 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.23 -66.14 0.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.147 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 50' ' ' ALA . . . . . 0.815 ' HA ' HG22 ' S' ' 53' ' ' THR . . . -63.13 -33.13 74.81 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.778 -1.169 . . . . 0.0 111.044 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 51' ' ' LEU . . . . . 0.525 ' O ' HG23 ' S' ' 55' ' ' VAL . 1.7 tt -50.42 -28.71 8.69 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 52' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' S' ' 50' ' ' ALA . . . -83.05 -39.14 10.35 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 112.695 -2.048 . . . . 0.0 114.002 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 53' ' ' THR . . . . . 0.815 HG22 ' HA ' ' S' ' 50' ' ' ALA . 0.5 OUTLIER -55.04 -60.46 3.34 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 116.039 -2.264 . . . . 0.0 108.309 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 54' ' ' ARG . . . . . 0.678 ' O ' HG23 ' S' ' 58' ' ' VAL . 3.0 ptp180 -48.56 -45.12 37.25 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.416 -1.314 . . . . 0.0 109.665 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 55' ' ' VAL . . . . . 0.525 HG23 ' O ' ' S' ' 51' ' ' LEU . 97.7 t -67.71 -21.91 27.8 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 C-N-CA 116.949 -1.9 . . . . 0.0 109.125 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 56' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' S' ' 53' ' ' THR . 2.4 ptt180 -83.29 -42.64 16.92 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 118.672 -1.211 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 57' ' ' ILE . . . . . 0.904 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -70.81 -31.93 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 115.99 -2.284 . . . . 0.0 105.745 -179.803 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 58' ' ' VAL . . . . . 0.904 ' N ' HD13 ' S' ' 57' ' ' ILE . 24.4 t -57.64 -63.83 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 118.541 -1.263 . . . . 0.0 108.307 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -43.79 -26.86 0.28 Allowed 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.205 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 60' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' S' ' 60' ' ' GLU . 0.0 OUTLIER -88.36 -32.92 18.14 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.585 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 61' ' ' LEU . . . . . 0.771 ' O ' HD12 ' S' ' 61' ' ' LEU . 0.5 OUTLIER -55.09 -20.79 10.66 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 117.254 -1.779 . . . . 0.0 106.623 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 62' ' ' LEU . . . . . 0.476 ' N ' ' C ' ' S' ' 60' ' ' GLU . 0.6 OUTLIER -78.28 30.14 0.18 Allowed 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.874 -1.512 . . . . 0.0 107.736 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 63' ' ' ARG . . . . . 0.578 ' H ' ' C ' ' S' ' 61' ' ' LEU . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.868 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 73' ' ' ASN . . . . . 0.406 ' HB3' ' H ' ' S' ' 74' ' ' GLU . 0.5 OUTLIER -125.92 -92.13 0.51 Allowed 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.22 -1.355 . . . . 0.0 109.318 179.524 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 74' ' ' GLU . . . . . 0.441 ' HG3' ' H ' ' S' ' 75' ' ' LEU . 0.0 OUTLIER -171.75 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.301 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.87 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 75' ' ' LEU . . . . . 0.441 ' H ' ' HG3' ' S' ' 74' ' ' GLU . 1.7 tm? -112.99 -15.98 12.75 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -46.8 -59.86 5.24 Favored Glycine 0 N--CA 1.479 1.526 0 C-N-CA 119.307 -1.425 . . . . 0.0 109.834 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.0 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 117.443 -1.703 . . . . 0.0 114.714 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.62 134.74 6.75 Favored Glycine 0 N--CA 1.501 2.968 0 N-CA-C 106.717 -2.553 . . . . 0.0 106.717 -179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 79' ' ' ILE . . . . . 0.564 ' O ' ' N ' ' S' ' 81' ' ' THR . 0.0 OUTLIER -56.97 -34.96 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 C-N-CA 118.397 -1.321 . . . . 0.0 112.95 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 80' ' ' ALA . . . . . 0.495 ' C ' ' O ' ' S' ' 79' ' ' ILE . . . -35.3 -31.08 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.366 -0.934 . . . . 0.0 109.378 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 81' ' ' THR . . . . . 0.564 ' N ' ' O ' ' S' ' 79' ' ' ILE . 0.2 OUTLIER -78.16 -60.39 2.39 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 114.299 -1.318 . . . . 0.0 111.344 179.683 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 82' ' ' ILE . . . . . 0.405 ' H ' HG23 ' S' ' 82' ' ' ILE . 1.5 pt -63.62 -10.91 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.66 -51.02 15.52 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.2 -1.8 . . . . 0.0 109.549 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 84' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 85' ' ' GLY . 1.8 mpt_? -48.93 -70.88 0.08 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.027 0.918 . . . . 0.0 110.669 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 85' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' S' ' 84' ' ' ARG . . . -20.11 -55.84 0.01 OUTLIER Glycine 0 N--CA 1.487 2.073 0 CA-C-N 113.017 -1.901 . . . . 0.0 114.346 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 86' ' ' SER . . . . . 0.572 ' C ' ' H ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -86.39 -61.83 1.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 118.215 -1.394 . . . . 0.0 112.905 -179.776 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -56.73 5.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.235 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 88' ' ' SER . . . . . 0.572 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -52.61 -36.33 56.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.849 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 89' ' ' LEU . . . . . 0.914 ' H ' HD12 ' S' ' 89' ' ' LEU . 2.4 mp -75.46 -54.21 7.41 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.957 -1.097 . . . . 0.0 110.872 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 90' ' ' LYS . . . . . 0.464 ' O ' ' C ' ' S' ' 91' ' ' ALA . 23.8 mttt -45.28 -64.05 0.8 Allowed 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.67 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 91' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' S' ' 92' ' ' ALA . . . -23.76 -66.76 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 113.676 -1.602 . . . . 0.0 112.914 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 92' ' ' ALA . . . . . 0.675 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . 178.39 -51.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.52 0 C-N-CA 118.792 -1.163 . . . . 0.0 113.181 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 93' ' ' PRO . . . . . 0.675 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 5.6 Cg_exo -58.36 97.51 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.829 0 C-N-CA 120.66 0.906 . . . . 0.0 111.807 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 94' ' ' VAL . . . . . 0.457 ' O ' HG12 ' S' ' 94' ' ' VAL . 28.8 t -110.86 -12.4 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -78.14 -28.81 48.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.209 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 96' ' ' LEU . . . . . 0.434 HD22 HD21 ' R' ' 38' ' ' LEU . 71.3 mt -46.55 -33.3 4.0 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.719 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.76 -36.95 85.57 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.771 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -65.31 -31.34 72.42 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.659 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 99' ' ' TRP . . . . . 0.541 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 14.2 t90 -86.8 -58.73 2.49 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.988 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 100' ' ' LEU . . . . . 0.519 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -36.72 -38.29 0.17 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.352 -0.939 . . . . 0.0 112.929 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 101' ' ' GLU . . . . . 0.519 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.8 mt-10 -41.43 -44.82 2.97 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 102' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' S' ' 99' ' ' TRP . 1.8 tt0 -75.8 -33.77 60.15 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.493 -1.685 . . . . 0.0 111.49 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 103' ' ' VAL . . . . . 0.541 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 3.6 t -85.16 -52.63 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 116.881 -1.928 . . . . 0.0 111.707 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' S' S ' 104' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' S' ' 100' ' ' LEU . 0.9 OUTLIER -56.54 -57.3 12.94 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.935 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 95.1 mt -51.13 -68.11 0.2 Allowed 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.445 -1.302 . . . . 0.0 110.473 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mttp -44.85 -56.86 4.16 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.651 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 116.399 -1.762 . . . . 0.0 110.848 179.99 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 1.2 tp-100 . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 4.4 m -147.43 71.47 11.81 Favored Pre-proline 0 N--CA 1.489 1.48 0 C-N-CA 119.139 -1.024 . . . . 0.0 111.338 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -67.4 133.45 30.28 Favored 'Trans proline' 0 C--N 1.314 -1.289 0 C-N-CA 121.68 1.586 . . . . 0.0 111.977 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 68.6 m-85 -89.6 89.64 7.91 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.103 -1.039 . . . . 0.0 110.754 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 7.8 t 54.87 52.64 11.64 Favored 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.526 -0.87 . . . . 0.0 110.55 -179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . 51.73 -144.41 0.59 Allowed 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.477 -0.889 . . . . 0.0 110.325 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -144.82 169.5 17.92 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.757 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 11.7 mtm -85.91 90.24 8.01 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.135 -1.026 . . . . 0.0 110.437 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.95 150.96 22.99 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.89 -179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -80.43 -49.7 11.09 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.47 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 pt20 -72.49 179.42 3.5 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.366 -0.934 . . . . 0.0 111.454 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 11.7 mtt85 -82.96 104.53 13.24 Favored 'General case' 0 N--CA 1.493 1.681 0 C-N-CA 119.342 -0.943 . . . . 0.0 111.306 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -144.21 -11.08 0.64 Allowed 'General case' 0 N--CA 1.492 1.673 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.18 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -90.09 -72.38 0.57 Allowed 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.086 -1.046 . . . . 0.0 109.648 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -49.26 -35.28 17.24 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 107.915 -1.143 . . . . 0.0 107.915 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 46.1 t-105 -51.05 -62.52 1.56 Allowed 'General case' 0 C--N 1.303 -1.438 0 CA-C-N 113.628 -1.624 . . . . 0.0 107.2 179.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.8 tp -45.79 -38.09 6.76 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 112.938 -1.937 . . . . 0.0 110.316 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.434 ' O ' ' C ' ' R' ' 22' ' ' PHE . 26.5 mmt180 -55.93 -66.42 0.43 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 117.17 -1.812 . . . . 0.0 107.69 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.454 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -39.35 -43.24 1.15 Allowed 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 118.619 -1.232 . . . . 0.0 111.068 179.318 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . 0.463 ' O ' ' N ' ' R' ' 26' ' ' LEU . 40.4 t -68.11 -70.67 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 119.384 -0.927 . . . . 0.0 111.108 -179.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.436 ' C ' ' O ' ' R' ' 23' ' ' VAL . 4.7 t0 -25.98 -48.83 0.03 OUTLIER 'General case' 0 C--N 1.303 -1.428 0 CA-C-N 114.227 -1.351 . . . . 0.0 113.19 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.689 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -77.3 -45.71 25.34 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 117.017 -1.873 . . . . 0.0 109.322 -179.923 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . 0.662 ' C ' HD12 ' R' ' 26' ' ' LEU . 0.2 OUTLIER -47.12 -52.74 14.57 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 118.959 -1.096 . . . . 0.0 111.101 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . 0.487 ' O ' ' N ' ' R' ' 29' ' ' ALA . 18.4 tptm -66.95 -68.46 0.37 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.103 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -41.86 -20.51 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 119.241 -0.984 . . . . 0.0 112.071 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.487 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -83.59 -54.22 5.1 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -43.79 -25.97 0.22 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 118.939 -1.104 . . . . 0.0 110.346 -179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . 0.413 ' N ' ' C ' ' R' ' 29' ' ' ALA . 2.6 tt0 -50.8 -41.92 57.63 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.532 -0.867 . . . . 0.0 109.548 179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m-80 -106.1 -72.17 0.72 Allowed 'General case' 0 N--CA 1.485 1.321 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.813 179.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . 0.631 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.7 OUTLIER 170.7 17.43 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.049 -1.06 . . . . 0.0 112.881 -179.746 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . 1.022 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.0 OUTLIER -92.69 -10.53 36.86 Favored 'General case' 0 N--CA 1.495 1.794 0 C-N-CA 118.251 -1.379 . . . . 0.0 110.614 -179.869 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . 0.444 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 11.0 p-80 -44.47 -30.88 0.94 Allowed 'General case' 0 C--N 1.292 -1.9 0 C-N-CA 119.446 -0.901 . . . . 0.0 112.929 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . . . . . . . . . 11.9 mt -69.68 -58.11 5.96 Favored Pre-proline 0 N--CA 1.487 1.409 0 C-N-CA 117.884 -1.526 . . . . 0.0 109.906 -179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -58.18 -29.98 89.15 Favored 'Trans proline' 0 C--N 1.317 -1.128 0 C-N-CA 119.923 0.415 . . . . 0.0 111.618 179.184 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -75.53 -45.97 34.91 Favored 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.694 -0.803 . . . . 0.0 109.283 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 43' ' ' LEU . 0.2 OUTLIER -45.87 -44.15 14.2 Favored 'General case' 0 C--N 1.303 -1.45 0 CA-C-N 114.8 -1.091 . . . . 0.0 108.777 179.452 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . 0.529 ' O ' ' N ' ' R' ' 109' ' ' TRP . 1.2 m120 -70.21 -16.48 63.07 Favored 'General case' 0 N--CA 1.494 1.768 0 CA-C-N 115.249 -0.887 . . . . 0.0 112.16 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tp -78.62 -48.61 14.76 Favored 'General case' 0 C--N 1.297 -1.71 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.738 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -128.13 47.39 2.42 Favored 'General case' 0 N--CA 1.511 2.593 0 C-N-CA 118.38 -1.328 . . . . 0.0 112.512 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . 0.472 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER 173.26 117.47 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.697 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.387 -179.833 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.614 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -35.86 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.513 0 N-CA-C 117.905 2.557 . . . . 0.0 117.905 -179.956 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.614 ' CD ' ' H ' ' R' ' 44' ' ' THR . 32.9 Cg_endo -80.91 -101.19 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.363 0 C-N-CA 121.154 1.236 . . . . 0.0 114.197 -179.087 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -53.44 -18.92 3.02 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.516 ' OE2' ' NH1' ' S' ' 54' ' ' ARG . 0.4 OUTLIER -63.76 -65.74 0.64 Allowed 'General case' 0 C--N 1.302 -1.483 0 CA-C-N 113.395 -1.73 . . . . 0.0 109.832 179.843 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . 0.461 ' NH2' ' O ' ' S' ' 15' ' ' ARG . 2.7 mmm180 -51.62 -30.56 21.88 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 118.773 -1.171 . . . . 0.0 110.912 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . 0.435 ' O ' ' OG1' ' R' ' 53' ' ' THR . 4.6 mt-10 -82.89 -72.81 0.43 Allowed 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.781 1.03 . . . . 0.0 113.781 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -62.19 -43.03 99.74 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 114.028 1.122 . . . . 0.0 114.028 -179.361 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . 0.678 ' C ' HD12 ' R' ' 51' ' ' LEU . 0.2 OUTLIER -58.51 -46.84 85.92 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 117.986 -1.486 . . . . 0.0 111.248 -179.802 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . 0.413 ' N ' ' HG ' ' R' ' 51' ' ' LEU . . . -53.95 -59.26 10.14 Favored Glycine 0 N--CA 1.488 2.158 0 N-CA-C 107.496 -2.241 . . . . 0.0 107.496 179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.528 ' O ' HG23 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -34.3 -78.67 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.384 0 CA-C-N 114.183 -1.008 . . . . 0.0 112.239 179.955 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.459 ' O ' HG12 ' R' ' 58' ' ' VAL . 0.0 OUTLIER -41.77 -56.42 2.68 Favored 'General case' 0 C--N 1.298 -1.667 0 N-CA-C 113.839 1.052 . . . . 0.0 113.839 -179.644 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 14.9 p -67.01 -18.86 24.87 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 114.956 -2.698 . . . . 0.0 110.548 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.505 ' O ' ' CG ' ' R' ' 60' ' ' GLU . 0.0 OUTLIER -93.02 -29.38 15.85 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 118.016 -1.474 . . . . 0.0 112.418 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 0.67 ' C ' HD12 ' R' ' 57' ' ' ILE . 0.2 OUTLIER -76.31 -41.43 36.37 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 115.663 -2.415 . . . . 0.0 106.872 -179.731 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 0.609 HG13 ' N ' ' R' ' 59' ' ' GLU . 7.3 p -66.33 -52.94 41.53 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 117.391 -1.724 . . . . 0.0 110.822 179.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.609 ' N ' HG13 ' R' ' 58' ' ' VAL . 5.7 tt0 -64.03 -12.99 43.57 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.33 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . 0.505 ' CG ' ' O ' ' R' ' 56' ' ' ARG . 3.4 mm-40 -78.97 -52.3 8.44 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.739 -179.95 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . 0.464 ' C ' ' H ' ' R' ' 63' ' ' ARG . 2.1 pp -89.4 -25.85 21.33 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 118.067 -1.453 . . . . 0.0 111.554 -179.753 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp -77.8 22.92 0.26 Allowed 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 118.321 -1.351 . . . . 0.0 110.696 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . 0.464 ' H ' ' C ' ' R' ' 61' ' ' LEU . 20.1 ttt180 -114.58 -47.02 2.92 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 119.918 -0.713 . . . . 0.0 110.846 179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -96.71 -88.56 1.83 Allowed Glycine 0 N--CA 1.494 2.555 0 C-N-CA 119.451 -1.357 . . . . 0.0 109.715 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -143.62 -54.55 0.37 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.673 -0.811 . . . . 0.0 110.565 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . 0.446 ' O ' ' CB ' ' R' ' 67' ' ' SER . 5.5 ttm -159.97 178.97 9.18 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.422 -0.911 . . . . 0.0 111.053 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . 0.446 ' CB ' ' O ' ' R' ' 66' ' ' MET . 1.3 t 163.62 86.67 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.473 0 CA-C-N 115.688 -0.687 . . . . 0.0 109.834 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . 0.512 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.4 OUTLIER -124.89 -24.65 4.04 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 115.285 -0.871 . . . . 0.0 109.941 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -72.36 28.98 0.05 Allowed 'General case' 0 C--N 1.305 -1.358 0 CA-C-N 115.352 -0.84 . . . . 0.0 111.733 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . 0.512 ' H ' ' C ' ' R' ' 68' ' ' GLN . 26.0 mt-10 -85.56 1.33 49.48 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-N 115.153 -0.931 . . . . 0.0 110.183 -179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 tp 61.39 147.39 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.142 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 14.3 mttp -42.62 128.27 4.0 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.119 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . 0.61 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.5 OUTLIER -96.73 10.56 38.38 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 107.7 -1.222 . . . . 0.0 107.7 179.81 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . 0.444 ' O ' ' N ' ' R' ' 76' ' ' GLY . 23.5 mm-40 40.55 -75.02 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.677 0 CA-C-N 110.926 -2.852 . . . . 0.0 112.231 179.758 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.61 ' N ' ' O ' ' R' ' 73' ' ' ASN . 6.3 mt -42.67 -22.75 0.03 OUTLIER 'General case' 0 C--N 1.292 -1.927 0 CA-C-N 113.384 -1.735 . . . . 0.0 110.845 -179.568 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . 0.444 ' N ' ' O ' ' R' ' 74' ' ' GLU . . . -102.54 -61.17 0.73 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 110.023 -1.231 . . . . 0.0 110.023 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.96 -94.56 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 103.54 1.01 46.76 Favored Glycine 0 N--CA 1.491 2.334 0 C-N-CA 119.867 -1.159 . . . . 0.0 113.958 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.845 ' H ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -122.11 -72.98 0.55 Allowed 'Isoleucine or valine' 0 CA--C 1.558 1.253 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 179.824 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.534 ' O ' ' N ' ' R' ' 82' ' ' ILE . . . -102.34 -71.28 0.72 Allowed 'General case' 0 N--CA 1.506 2.339 0 N-CA-C 114.459 1.281 . . . . 0.0 114.459 -179.349 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . 0.647 ' HG1' ' HE1' ' R' ' 1' ' ' TRP . 0.6 OUTLIER -37.09 -21.13 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.56 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -79.75 -31.26 13.7 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 C-N-CA 118.118 -1.433 . . . . 0.0 112.389 -179.766 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -100.35 19.71 16.14 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 113.943 1.09 . . . . 0.0 113.943 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.671 ' NE ' ' CE2' ' R' ' 1' ' ' TRP . 0.1 OUTLIER -93.46 -39.74 10.73 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 117.575 -1.65 . . . . 0.0 107.804 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . 0.418 ' N ' ' CD ' ' R' ' 84' ' ' ARG . . . -40.57 -24.72 0.08 OUTLIER Glycine 0 N--CA 1.481 1.699 0 CA-C-N 113.48 -1.691 . . . . 0.0 110.561 180.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . 0.478 ' N ' ' O ' ' R' ' 84' ' ' ARG . 1.8 t -81.48 -70.3 0.55 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.281 -0.968 . . . . 0.0 110.312 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 58.3 m-80 -60.26 -3.59 0.65 Allowed 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.97 -179.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . 0.477 ' HA ' ' HB3' ' R' ' 91' ' ' ALA . 0.6 OUTLIER -48.48 -26.73 2.29 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.98 -1.088 . . . . 0.0 110.698 -179.958 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.7 mt -41.18 -42.12 1.98 Allowed 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 119.966 -0.693 . . . . 0.0 110.957 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.97 -50.26 3.03 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 121.799 0.809 . . . . 0.0 110.399 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . 0.477 ' HB3' ' HA ' ' R' ' 88' ' ' SER . . . -39.26 -55.34 1.71 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.817 -1.538 . . . . 0.0 112.351 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -63.45 162.77 23.44 Favored Pre-proline 0 N--CA 1.489 1.503 0 C-N-CA 119.365 -0.934 . . . . 0.0 109.814 179.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 1.5 Cg_endo -56.82 170.04 1.58 Allowed 'Trans proline' 0 C--N 1.316 -1.143 0 C-N-CA 121.02 1.146 . . . . 0.0 111.593 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . 0.445 ' C ' ' H ' ' R' ' 96' ' ' LEU . 79.5 t -93.98 -31.08 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.388 0 C-N-CA 119.554 -0.858 . . . . 0.0 110.797 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -66.47 3.6 0.93 Allowed 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.894 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . 0.486 HD13 ' HG2' ' R' ' 93' ' ' PRO . 1.3 tp -84.69 -44.93 12.95 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.483 -0.887 . . . . 0.0 110.593 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -59.07 -24.32 62.8 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.764 -0.775 . . . . 0.0 109.543 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 20.2 mt-30 -63.25 -40.08 96.41 Favored 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.435 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.635 ' CE3' HG21 ' R' ' 103' ' ' VAL . 7.3 t90 -101.2 -60.04 1.59 Allowed 'General case' 0 N--CA 1.512 2.672 0 C-N-CA 120.025 -0.67 . . . . 0.0 112.327 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.455 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -43.67 -19.74 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.364 0 C-N-CA 118.386 -1.325 . . . . 0.0 113.57 179.589 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.455 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.2 mm-40 -53.23 -37.13 61.79 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.418 ' N ' ' C ' ' R' ' 100' ' ' LEU . 3.7 mt-10 -86.81 -37.66 17.57 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 111.622 -2.535 . . . . 0.0 114.556 179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.635 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.0 t -82.62 -9.53 11.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 C-N-CA 116.08 -2.248 . . . . 0.0 111.69 -179.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 22.3 tp -94.37 -56.2 2.9 Favored 'General case' 0 C--N 1.3 -1.546 0 CA-C-N 115.793 -0.639 . . . . 0.0 112.12 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . 0.654 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.4 OUTLIER -68.3 -27.17 66.06 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.847 -1.141 . . . . 0.0 111.548 -179.643 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 27.2 tttp -60.38 -40.12 89.73 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 119.111 -1.036 . . . . 0.0 110.438 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.41 0 CA-C-O 116.326 -1.797 . . . . 0.0 110.415 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 57.5 mt-30 . . . . . 0 N--CA 1.485 1.324 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . 0.537 ' N ' ' CD ' ' S' ' 6' ' ' PRO . 0.2 OUTLIER -81.98 -41.82 1.01 Allowed Pre-proline 0 N--CA 1.485 1.306 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.764 179.914 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . 0.537 ' CD ' ' N ' ' S' ' 5' ' ' SER . 2.0 Cg_endo -74.74 148.64 36.84 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 120.471 0.781 . . . . 0.0 111.86 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 43.1 t80 54.06 80.14 0.12 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.975 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -153.73 -57.19 0.12 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.696 179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -147.16 -2.1 0.62 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.87 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -84.88 65.82 9.37 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.28 -0.968 . . . . 0.0 110.54 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 36.7 mtt -92.25 115.13 27.81 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.423 -0.911 . . . . 0.0 110.688 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -171.28 103.08 0.21 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.431 -0.908 . . . . 0.0 110.554 -179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . 0.466 ' O ' ' N ' ' S' ' 15' ' ' ARG . 0.4 OUTLIER -155.32 71.51 0.78 Allowed 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 118.981 -1.088 . . . . 0.0 111.368 -179.964 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 41.6 mt-30 -61.86 80.63 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.009 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . 0.466 ' N ' ' O ' ' S' ' 13' ' ' GLU . 4.1 mtt180 -88.34 142.02 28.08 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.185 -1.006 . . . . 0.0 110.656 179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -157.32 -0.77 0.11 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.932 -0.707 . . . . 0.0 110.223 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.444 ' C ' ' N ' ' S' ' 19' ' ' TRP . 6.1 mt-30 -95.4 -83.33 0.36 Allowed 'General case' 0 N--CA 1.486 1.335 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.833 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.417 ' C ' ' O ' ' S' ' 17' ' ' GLN . 9.2 pt-20 -45.22 -30.52 1.23 Allowed 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . 0.444 ' N ' ' C ' ' S' ' 17' ' ' GLN . 62.4 t-105 -55.89 -64.01 0.99 Allowed 'General case' 0 N--CA 1.488 1.456 0 CA-C-N 113.675 -1.602 . . . . 0.0 108.146 179.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . 0.447 ' O ' ' N ' ' S' ' 24' ' ' ASP . 6.5 tp -48.14 -36.71 13.92 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 113.888 -1.505 . . . . 0.0 109.92 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.439 ' O ' ' C ' ' S' ' 22' ' ' PHE . 17.6 mmt180 -56.53 -67.39 0.31 Allowed 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 117.383 -1.727 . . . . 0.0 106.361 179.704 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.459 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -37.55 -47.29 0.91 Allowed 'General case' 0 C--N 1.312 -1.064 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.58 178.924 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.433 HG23 ' CD2' ' S' ' 22' ' ' PHE . 48.6 t -74.27 -74.7 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.594 -179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.447 ' N ' ' O ' ' S' ' 20' ' ' LEU . 14.3 t0 -37.1 -41.73 0.38 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 120.205 -0.598 . . . . 0.0 111.596 179.964 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.517 HD23 ' SD ' ' S' ' 42' ' ' MET . 58.6 tp -60.62 -53.11 61.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 1.1 tt -56.07 -61.51 2.34 Favored 'General case' 0 N--CA 1.489 1.507 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.361 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 21.8 tptp -39.67 -53.97 2.1 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 120.047 -0.661 . . . . 0.0 112.572 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 15.8 m-80 -65.97 -25.28 67.03 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.473 -179.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . 0.549 ' HB1' HD13 ' S' ' 34' ' ' LEU . . . -82.99 -48.95 10.08 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.254 -0.978 . . . . 0.0 112.875 -179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . 0.485 ' CE2' ' NE2' ' S' ' 35' ' ' HIS . 9.4 t80 -42.09 -21.7 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.916 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' S' ' 29' ' ' ALA . 0.9 OUTLIER -69.63 -47.18 64.29 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.015 -1.074 . . . . 0.0 108.926 179.727 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.8 OUTLIER -74.72 -27.74 60.5 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.504 -0.879 . . . . 0.0 109.293 179.772 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.5 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 1.3 t70 86.49 50.72 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 115.195 -0.911 . . . . 0.0 111.479 179.645 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . 0.58 ' N ' ' CD1' ' S' ' 34' ' ' LEU . 0.0 OUTLIER -136.08 14.62 3.3 Favored 'General case' 0 C--N 1.304 -1.391 0 CA-C-O 122.708 1.242 . . . . 0.0 109.223 179.672 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . 0.485 ' NE2' ' CE2' ' S' ' 30' ' ' TYR . 31.1 p-80 -61.73 -19.15 62.11 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 112.904 -1.953 . . . . 0.0 111.526 179.745 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' S' ' 36' ' ' LEU . 7.8 mt -69.61 -59.01 5.09 Favored Pre-proline 0 N--CA 1.483 1.184 0 C-N-CA 118.894 -1.122 . . . . 0.0 109.213 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.427 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -54.31 -34.83 81.77 Favored 'Trans proline' 0 C--N 1.318 -1.076 0 N-CA-C 110.115 -0.763 . . . . 0.0 110.115 179.109 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . 0.474 HD22 HD21 ' S' ' 25' ' ' LEU . 19.5 mt -72.13 -40.45 68.07 Favored 'General case' 0 N--CA 1.498 1.951 0 C-N-CA 118.991 -1.084 . . . . 0.0 110.523 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.494 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.4 OUTLIER -50.61 -50.8 53.15 Favored 'General case' 0 N--CA 1.486 1.327 0 CA-C-O 121.523 0.678 . . . . 0.0 109.315 179.644 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . 0.614 ' ND2' HH12 ' S' ' 48' ' ' ARG . 0.7 OUTLIER -56.49 -6.06 0.26 Allowed 'General case' 0 N--CA 1.482 1.131 0 CA-C-N 115.146 -0.934 . . . . 0.0 110.349 -179.865 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . 0.501 ' CD1' HH22 ' R' ' 84' ' ' ARG . 1.8 tp -100.43 -67.87 0.84 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.901 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . 0.517 ' SD ' HD23 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -70.6 -3.88 20.43 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.658 -1.217 . . . . 0.0 111.172 -179.826 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . 0.448 ' O ' ' O ' ' S' ' 39' ' ' LEU . 1.5 mp -157.0 132.91 9.52 Favored 'General case' 0 N--CA 1.499 2.008 0 C-N-CA 119.799 -0.76 . . . . 0.0 110.177 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.597 ' H ' ' CD ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -170.42 -30.45 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.328 0 C-N-CA 115.916 -2.314 . . . . 0.0 116.407 179.829 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.597 ' CD ' ' H ' ' S' ' 44' ' ' THR . 34.1 Cg_endo -99.03 -102.97 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.398 0 CA-C-N 119.277 0.777 . . . . 0.0 113.701 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -54.44 -16.75 2.48 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 118.142 -1.423 . . . . 0.0 107.831 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . 0.457 ' N ' ' C ' ' S' ' 45' ' ' PRO . 0.5 OUTLIER -68.27 -67.48 0.46 Allowed 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.554 -1.203 . . . . 0.0 107.804 179.498 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . 0.614 HH12 ' ND2' ' S' ' 40' ' ' ASN . 0.0 OUTLIER -41.56 -33.81 0.5 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.762 -0.654 . . . . 0.0 111.927 179.774 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . 0.441 ' O ' ' OG1' ' S' ' 53' ' ' THR . 4.2 mt-10 -84.79 -67.83 0.77 Allowed 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 119.536 -0.866 . . . . 0.0 113.041 -179.755 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . 0.574 ' HB1' HH12 ' S' ' 54' ' ' ARG . . . -45.88 -23.67 0.31 Allowed 'General case' 0 C--N 1.297 -1.703 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.195 -179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . 0.411 ' C ' ' N ' ' S' ' 53' ' ' THR . 4.2 mp -77.46 -56.74 4.29 Favored 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 119.01 -1.076 . . . . 0.0 110.086 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -21.63 4.07 Favored Glycine 0 N--CA 1.495 2.619 0 C-N-CA 118.635 -1.745 . . . . 0.0 109.434 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.441 ' OG1' ' O ' ' S' ' 49' ' ' GLU . 0.1 OUTLIER -73.64 -78.67 0.09 Allowed 'General case' 0 C--N 1.299 -1.594 0 CA-C-N 114.173 -1.013 . . . . 0.0 111.007 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.574 HH12 ' HB1' ' S' ' 50' ' ' ALA . 23.3 mtt85 -41.58 -26.99 0.08 Allowed 'General case' 0 N--CA 1.499 2.022 0 C-N-CA 120.132 -0.627 . . . . 0.0 110.742 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 98.7 t -80.0 -41.5 21.37 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 C-N-CA 119.022 -1.071 . . . . 0.0 108.845 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.43 ' N ' ' O ' ' S' ' 53' ' ' THR . 19.7 mtt180 -58.33 -50.61 73.01 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 116.993 -1.883 . . . . 0.0 107.34 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -62.46 -66.57 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 C-N-CA 117.035 -1.866 . . . . 0.0 111.293 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 52.0 t -42.93 -64.45 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.51 2.564 0 C-N-CA 118.424 -1.31 . . . . 0.0 113.318 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -48.55 -46.7 39.23 Favored 'General case' 0 N--CA 1.486 1.361 0 CA-C-N 115.124 -0.944 . . . . 0.0 111.985 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -67.74 -30.63 70.16 Favored 'General case' 0 N--CA 1.498 1.945 0 C-N-CA 119.297 -0.961 . . . . 0.0 112.227 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 8.1 mt -63.15 -27.46 69.39 Favored 'General case' 0 C--N 1.284 -2.252 0 C-N-CA 118.467 -1.293 . . . . 0.0 110.757 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . 0.624 HD13 HD21 ' S' ' 104' ' ' LEU . 4.9 mt -81.87 -62.91 1.5 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 116.479 2.029 . . . . 0.0 116.479 -179.738 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -109.04 1.36 20.47 Favored 'General case' 0 N--CA 1.504 2.234 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.638 ' O ' ' N ' ' S' ' 66' ' ' MET . . . -110.35 21.23 24.51 Favored Glycine 0 C--N 1.295 -1.72 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . 0.55 ' C ' ' O ' ' S' ' 64' ' ' GLY . 75.3 mt-10 -20.3 -44.32 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 O-C-N 125.267 1.216 . . . . 0.0 110.014 179.636 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . 0.638 ' N ' ' O ' ' S' ' 64' ' ' GLY . 4.3 mmt -55.63 108.26 0.42 Allowed 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 106.064 -1.828 . . . . 0.0 106.064 179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 37.2 t -147.6 76.16 1.39 Allowed 'General case' 0 C--N 1.288 -2.086 0 N-CA-C 106.503 -1.666 . . . . 0.0 106.503 -179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.427 ' C ' ' H ' ' S' ' 70' ' ' GLU . 18.8 pt20 -122.67 -37.95 2.7 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 109.498 -3.501 . . . . 0.0 111.287 179.447 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.02 30.6 1.06 Allowed 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 123.03 1.395 . . . . 0.0 107.873 179.403 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.473 ' O ' ' C ' ' S' ' 71' ' ' LEU . 5.5 mm-40 -137.06 -31.5 0.83 Allowed 'General case' 0 C--N 1.29 -2.005 0 CA-C-N 112.818 -1.992 . . . . 0.0 113.782 -179.446 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . 0.473 ' C ' ' O ' ' S' ' 70' ' ' GLU . 10.4 mt -39.75 106.52 0.06 Allowed 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 113.772 -1.558 . . . . 0.0 110.465 -179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . 0.788 ' C ' ' H ' ' S' ' 74' ' ' GLU . 14.8 tttt 48.83 57.18 6.67 Favored 'General case' 0 N--CA 1.525 3.282 1 N-CA-C 122.063 4.097 . . . . 0.0 122.063 178.699 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . 0.26 0.2 OUTLIER -74.1 18.18 0.15 Allowed 'General case' 0 N--CA 1.519 2.989 0 O-C-N 118.418 -2.677 . . . . 0.0 108.844 179.455 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . 0.788 ' H ' ' C ' ' S' ' 72' ' ' LYS 0.363 0.0 OUTLIER 40.81 -51.1 0.0 OUTLIER 'General case' 1 N--CA 1.58 6.033 1 N-CA-C 126.846 5.869 . . . . 0.0 126.846 -171.986 . . . . . . . . 6 4 . 1 . 001 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . 0.501 HD12 ' N ' ' S' ' 76' ' ' GLY . 3.4 pp -91.29 -20.36 21.97 Favored 'General case' 0 C--N 1.267 -2.982 0 CA-C-N 118.796 0.725 . . . . 0.0 112.039 -178.665 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . 0.501 ' N ' HD12 ' S' ' 75' ' ' LEU . . . -82.18 -16.38 72.03 Favored Glycine 1 N--CA 1.548 6.125 0 CA-C-N 112.728 -2.033 . . . . 0.0 115.106 178.932 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -136.72 -69.18 0.47 Allowed 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 115.923 -2.311 . . . . 0.0 113.344 179.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . 0.439 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 149.12 127.72 1.61 Allowed Glycine 0 CA--C 1.456 -3.644 1 N-CA-C 98.104 -5.999 . . . . 0.0 98.104 -179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -68.21 -22.61 27.71 Favored 'Isoleucine or valine' 0 C--N 1.262 -3.211 1 C-N-CA 111.581 -4.047 . . . . 0.0 106.397 -178.572 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.478 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -63.66 -37.32 86.88 Favored 'General case' 0 N--CA 1.511 2.619 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -179.363 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.439 ' OG1' ' O ' ' S' ' 78' ' ' GLY . 9.1 p -53.67 -55.94 21.62 Favored 'General case' 0 C--N 1.297 -1.683 0 C-N-CA 119.582 -0.847 . . . . 0.0 110.296 179.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . 0.468 HG21 HD13 ' S' ' 82' ' ' ILE 0.37 0.3 OUTLIER -63.28 11.21 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 N-CA-C 117.812 2.523 . . . . 0.0 117.812 -178.761 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.478 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -96.55 -62.28 1.29 Allowed 'General case' 0 N--CA 1.497 1.906 0 C-N-CA 118.402 -1.319 . . . . 0.0 108.063 178.686 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . 0.51 ' O ' ' N ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -52.34 -23.7 6.34 Favored 'General case' 0 N--CA 1.507 2.404 0 C-N-CA 118.357 -1.337 . . . . 0.0 109.006 179.241 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.63 -11.1 59.45 Favored Glycine 0 N--CA 1.498 2.825 0 CA-C-N 113.627 -1.624 . . . . 0.0 112.386 -179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.3 m -100.49 -23.16 14.78 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -179.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . 0.514 ' N ' ' ND2' ' S' ' 87' ' ' ASN . 0.6 OUTLIER -105.49 -3.8 22.05 Favored 'General case' 0 N--CA 1.5 2.067 0 CA-C-N 113.207 -1.815 . . . . 0.0 108.573 179.893 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . 0.51 ' N ' ' O ' ' S' ' 84' ' ' ARG . 0.2 OUTLIER -62.01 -15.6 45.36 Favored 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 106.426 -1.694 . . . . 0.0 106.426 -179.787 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . 0.462 ' N ' ' C ' ' S' ' 87' ' ' ASN . 3.4 mt -71.72 -78.9 0.08 Allowed 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.221 -1.809 . . . . 0.0 111.366 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -53.96 -66.61 0.36 Allowed 'General case' 0 N--CA 1.497 1.917 0 N-CA-C 116.116 1.895 . . . . 0.0 116.116 179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.54 0.35 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 117.286 2.328 . . . . 0.0 117.286 -179.217 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.13 160.04 76.9 Favored Pre-proline 0 N--CA 1.501 2.085 0 C-N-CA 118.482 -1.287 . . . . 0.0 110.359 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -68.27 158.22 58.46 Favored 'Trans proline' 0 C--N 1.324 -0.723 0 N-CA-C 108.29 -1.465 . . . . 0.0 108.29 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . 0.496 ' O ' ' N ' ' S' ' 96' ' ' LEU . 36.4 t -88.04 -65.12 0.99 Allowed 'Isoleucine or valine' 0 C--N 1.294 -1.837 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.353 -179.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 12.0 tt0 -45.37 -12.39 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 C-N-CA 119.065 -1.054 . . . . 0.0 112.783 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . 0.496 ' N ' ' O ' ' S' ' 94' ' ' VAL . 0.9 OUTLIER -65.59 -34.95 79.42 Favored 'General case' 0 N--CA 1.496 1.858 0 C-N-CA 117.882 -1.527 . . . . 0.0 109.04 179.827 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 3.4 mpt_? -54.08 -24.18 16.51 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.559 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 18.6 mt-30 -82.81 -28.92 29.9 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 118.516 -1.274 . . . . 0.0 110.814 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.712 ' CE3' HG21 ' S' ' 103' ' ' VAL . 6.2 t90 -90.34 -56.25 3.28 Favored 'General case' 0 N--CA 1.514 2.764 0 C-N-CA 120.167 -0.613 . . . . 0.0 111.518 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.611 HD12 HD23 ' S' ' 104' ' ' LEU . 1.6 mm? -40.18 -31.58 0.14 Allowed 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 118.954 -1.098 . . . . 0.0 113.829 179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.484 ' C ' ' O ' ' S' ' 100' ' ' LEU . 42.5 mt-10 -46.72 -39.7 12.05 Favored 'General case' 0 C--N 1.305 -1.351 0 N-CA-C 105.02 -2.215 . . . . 0.0 105.02 179.551 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -86.01 -32.76 21.31 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-N 112.79 -2.004 . . . . 0.0 114.333 -179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.712 HG21 ' CE3' ' S' ' 99' ' ' TRP . 2.8 t -90.64 -2.43 10.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 C-N-CA 116.64 -2.024 . . . . 0.0 113.125 -179.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . 0.624 HD21 HD13 ' S' ' 62' ' ' LEU . 0.2 OUTLIER -109.06 -49.36 3.14 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.148 -0.621 . . . . 0.0 111.92 -179.922 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . 0.433 ' N ' ' CD2' ' S' ' 105' ' ' LEU . 3.9 mm? -69.04 -64.2 0.91 Allowed 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 118.832 -1.147 . . . . 0.0 109.602 -179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.1 -57.83 10.49 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.202 -0.908 . . . . 0.0 110.646 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 3.3 m . . . . . 0 N--CA 1.486 1.33 0 CA-C-O 116.371 -1.776 . . . . 0.0 109.858 -179.996 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.671 ' CE2' ' NE ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 116.429 -1.748 . . . . 0.0 109.664 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.529 ' N ' ' O ' ' R' ' 40' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.48 1.055 0 CA-C-O 117.141 -1.409 . . . . 0.0 107.71 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 . . . . . 0 N--CA 1.486 1.337 0 CA-C-O 120.817 0.341 . . . . 0.0 110.549 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . 0.462 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.3 OUTLIER -60.57 -49.84 88.15 Favored Pre-proline 0 N--CA 1.486 1.33 0 C-N-CA 118.902 -1.119 . . . . 0.0 111.963 179.929 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' R' ' 5' ' ' SER . 6.1 Cg_endo -70.22 139.66 39.16 Favored 'Trans proline' 0 C--N 1.325 -0.696 0 C-N-CA 120.842 1.028 . . . . 0.0 111.164 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 2.9 m-85 -87.24 117.3 25.9 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.202 -0.999 . . . . 0.0 110.906 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -75.11 146.24 41.56 Favored 'General case' 0 C--N 1.304 -1.395 0 C-N-CA 119.351 -0.94 . . . . 0.0 111.042 179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -172.34 95.31 0.14 Allowed 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.579 -0.848 . . . . 0.0 110.532 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.68 -176.53 1.05 Allowed 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.078 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . 0.46 ' N ' ' SD ' ' R' ' 11' ' ' MET . 0.8 OUTLIER -83.24 178.91 7.87 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.551 -0.86 . . . . 0.0 111.22 -179.972 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -84.44 122.61 29.22 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.565 -0.854 . . . . 0.0 111.579 -179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -66.48 -37.1 84.37 Favored 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.133 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 20.4 mt-30 51.85 83.71 0.05 Allowed 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.587 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 27.2 mmm-85 -87.62 117.46 26.45 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.22 -0.992 . . . . 0.0 110.299 179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 32.3 t-80 -147.94 -2.2 0.55 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.572 -0.851 . . . . 0.0 110.934 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.416 ' C ' ' N ' ' R' ' 19' ' ' TRP . 2.7 mt-30 -83.88 -80.24 0.19 Allowed 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.022 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' R' ' 17' ' ' GLN . 5.3 mt-10 -44.2 -31.5 1.0 Allowed 'General case' 0 N--CA 1.495 1.779 0 CA-C-O 122.708 1.242 . . . . 0.0 108.666 179.777 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . 0.416 ' N ' ' C ' ' R' ' 17' ' ' GLN . 74.7 t-105 -56.82 -61.5 2.39 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-N 112.78 -2.009 . . . . 0.0 110.823 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.1 tt -48.11 -24.89 1.24 Allowed 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 114.815 -1.084 . . . . 0.0 110.976 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.533 ' O ' ' N ' ' R' ' 23' ' ' VAL . 10.1 mmt180 -69.78 -70.61 0.27 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 118.909 -1.116 . . . . 0.0 109.017 179.874 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.472 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.35 -33.19 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 120.253 -0.579 . . . . 0.0 111.318 179.695 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . 0.533 ' N ' ' O ' ' R' ' 21' ' ' ARG . 48.9 t -75.22 -55.88 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 119.536 -0.866 . . . . 0.0 110.323 179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 17.6 t0 -38.64 -52.84 1.65 Allowed 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.476 -0.784 . . . . 0.0 111.459 179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.413 ' N ' HD23 ' R' ' 25' ' ' LEU . 0.5 OUTLIER -64.38 -55.85 18.33 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.698 -1.201 . . . . 0.0 110.432 179.985 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . 0.501 HD11 HD11 ' R' ' 39' ' ' LEU . 0.4 OUTLIER -63.54 -7.05 6.04 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.731 -0.788 . . . . 0.0 112.149 -179.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 22.8 ttpt -83.66 -36.15 24.01 Favored 'General case' 0 C--N 1.299 -1.6 0 C-N-CA 118.882 -1.127 . . . . 0.0 112.821 -179.785 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 10.5 t-20 -113.08 -0.14 14.8 Favored 'General case' 0 N--CA 1.499 2.006 0 C-N-CA 119.69 -0.804 . . . . 0.0 113.098 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 30' ' ' TYR . . . -80.2 -53.17 6.92 Favored 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 118.884 -1.127 . . . . 0.0 112.647 -179.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . 0.436 ' C ' ' O ' ' R' ' 29' ' ' ALA . 14.8 t80 -30.75 -46.63 0.08 Allowed 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 112.795 0.665 . . . . 0.0 112.795 -179.829 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . 0.481 HE21 ' CA ' ' R' ' 31' ' ' GLN . 0.0 OUTLIER -58.7 -52.43 65.71 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.346 -0.942 . . . . 0.0 111.191 179.992 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . 0.507 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 15.9 m120 -78.03 -12.14 59.96 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.245 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . 0.507 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.9 t70 78.91 36.24 0.18 Allowed 'General case' 0 N--CA 1.496 1.832 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.233 -179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -99.48 -15.04 18.83 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.957 -1.019 . . . . 0.0 109.022 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . 0.446 ' O ' HD13 ' R' ' 39' ' ' LEU . 29.4 p-80 -52.42 -31.67 35.4 Favored 'General case' 0 C--N 1.294 -1.825 0 CA-C-N 113.882 -1.508 . . . . 0.0 113.358 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.45 HD23 ' HA ' ' R' ' 36' ' ' LEU . 5.8 mt -69.95 -61.52 2.88 Favored Pre-proline 0 C--N 1.303 -1.431 0 C-N-CA 117.849 -1.541 . . . . 0.0 111.768 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.438 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 1.5 Cg_endo -54.3 -25.44 38.88 Favored 'Trans proline' 0 C--N 1.314 -1.262 0 C-N-CA 120.493 0.795 . . . . 0.0 111.208 179.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 46.5 mt -85.26 -35.81 21.3 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.123 179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.501 HD11 HD11 ' R' ' 26' ' ' LEU . 0.1 OUTLIER -53.91 -36.15 62.42 Favored 'General case' 0 N--CA 1.49 1.545 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.514 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . 0.611 HD22 ' N ' ' R' ' 40' ' ' ASN . 1.7 m120 -73.31 4.57 4.46 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 119.627 -0.829 . . . . 0.0 111.012 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . 0.437 HD12 HD23 ' R' ' 38' ' ' LEU . 50.3 mt -110.68 -67.32 1.0 Allowed 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.857 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.0 OUTLIER -83.8 40.29 0.73 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.778 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -154.92 165.84 35.43 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-N 115.171 -0.922 . . . . 0.0 108.626 179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.651 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.293 0.2 OUTLIER -121.76 -151.69 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.607 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.353 -179.785 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.651 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.8 Cg_endo -101.09 -37.73 0.02 OUTLIER 'Trans proline' 0 C--N 1.33 -0.444 0 N-CA-C 109.953 -0.826 . . . . 0.0 109.953 179.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.77 -26.2 63.8 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 114.881 -1.054 . . . . 0.0 108.709 179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.422 ' O ' ' CB ' ' R' ' 51' ' ' LEU . 4.7 mm-40 -64.46 -51.0 65.27 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.344 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 6.1 mmm180 -51.73 -38.76 56.65 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 119.141 -1.023 . . . . 0.0 110.327 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . 0.447 ' O ' ' OG1' ' R' ' 53' ' ' THR . 1.2 tt0 -74.66 -67.84 0.6 Allowed 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.164 -1.015 . . . . 0.0 112.101 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.505 ' HB1' HH21 ' R' ' 54' ' ' ARG . . . -56.36 -41.35 76.02 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 120.042 -0.663 . . . . 0.0 112.718 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . 0.422 ' CB ' ' O ' ' R' ' 47' ' ' GLU . 0.9 OUTLIER -53.5 -66.84 0.32 Allowed 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 118.98 -1.088 . . . . 0.0 111.033 179.991 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.67 -44.62 6.89 Favored Glycine 0 N--CA 1.492 2.409 0 C-N-CA 119.295 -1.431 . . . . 0.0 109.941 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.546 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -49.02 -80.45 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 120.055 -0.658 . . . . 0.0 110.964 179.893 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.505 HH21 ' HB1' ' R' ' 50' ' ' ALA . 38.1 mtt-85 -37.53 -34.36 0.09 Allowed 'General case' 0 N--CA 1.495 1.782 0 CA-C-N 115.536 -0.757 . . . . 0.0 111.849 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 42.6 t -77.56 -32.62 18.51 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.541 0 C-N-CA 118.197 -1.401 . . . . 0.0 110.446 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -79.8 -35.47 38.42 Favored 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.258 179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 0.937 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.84 -36.37 32.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 117.641 -1.624 . . . . 0.0 108.941 179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 0.937 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.3 t -61.76 -61.44 1.6 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 C-N-CA 118.295 -1.362 . . . . 0.0 109.141 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.508 ' N ' HG12 ' R' ' 58' ' ' VAL . 1.3 mm-40 -45.9 -44.42 14.57 Favored 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.514 -0.875 . . . . 0.0 110.813 179.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -52.93 -52.26 58.44 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.106 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 65.8 mt -76.4 -1.66 28.06 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.619 -0.832 . . . . 0.0 111.53 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp -112.06 22.37 14.89 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 119.701 -0.799 . . . . 0.0 112.138 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 -77.23 -78.79 0.12 Allowed 'General case' 0 N--CA 1.486 1.356 0 C-N-CA 118.672 -1.211 . . . . 0.0 110.163 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -119.45 -72.36 0.37 Allowed Glycine 0 N--CA 1.489 2.198 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.404 ' O ' ' C ' ' R' ' 66' ' ' MET . 70.9 mt-10 -154.43 -55.51 0.1 Allowed 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.61 -0.836 . . . . 0.0 111.207 -179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . 0.404 ' C ' ' O ' ' R' ' 65' ' ' GLU . 8.4 tpp -35.1 141.84 0.06 Allowed 'General case' 0 N--CA 1.494 1.771 0 CA-C-N 115.544 -0.753 . . . . 0.0 112.425 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 19.5 p -167.2 71.21 0.11 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.713 -0.795 . . . . 0.0 110.932 179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . 0.52 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.2 OUTLIER -128.35 -25.35 2.96 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 119.879 -0.729 . . . . 0.0 110.656 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 5.5 tpt180 -71.65 32.51 0.05 Allowed 'General case' 0 C--N 1.305 -1.353 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.815 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . 0.52 ' H ' ' C ' ' R' ' 68' ' ' GLN . 3.3 pt-20 -100.77 24.13 9.58 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 119.835 -0.746 . . . . 0.0 110.989 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.12 131.15 45.78 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.346 -0.942 . . . . 0.0 110.994 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . 0.469 ' CB ' ' NZ ' ' R' ' 72' ' ' LYS . 1.7 ttmp? -69.41 126.73 30.65 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 119.568 -0.853 . . . . 0.0 111.117 -179.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 62.4 m-80 -101.07 -105.96 0.24 Allowed 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 121.775 0.798 . . . . 0.0 110.474 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . 0.462 ' CG ' ' N ' ' R' ' 75' ' ' LEU . 8.3 pt-20 -144.41 -35.77 0.34 Allowed 'General case' 0 C--N 1.279 -2.459 0 CA-C-N 114.365 -1.289 . . . . 0.0 109.769 179.786 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.462 ' N ' ' CG ' ' R' ' 74' ' ' GLU . 0.9 OUTLIER -116.22 -0.7 12.57 Favored 'General case' 0 C--N 1.308 -1.222 0 CA-C-N 115.086 -0.961 . . . . 0.0 109.397 179.853 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -55.59 -73.77 0.39 Allowed Glycine 0 N--CA 1.491 2.333 0 C-N-CA 119.647 -1.263 . . . . 0.0 110.529 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -164.98 -98.4 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.151 -1.02 . . . . 0.0 110.991 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.99 143.09 7.64 Favored Glycine 0 N--CA 1.493 2.464 0 C-N-CA 119.364 -1.398 . . . . 0.0 111.159 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.854 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.47 -42.23 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.231 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.226 -179.914 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.471 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.33 -65.98 0.6 Allowed 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.066 -1.054 . . . . 0.0 110.594 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 50.3 m -36.15 -45.82 0.47 Allowed 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 112.905 0.706 . . . . 0.0 112.905 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 22.6 pt -72.87 -36.68 52.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 C-N-CA 118.962 -1.095 . . . . 0.0 112.612 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.471 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.1 OUTLIER -52.51 -72.31 0.05 Allowed 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.814 -1.154 . . . . 0.0 111.145 -179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.418 ' NE ' ' CD1' ' R' ' 1' ' ' TRP . 0.0 OUTLIER -54.89 -14.9 1.62 Allowed 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 118.886 -1.126 . . . . 0.0 110.486 179.971 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.18 -59.48 7.86 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.342 -1.408 . . . . 0.0 110.229 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . 0.471 ' C ' ' H ' ' R' ' 88' ' ' SER . 100.0 p -88.0 -43.88 11.41 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.315 -0.954 . . . . 0.0 110.781 -179.955 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -68.64 8.65 0.46 Allowed 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.49 -0.884 . . . . 0.0 110.847 179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . 0.526 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.4 OUTLIER -68.92 -23.59 64.19 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.622 -179.834 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . 0.465 ' C ' ' O ' ' R' ' 88' ' ' SER . 10.2 mt -30.87 -34.9 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.857 0 O-C-N 123.69 0.619 . . . . 0.0 112.022 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . 0.526 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -110.14 -64.82 1.22 Allowed 'General case' 0 N--CA 1.489 1.507 0 CA-C-O 121.63 0.728 . . . . 0.0 111.413 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . 0.413 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.23 -37.86 0.06 Allowed 'General case' 0 C--N 1.294 -1.846 0 CA-C-N 114.025 -1.443 . . . . 0.0 112.76 -179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.428 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -56.58 159.21 7.04 Favored Pre-proline 0 N--CA 1.49 1.561 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.859 -179.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . 0.428 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 3.1 Cg_exo -59.62 169.55 4.19 Favored 'Trans proline' 0 C--N 1.325 -0.672 0 C-N-CA 121.257 1.304 . . . . 0.0 111.333 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 63.9 t -108.98 -21.43 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 119.802 -0.759 . . . . 0.0 111.182 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -94.11 -1.15 54.74 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 119.363 -0.935 . . . . 0.0 111.12 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.55 -31.03 12.53 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.879 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -37.65 71.29 Favored 'General case' 0 C--N 1.307 -1.261 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.442 -179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 25.2 mt-30 -66.38 -10.32 42.21 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.501 -0.88 . . . . 0.0 110.311 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.71 ' CE3' HG21 ' R' ' 103' ' ' VAL . 5.9 t90 -97.87 -62.24 1.27 Allowed 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.841 -0.743 . . . . 0.0 111.553 -179.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.516 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -39.43 -38.09 0.53 Allowed 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 114.046 1.128 . . . . 0.0 114.046 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.516 ' C ' ' O ' ' R' ' 100' ' ' LEU . 1.1 mm-40 -41.57 -38.61 1.38 Allowed 'General case' 0 C--N 1.295 -1.791 0 C-N-CA 117.928 -1.509 . . . . 0.0 107.806 179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -90.6 -27.2 19.26 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.484 -1.689 . . . . 0.0 112.868 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.71 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.6 t -87.97 -9.19 10.97 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 117.26 -1.776 . . . . 0.0 111.023 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 17.4 tp -98.61 -52.97 3.45 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.018 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . 0.48 ' N ' HD22 ' R' ' 105' ' ' LEU . 4.5 mm? -70.29 -68.51 0.42 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.74 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 13.9 tptt -48.77 -17.97 0.23 Allowed 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.643 -0.823 . . . . 0.0 111.875 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 34.4 m . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 116.339 -1.791 . . . . 0.0 110.81 -179.918 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 19.3 mt-30 . . . . . 0 N--CA 1.485 1.287 0 CA-C-O 120.858 0.361 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . 0.455 ' C ' ' H ' ' S' ' 7' ' ' TYR . 2.4 m -66.09 154.55 89.56 Favored Pre-proline 0 N--CA 1.487 1.411 0 C-N-CA 119.324 -0.95 . . . . 0.0 110.148 179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 3.6 Cg_exo -56.22 -4.49 0.74 Allowed 'Trans proline' 0 C--N 1.322 -0.855 0 C-N-CA 120.923 1.082 . . . . 0.0 111.534 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . 0.455 ' H ' ' C ' ' S' ' 5' ' ' SER . 4.6 m-85 -74.28 -60.96 2.03 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.297 -0.961 . . . . 0.0 110.956 179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -80.62 21.33 0.66 Allowed 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.892 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.85 -71.59 0.16 Allowed 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 119.186 -1.006 . . . . 0.0 110.876 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -58.49 153.25 16.34 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.765 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 38.8 mtp -128.41 69.97 1.37 Allowed 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 120.06 -0.656 . . . . 0.0 110.947 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.29 156.33 19.25 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.763 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 10.0 pt-20 -164.94 155.1 13.7 Favored 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.894 179.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -58.15 171.59 0.53 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.036 -179.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . 0.442 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER -89.53 -11.8 41.78 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.157 -179.924 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -55.14 -7.33 0.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 CA-C-N 115.69 -0.686 . . . . 0.0 110.384 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.442 ' H ' ' C ' ' S' ' 15' ' ' ARG . 0.0 OUTLIER -76.89 -86.24 0.05 Allowed 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.775 -179.949 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -43.24 -34.77 1.24 Allowed 'General case' 0 N--CA 1.495 1.777 0 CA-C-O 122.279 1.038 . . . . 0.0 109.176 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 27.2 t-105 -51.97 -57.55 9.13 Favored 'General case' 0 C--N 1.294 -1.83 0 CA-C-N 113.815 -1.538 . . . . 0.0 109.075 179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.4 mt -59.37 -30.71 68.61 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.105 -1.407 . . . . 0.0 111.493 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.557 ' O ' ' N ' ' S' ' 24' ' ' ASP . 9.0 mmt85 -56.24 -65.23 0.64 Allowed 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 117.902 -1.519 . . . . 0.0 109.519 179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.482 ' CD1' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -36.62 -39.49 0.21 Allowed 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 119.143 -1.023 . . . . 0.0 110.076 179.569 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 23.0 t -74.2 -36.69 44.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.136 179.843 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.557 ' N ' ' O ' ' S' ' 21' ' ' ARG . 54.7 t0 -58.83 -64.01 1.09 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.577 179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.66 -56.03 8.13 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 118.956 -1.098 . . . . 0.0 109.561 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.737 ' C ' HD13 ' S' ' 26' ' ' LEU . 2.3 tm? -38.68 -46.4 1.22 Allowed 'General case' 0 N--CA 1.492 1.639 0 CA-C-N 115.434 -0.803 . . . . 0.0 111.244 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . 0.428 ' NZ ' ' CE2' ' R' ' 30' ' ' TYR . 26.0 mtmm -66.16 -77.37 0.07 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.662 -0.815 . . . . 0.0 112.523 -179.834 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 44.4 m-20 -39.13 -47.76 1.62 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 112.988 0.736 . . . . 0.0 112.988 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . 0.525 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -69.91 -27.37 64.73 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.641 -0.824 . . . . 0.0 113.132 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -62.12 -41.31 98.1 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 118.582 -1.247 . . . . 0.0 111.089 -179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.9 tt0 -50.13 -30.97 12.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 119.114 -1.034 . . . . 0.0 110.791 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.448 ' O ' ' OD1' ' S' ' 33' ' ' ASP . 87.7 m-20 -101.77 -83.5 0.46 Allowed 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.482 -0.887 . . . . 0.0 111.402 179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.463 ' C ' HD22 ' S' ' 34' ' ' LEU . 0.3 OUTLIER 172.74 24.47 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.787 -179.996 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . 0.761 HD22 ' N ' ' S' ' 34' ' ' LEU . 2.1 mm? -98.07 -13.34 21.07 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 119.459 -0.896 . . . . 0.0 109.74 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 11.1 p-80 -51.15 -18.0 0.78 Allowed 'General case' 0 C--N 1.292 -1.901 0 C-N-CA 119.249 -0.98 . . . . 0.0 111.055 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.476 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.1 mt -78.51 -65.86 0.31 Allowed Pre-proline 0 N--CA 1.482 1.14 0 C-N-CA 118.592 -1.243 . . . . 0.0 110.278 179.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.476 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 6.1 Cg_exo -49.22 -33.44 28.02 Favored 'Trans proline' 0 C--N 1.318 -1.079 0 N-CA-C 110.161 -0.746 . . . . 0.0 110.161 179.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.21 -38.59 75.3 Favored 'General case' 0 N--CA 1.495 1.819 0 C-N-CA 119.48 -0.888 . . . . 0.0 110.05 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.456 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.5 OUTLIER -57.65 -22.55 46.36 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 115.226 -0.897 . . . . 0.0 109.079 179.655 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -95.58 15.69 19.2 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 119.298 -0.961 . . . . 0.0 109.696 179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.1 tt -115.52 -63.85 1.4 Allowed 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 -179.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.24 -21.82 61.33 Favored 'General case' 0 N--CA 1.501 2.117 0 C-N-CA 118.704 -1.198 . . . . 0.0 112.532 -179.731 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . 0.472 HD12 ' H ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -152.84 160.2 43.07 Favored 'General case' 0 N--CA 1.503 2.21 0 C-N-CA 119.872 -0.731 . . . . 0.0 109.854 179.777 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.6 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER 178.93 -41.65 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 118.306 -1.357 . . . . 0.0 114.32 -179.828 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.6 ' HD2' ' H ' ' S' ' 44' ' ' THR . 10.6 Cg_endo -75.88 -98.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.544 1.009 0 C-N-CA 121.255 1.303 . . . . 0.0 113.064 -179.625 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 8.4 t70 -48.59 -24.88 1.48 Allowed 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.875 -1.13 . . . . 0.0 110.351 -179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -59.31 -69.17 0.21 Allowed 'General case' 0 C--N 1.299 -1.599 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.778 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -48.72 -29.45 4.48 Favored 'General case' 0 C--N 1.299 -1.614 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.7 -179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -82.56 -67.88 0.75 Allowed 'General case' 0 C--N 1.302 -1.467 0 C-N-CA 118.759 -1.176 . . . . 0.0 112.203 -179.834 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.11 -51.09 71.1 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.088 -1.045 . . . . 0.0 112.054 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . 0.481 HD12 ' O ' ' R' ' 42' ' ' MET . 3.9 tp -39.47 -58.32 1.28 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 120.04 -0.664 . . . . 0.0 111.214 -179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . 0.4 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -53.98 -44.0 72.2 Favored Glycine 0 N--CA 1.492 2.383 0 C-N-CA 119.28 -1.438 . . . . 0.0 109.912 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -47.6 -75.87 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.465 0 C-N-CA 119.491 -0.884 . . . . 0.0 112.64 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.66 ' HE ' ' CA ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -48.74 -24.87 1.55 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.437 -179.892 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 47.6 t -79.06 -27.61 13.45 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.578 0 C-N-CA 118.359 -1.336 . . . . 0.0 110.342 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -81.79 -37.91 26.41 Favored 'General case' 0 C--N 1.304 -1.408 0 C-N-CA 118.662 -1.215 . . . . 0.0 111.307 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 0.804 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -73.61 -35.07 43.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 117.326 -1.75 . . . . 0.0 107.931 -179.969 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . 0.804 ' N ' HD13 ' S' ' 57' ' ' ILE . 11.8 t -60.56 -56.02 20.5 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 C-N-CA 117.925 -1.51 . . . . 0.0 109.292 179.471 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -55.83 -27.06 49.54 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.462 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -71.79 -52.19 18.81 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.017 -1.073 . . . . 0.0 112.821 -179.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . 0.418 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -60.74 -24.69 65.91 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 117.738 -1.585 . . . . 0.0 110.269 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . 0.663 ' O ' ' N ' ' S' ' 64' ' ' GLY . 5.3 tp -85.38 25.48 1.02 Allowed 'General case' 0 C--N 1.306 -1.308 0 C-N-CA 119.402 -0.919 . . . . 0.0 109.539 179.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . 0.43 ' C ' ' O ' ' S' ' 62' ' ' LEU . 6.6 mtp-105 14.7 40.72 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.1 0 O-C-N 124.696 1.248 . . . . 0.0 114.315 -179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.663 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -90.22 -14.23 59.19 Favored Glycine 0 N--CA 1.489 2.224 0 C-N-CA 119.494 -1.336 . . . . 0.0 109.84 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 59.2 mm-40 -135.4 -66.76 0.56 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.016 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -111.94 -175.09 2.61 Favored 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.64 -179.9 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . 0.521 ' O ' ' N ' ' S' ' 69' ' ' ARG . 3.1 p -163.05 -78.67 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.443 -0.903 . . . . 0.0 109.468 179.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.52 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.9 OUTLIER -30.26 -36.23 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.25 0 CA-C-N 115.401 -0.818 . . . . 0.0 111.784 179.681 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . 0.7 HH21 HD22 ' S' ' 73' ' ' ASN . 7.9 tpt180 -73.05 31.4 0.07 Allowed 'General case' 0 C--N 1.308 -1.222 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.291 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.52 ' H ' ' C ' ' S' ' 68' ' ' GLN . 3.0 mt-10 -91.7 -51.3 5.31 Favored 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.824 -0.75 . . . . 0.0 110.611 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 11.8 mt -47.39 145.06 2.61 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.146 -1.022 . . . . 0.0 110.26 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 29.1 tttm -60.85 124.56 20.82 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.863 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . 0.7 HD22 HH21 ' S' ' 69' ' ' ARG . 17.5 m-20 -104.19 -103.06 0.31 Allowed 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.539 0.685 . . . . 0.0 110.696 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -147.85 -40.67 0.17 Allowed 'General case' 0 C--N 1.28 -2.434 0 CA-C-N 114.719 -1.128 . . . . 0.0 110.816 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.2 tp -130.17 18.97 5.43 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 120.1 -0.64 . . . . 0.0 110.484 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -73.58 -57.89 4.8 Favored Glycine 0 N--CA 1.491 2.353 0 C-N-CA 119.577 -1.297 . . . . 0.0 110.89 -179.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -152.44 -67.31 0.16 Allowed 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.199 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . 0.469 ' O ' ' OG1' ' S' ' 81' ' ' THR . . . 152.74 161.64 10.41 Favored Glycine 0 N--CA 1.491 2.333 0 C-N-CA 119.193 -1.48 . . . . 0.0 110.945 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.873 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -65.57 -40.68 88.81 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.337 0 C-N-CA 120.024 -0.671 . . . . 0.0 111.055 179.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.418 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -67.29 -37.11 82.87 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.274 -0.971 . . . . 0.0 111.617 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' S' ' 78' ' ' GLY . 77.7 p -60.2 -56.42 21.84 Favored 'General case' 0 C--N 1.3 -1.575 0 C-N-CA 119.634 -0.826 . . . . 0.0 112.337 -179.843 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . 0.421 HD13 HG21 ' S' ' 82' ' ' ILE . 18.5 pt -57.25 -0.63 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.515 -179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.468 ' C ' ' H ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -98.49 -69.98 0.74 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.257 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . 0.54 ' NH2' ' N ' ' R' ' 109' ' ' TRP . 0.1 OUTLIER -58.68 -3.84 0.36 Allowed 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 118.859 -1.136 . . . . 0.0 110.922 -179.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . 0.468 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -95.69 -22.59 20.74 Favored Glycine 0 N--CA 1.488 2.123 0 C-N-CA 119.341 -1.409 . . . . 0.0 110.292 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 65.2 p -87.32 -12.83 45.3 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.393 -0.923 . . . . 0.0 111.279 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . 0.509 ' O ' ' N ' ' S' ' 89' ' ' LEU . 9.2 m120 -102.87 3.72 36.9 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 119.688 -0.805 . . . . 0.0 110.874 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -40.32 -24.28 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 119.852 -0.739 . . . . 0.0 111.22 179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . 0.509 ' N ' ' O ' ' S' ' 87' ' ' ASN . 7.3 mt -55.84 -49.58 72.93 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.641 -0.824 . . . . 0.0 110.922 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -103.92 -34.96 8.31 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.848 -0.741 . . . . 0.0 111.092 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.0 -71.42 0.07 Allowed 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.88 -1.055 . . . . 0.0 112.2 -179.675 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . 0.434 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -70.7 159.22 85.9 Favored Pre-proline 0 N--CA 1.488 1.436 0 C-N-CA 119.123 -1.031 . . . . 0.0 111.351 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . 0.434 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 5.8 Cg_exo -57.12 176.79 0.22 Allowed 'Trans proline' 0 C--N 1.323 -0.791 0 C-N-CA 121.668 1.579 . . . . 0.0 112.038 -179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . 0.478 ' O ' HG12 ' S' ' 94' ' ' VAL . 65.7 t -96.08 -9.64 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.43 0 C-N-CA 119.608 -0.837 . . . . 0.0 110.628 179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -77.12 -22.29 52.88 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.584 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -59.48 -37.9 79.45 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.859 -0.736 . . . . 0.0 110.847 179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -58.35 -47.9 82.3 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.747 -0.781 . . . . 0.0 111.439 -179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 8.6 mt-30 -80.2 -8.15 59.3 Favored 'General case' 0 C--N 1.303 -1.435 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.908 -179.958 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.594 ' CH2' HG21 ' S' ' 103' ' ' VAL . 6.2 t90 -101.37 -65.63 0.96 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 118.925 -1.11 . . . . 0.0 112.398 -179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.554 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -59.15 -39.9 83.87 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -179.67 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.554 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.0 OUTLIER -40.98 -29.91 0.12 Allowed 'General case' 0 C--N 1.296 -1.748 0 C-N-CA 117.563 -1.655 . . . . 0.0 106.95 179.738 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . 0.545 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 mt-10 -91.88 -24.6 19.28 Favored 'General case' 0 C--N 1.306 -1.289 0 CA-C-N 112.9 -1.955 . . . . 0.0 112.348 179.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.594 HG21 ' CH2' ' S' ' 99' ' ' TRP . 18.9 t -87.96 -21.19 7.15 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.495 0 C-N-CA 116.536 -2.066 . . . . 0.0 109.833 -179.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 1.6 tp -86.94 -57.78 2.84 Favored 'General case' 0 C--N 1.308 -1.207 0 C-N-CA 119.944 -0.702 . . . . 0.0 110.949 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 9.6 mt -76.35 -75.09 0.2 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 118.728 -1.189 . . . . 0.0 110.343 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 16.2 tttt -76.63 47.39 0.49 Allowed 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 115.455 -0.793 . . . . 0.0 110.381 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.305 -1.352 0 CA-C-O 116.324 -1.798 . . . . 0.0 110.921 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.418 ' CD1' ' NE ' ' R' ' 84' ' ' ARG . 0.5 OUTLIER . . . . . 0 N--CA 1.485 1.281 0 CA-C-O 116.36 -1.781 . . . . 0.0 110.413 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.54 ' N ' ' NH2' ' S' ' 84' ' ' ARG . 21.6 p-90 . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 116.411 -1.757 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.896 0.379 . . . . 0.0 110.119 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 51.5 m 45.41 67.83 3.87 Favored Pre-proline 0 C--N 1.304 -1.407 0 C-N-CA 119.493 -0.883 . . . . 0.0 111.657 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 3.5 Cg_exo -63.82 109.89 1.18 Allowed 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 121.606 1.537 . . . . 0.0 111.092 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -145.39 7.36 1.14 Allowed 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.237 -0.985 . . . . 0.0 111.208 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 3.2 m -80.16 79.46 6.71 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.912 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -96.72 -112.13 0.14 Allowed 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 119.556 -0.858 . . . . 0.0 110.676 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . 45.61 -164.0 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.32 -0.952 . . . . 0.0 110.839 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . 0.526 ' N ' ' SD ' ' R' ' 11' ' ' MET . 0.0 OUTLIER -69.4 145.36 52.92 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 119.434 -0.906 . . . . 0.0 110.684 -179.917 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -140.69 -137.58 0.12 Allowed 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.637 -0.825 . . . . 0.0 111.044 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 61.0 mt-10 -97.94 56.16 1.22 Allowed 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.644 -0.822 . . . . 0.0 111.121 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 9.8 mm100 -115.58 -140.75 0.37 Allowed 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 120.102 -0.639 . . . . 0.0 110.579 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . 0.588 ' O ' ' N ' ' R' ' 17' ' ' GLN . 23.5 ttt180 -160.55 -93.66 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 118.945 -1.102 . . . . 0.0 111.145 -179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 4.1 m80 -38.74 83.91 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 112.204 0.446 . . . . 0.0 112.204 179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.588 ' N ' ' O ' ' R' ' 15' ' ' ARG . 1.5 mt-30 -123.15 -91.42 0.55 Allowed 'General case' 0 N--CA 1.493 1.693 0 C-N-CA 120.301 -0.56 . . . . 0.0 109.795 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -57.24 -24.1 52.47 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . 0.4 ' N ' ' C ' ' R' ' 17' ' ' GLN . 9.4 t-105 -59.17 -46.99 86.95 Favored 'General case' 0 C--N 1.293 -1.865 0 CA-C-N 112.559 -2.11 . . . . 0.0 106.214 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.0 tp -56.34 -47.22 79.25 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 112.562 -2.108 . . . . 0.0 110.411 179.743 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.0 OUTLIER -47.99 -70.0 0.11 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 119.05 -1.06 . . . . 0.0 110.416 -179.99 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.5 OUTLIER -27.38 -51.14 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.413 -0.915 . . . . 0.0 111.329 179.675 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . 0.423 HG23 ' H ' ' R' ' 23' ' ' VAL . 1.2 t -68.73 -46.29 79.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 C-N-CA 119.326 -0.949 . . . . 0.0 110.991 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.504 ' N ' ' O ' ' R' ' 21' ' ' ARG . 64.0 t0 -39.03 -45.37 1.22 Allowed 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 119.896 -0.722 . . . . 0.0 111.709 -179.907 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.409 ' HG ' ' H ' ' R' ' 25' ' ' LEU . 1.4 mt -75.88 -34.91 60.0 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.06 -1.056 . . . . 0.0 109.986 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . 0.423 ' N ' ' O ' ' R' ' 23' ' ' VAL . 1.0 OUTLIER -55.57 -31.81 62.49 Favored 'General case' 0 C--N 1.3 -1.566 0 C-N-CA 119.581 -0.848 . . . . 0.0 112.048 -179.978 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 2.7 mttp -79.93 -39.53 30.1 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 118.931 -1.108 . . . . 0.0 112.244 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -85.86 -18.18 33.53 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.201 -0.999 . . . . 0.0 111.898 -179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.423 ' HB1' ' N ' ' R' ' 35' ' ' HIS . . . -82.36 -58.84 2.76 Favored 'General case' 0 C--N 1.3 -1.564 0 C-N-CA 118.968 -1.093 . . . . 0.0 111.766 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -45.47 -32.15 2.06 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.164 -1.014 . . . . 0.0 110.596 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' R' ' 31' ' ' GLN . 0.3 OUTLIER -46.79 -40.75 14.22 Favored 'General case' 0 C--N 1.304 -1.403 0 C-N-CA 119.099 -1.04 . . . . 0.0 109.667 -179.988 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . 0.4 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 63.6 t30 -106.51 -73.53 0.68 Allowed 'General case' 0 N--CA 1.488 1.44 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.561 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . 0.4 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.5 OUTLIER 170.6 18.17 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.076 0 C-N-CA 119.134 -1.026 . . . . 0.0 112.63 -179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . 0.502 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.9 OUTLIER -88.8 -13.44 39.41 Favored 'General case' 0 N--CA 1.494 1.747 0 C-N-CA 119.05 -1.06 . . . . 0.0 109.19 179.942 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . 0.542 ' O ' HD13 ' R' ' 39' ' ' LEU . 46.5 p-80 -51.55 -27.52 11.11 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 114.385 -1.279 . . . . 0.0 113.024 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.456 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.9 mt -70.17 -62.52 2.21 Favored Pre-proline 0 N--CA 1.486 1.365 0 C-N-CA 117.872 -1.531 . . . . 0.0 110.815 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.456 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.1 Cg_exo -51.63 -25.21 19.34 Favored 'Trans proline' 0 C--N 1.318 -1.04 0 C-N-CA 120.743 0.962 . . . . 0.0 110.667 179.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 24.5 mt -81.08 -38.83 26.68 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.096 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.542 HD13 ' O ' ' R' ' 35' ' ' HIS . 0.5 OUTLIER -59.94 -21.09 60.7 Favored 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 114.571 -1.195 . . . . 0.0 110.163 179.87 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . 0.546 ' O ' ' ND2' ' R' ' 40' ' ' ASN . 0.1 OUTLIER -103.69 11.68 35.68 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.955 -0.698 . . . . 0.0 109.374 179.645 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 39.4 tp -107.0 -69.81 0.82 Allowed 'General case' 0 N--CA 1.49 1.542 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.635 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . 0.462 ' C ' HD12 ' R' ' 43' ' ' LEU . 1.1 mtt -77.36 7.74 4.97 Favored 'General case' 0 N--CA 1.494 1.737 0 C-N-CA 118.121 -1.432 . . . . 0.0 112.81 -179.615 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . 0.462 HD12 ' C ' ' R' ' 42' ' ' MET . 9.0 mp -116.5 -176.2 2.91 Favored 'General case' 0 N--CA 1.503 2.185 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 179.63 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.513 ' HB ' ' CD ' ' R' ' 45' ' ' PRO 0.275 0.0 OUTLIER -126.2 -153.33 0.02 OUTLIER Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 118.543 -1.263 . . . . 0.0 109.62 179.996 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.513 ' CD ' ' HB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -97.99 -38.27 0.02 OUTLIER 'Trans proline' 0 N--CA 1.478 0.612 0 CA-C-N 119.95 1.018 . . . . 0.0 111.351 179.356 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . 0.439 ' OD1' ' OE1' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -56.42 -18.96 12.84 Favored 'General case' 0 C--N 1.307 -1.251 0 C-N-CA 118.965 -1.094 . . . . 0.0 109.092 -179.912 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.439 ' OE1' ' OD1' ' R' ' 46' ' ' ASP . 3.6 mp0 -60.67 -71.33 0.14 Allowed 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.327 -0.949 . . . . 0.0 109.727 179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -43.67 -44.45 6.44 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.674 -0.81 . . . . 0.0 109.867 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . 0.466 ' O ' ' OG1' ' R' ' 53' ' ' THR . 8.0 mm-40 -56.47 -77.32 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.06 -1.056 . . . . 0.0 111.58 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.452 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -66.73 -60.07 3.01 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.286 -179.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . 0.542 ' C ' HD23 ' R' ' 51' ' ' LEU . 4.5 tt -34.02 -58.53 0.45 Allowed 'General case' 0 N--CA 1.498 1.943 0 C-N-CA 120.351 -0.539 . . . . 0.0 111.122 -179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.2 -48.09 59.87 Favored Glycine 0 N--CA 1.488 2.11 0 C-N-CA 119.042 -1.551 . . . . 0.0 109.44 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.506 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.3 OUTLIER -48.46 -79.15 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.895 -0.722 . . . . 0.0 112.453 179.904 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.618 ' H ' ' CD ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -39.88 -24.44 0.02 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.826 -179.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . 0.506 ' N ' ' O ' ' R' ' 53' ' ' THR . 1.5 t -88.43 -30.18 5.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.63 0 C-N-CA 118.488 -1.285 . . . . 0.0 111.236 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -76.58 -37.41 56.56 Favored 'General case' 0 C--N 1.301 -1.53 0 C-N-CA 119.146 -1.022 . . . . 0.0 110.163 179.992 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 0.476 HG22 ' O ' ' R' ' 53' ' ' THR . 0.1 OUTLIER -76.79 -52.42 17.04 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.177 0 C-N-CA 118.834 -1.147 . . . . 0.0 109.651 -179.969 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 0.503 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.5 p -51.99 -44.42 38.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 C-N-CA 117.692 -1.603 . . . . 0.0 110.742 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.503 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 1.5 tm-20 -66.73 -29.56 69.57 Favored 'General case' 0 C--N 1.308 -1.238 0 C-N-CA 119.625 -0.83 . . . . 0.0 111.251 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.52 -48.81 20.88 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.985 -179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 97.8 mt -70.69 -22.69 62.44 Favored 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.681 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . 0.415 ' C ' ' H ' ' R' ' 64' ' ' GLY . 6.5 tp -61.58 -36.84 81.8 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 118.824 -1.15 . . . . 0.0 110.297 179.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . 0.651 ' O ' ' N ' ' R' ' 65' ' ' GLU . 17.1 ttm180 -80.19 16.13 1.35 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.311 -0.956 . . . . 0.0 109.999 -179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . 0.415 ' H ' ' C ' ' R' ' 62' ' ' LEU . . . 17.58 37.18 0.01 OUTLIER Glycine 0 N--CA 1.504 3.215 0 O-C-N 124.697 1.248 . . . . 0.0 114.37 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.651 ' N ' ' O ' ' R' ' 63' ' ' ARG . 0.3 OUTLIER -54.52 -29.77 51.59 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 118.793 -1.163 . . . . 0.0 109.767 179.859 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -151.77 157.78 42.45 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 115.489 -0.778 . . . . 0.0 110.251 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 6.2 t -169.29 70.67 0.07 Allowed 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 119.183 -1.007 . . . . 0.0 109.987 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . . . . . . . . . 1.1 pt20 -131.13 -97.44 0.33 Allowed 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.718 -0.793 . . . . 0.0 110.922 -179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.13 30.16 3.22 Favored 'General case' 0 C--N 1.306 -1.285 0 C-N-CA 120.194 -0.602 . . . . 0.0 111.042 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . 0.444 ' O ' ' OE1' ' R' ' 74' ' ' GLU . 43.7 mt-10 -130.09 33.29 4.39 Favored 'General case' 0 C--N 1.295 -1.768 0 CA-C-N 114.963 -1.017 . . . . 0.0 110.794 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 23.1 mt -103.66 19.48 19.77 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 119.448 -0.901 . . . . 0.0 112.276 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 4.6 mttt -157.33 -68.5 0.1 Allowed 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 117.948 -1.501 . . . . 0.0 113.048 -179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -77.38 0.02 23.98 Favored 'General case' 0 C--N 1.308 -1.197 0 C-N-CA 118.661 -1.215 . . . . 0.0 112.298 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . 0.444 ' OE1' ' O ' ' R' ' 70' ' ' GLU . 1.2 pt-20 -60.19 -28.68 68.16 Favored 'General case' 0 C--N 1.278 -2.511 0 C-N-CA 118.201 -1.4 . . . . 0.0 107.471 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.623 ' O ' ' N ' ' R' ' 77' ' ' ALA . 0.8 OUTLIER -136.04 15.08 3.3 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 114.002 -1.454 . . . . 0.0 109.593 179.766 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . 0.482 ' C ' ' O ' ' R' ' 75' ' ' LEU . . . 21.34 38.95 0.01 OUTLIER Glycine 0 N--CA 1.505 3.298 0 O-C-N 124.266 0.979 . . . . 0.0 112.25 -179.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . 0.623 ' N ' ' O ' ' R' ' 75' ' ' LEU . . . -75.39 -78.86 0.1 Allowed 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.938 -0.705 . . . . 0.0 111.384 -179.848 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . 0.478 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 171.19 157.8 13.86 Favored Glycine 0 N--CA 1.488 2.146 0 N-CA-C 109.771 -1.332 . . . . 0.0 109.771 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.76 ' N ' HD13 ' R' ' 79' ' ' ILE . 0.7 OUTLIER -73.56 28.94 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 C-N-CA 119.754 -0.778 . . . . 0.0 112.51 -179.897 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.478 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.99 -37.4 5.61 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . 0.505 ' HA ' ' HE1' ' R' ' 1' ' ' TRP . 17.4 p -95.87 -56.44 2.66 Favored 'General case' 0 C--N 1.305 -1.336 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.182 179.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . 0.409 ' H ' HG23 ' R' ' 82' ' ' ILE . 1.5 pp -47.43 -13.99 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.302 -1.493 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.393 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.487 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -66.25 -80.43 0.04 OUTLIER 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.642 -179.923 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.801 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -54.18 -20.5 6.92 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.808 179.982 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -56.99 -46.7 91.05 Favored Glycine 0 N--CA 1.489 2.194 0 CA-C-N 115.07 -0.968 . . . . 0.0 112.101 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -113.93 -27.95 7.55 Favored 'General case' 0 N--CA 1.496 1.872 0 C-N-CA 119.659 -0.817 . . . . 0.0 112.187 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . 0.607 ' C ' ' H ' ' R' ' 89' ' ' LEU . 1.9 t-20 -88.3 -56.27 3.39 Favored 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.793 -1.163 . . . . 0.0 111.446 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . 0.597 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.8 -2.91 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.605 -1.238 . . . . 0.0 110.459 -179.966 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . 0.749 ' O ' ' N ' ' R' ' 91' ' ' ALA . 1.2 mm? 28.79 32.44 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.843 0 O-C-N 124.805 1.316 . . . . 0.0 110.929 -179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . 0.597 ' N ' ' O ' ' R' ' 88' ' ' SER . 6.9 tptt 20.19 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.417 0 CA-C-N 114.163 -1.381 . . . . 0.0 113.927 -179.857 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . 0.749 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -88.13 -3.09 58.93 Favored 'General case' 0 C--N 1.287 -2.132 0 C-N-CA 117.282 -1.767 . . . . 0.0 109.749 -179.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.715 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -70.89 171.13 8.99 Favored Pre-proline 0 N--CA 1.487 1.416 0 CA-C-N 114.906 -1.043 . . . . 0.0 110.83 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . 0.715 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 6.1 Cg_exo -59.33 120.35 8.15 Favored 'Trans proline' 0 C--N 1.324 -0.758 0 C-N-CA 121.112 1.208 . . . . 0.0 111.618 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 43.1 t -60.99 -37.61 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 C-N-CA 118.966 -1.094 . . . . 0.0 109.979 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -60.4 -10.05 4.36 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.709 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . 0.53 HD23 ' O ' ' R' ' 96' ' ' LEU . 3.2 tt -72.3 -55.03 7.82 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 119.678 -0.809 . . . . 0.0 110.074 -179.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . 0.488 ' O ' ' CG ' ' R' ' 101' ' ' GLU . 0.0 OUTLIER -63.13 -12.06 24.73 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 119.585 -0.846 . . . . 0.0 111.088 179.959 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -80.96 -34.2 33.32 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.05 -1.06 . . . . 0.0 111.049 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.638 ' HE1' ' ND2' ' S' ' 32' ' ' ASN . 46.2 t90 -80.52 -58.84 2.93 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 121.952 0.882 . . . . 0.0 111.129 -179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.587 ' C ' ' N ' ' R' ' 102' ' ' GLU . 0.3 OUTLIER -70.43 -15.2 62.8 Favored 'General case' 0 C--N 1.291 -1.977 0 C-N-CA 117.416 -1.714 . . . . 0.0 115.26 -179.884 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.488 ' CG ' ' O ' ' R' ' 97' ' ' ARG . 3.0 mm-40 -57.94 -18.71 25.1 Favored 'General case' 0 C--N 1.289 -2.04 0 N-CA-C 103.541 -2.763 . . . . 0.0 103.541 179.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.587 ' N ' ' C ' ' R' ' 100' ' ' LEU . 5.0 mt-10 -99.13 -35.63 9.94 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-N 112.378 -2.192 . . . . 0.0 114.195 -179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.519 HG21 ' CH2' ' R' ' 99' ' ' TRP . 5.1 t -73.55 -14.18 16.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 C-N-CA 113.958 -3.097 . . . . 0.0 108.761 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . 0.548 HD22 ' NH2' ' R' ' 63' ' ' ARG . 2.1 mt -88.65 -58.6 2.49 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.399 179.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 15.8 mt -62.5 -77.87 0.05 OUTLIER 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.887 -1.125 . . . . 0.0 110.38 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.8 tptm -43.58 -81.22 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 115.549 -0.75 . . . . 0.0 110.718 179.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.489 1.515 0 CA-C-O 116.27 -1.824 . . . . 0.0 110.67 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 . . . . . 0 N--CA 1.487 1.414 0 CA-C-O 120.963 0.411 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 70.2 m 45.29 67.61 4.05 Favored Pre-proline 0 N--CA 1.488 1.437 0 C-N-CA 119.683 -0.807 . . . . 0.0 111.431 -179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -68.7 -52.8 0.39 Allowed 'Trans proline' 0 C--N 1.313 -1.317 0 C-N-CA 121.897 1.732 . . . . 0.0 111.794 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.8 OUTLIER -80.9 52.1 1.67 Allowed 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.302 -0.959 . . . . 0.0 111.596 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 60.3 p -80.88 3.38 22.9 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 119.183 -1.007 . . . . 0.0 111.148 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.13 -44.16 92.02 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.756 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . 50.28 95.78 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.696 -0.802 . . . . 0.0 111.435 -179.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 3.6 mtm -93.72 -57.08 2.67 Favored 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.466 -0.894 . . . . 0.0 110.436 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . 0.431 ' O ' ' O ' ' S' ' 13' ' ' GLU . . . -165.94 -33.33 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.601 -0.839 . . . . 0.0 110.727 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . 0.431 ' O ' ' O ' ' S' ' 12' ' ' ALA . 7.1 mt-10 52.09 169.46 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.946 -0.702 . . . . 0.0 111.523 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -127.57 107.14 9.67 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 115.833 -0.621 . . . . 0.0 110.291 179.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.7 mtt180 -97.76 117.7 32.64 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.633 -0.827 . . . . 0.0 111.446 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -128.49 15.72 6.55 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.771 -0.649 . . . . 0.0 110.174 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.473 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.5 mp0 -88.58 -90.07 0.13 Allowed 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.906 -0.717 . . . . 0.0 110.461 179.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.552 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -43.45 -26.54 0.21 Allowed 'General case' 0 N--CA 1.497 1.917 0 CA-C-O 122.443 1.116 . . . . 0.0 109.198 179.916 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . 0.473 ' N ' ' C ' ' S' ' 17' ' ' GLN . 53.9 t-105 -57.11 -60.96 2.82 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 113.114 -1.857 . . . . 0.0 109.724 179.805 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 4.9 tp -43.49 -35.35 1.61 Allowed 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.851 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.552 ' O ' ' N ' ' S' ' 23' ' ' VAL . 29.7 mtt180 -64.01 -71.95 0.16 Allowed 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.181 -1.008 . . . . 0.0 109.945 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.513 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -25.89 -40.03 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.885 0 O-C-N 123.461 0.476 . . . . 0.0 111.791 179.604 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.552 ' N ' ' O ' ' S' ' 21' ' ' ARG . 89.4 t -73.65 -71.65 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 C-N-CA 119.959 -0.696 . . . . 0.0 111.718 179.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.417 ' C ' ' O ' ' S' ' 23' ' ' VAL . 33.1 t70 -28.28 -35.83 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 113.625 0.972 . . . . 0.0 113.625 -179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.589 HD12 ' CE ' ' S' ' 42' ' ' MET . 1.5 mt -87.3 -44.07 11.69 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.015 -1.074 . . . . 0.0 111.069 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.427 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -57.15 -63.13 1.32 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.156 -1.017 . . . . 0.0 111.74 -179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -50.55 -49.17 56.7 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.06 0.763 . . . . 0.0 113.06 -179.705 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 17.2 m-80 -67.46 -35.61 79.53 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.737 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -62.47 -27.91 69.46 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 118.896 -1.121 . . . . 0.0 111.771 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -51.19 -53.57 33.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 118.694 -1.202 . . . . 0.0 110.519 -179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -57.12 -14.82 4.35 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.126 -1.03 . . . . 0.0 110.404 179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.638 ' ND2' ' HE1' ' R' ' 99' ' ' TRP . 0.6 OUTLIER -105.43 -17.16 14.52 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.544 179.991 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.485 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.7 t0 75.13 25.35 1.35 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.792 -0.763 . . . . 0.0 109.847 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -101.5 -13.97 17.69 Favored 'General case' 0 N--CA 1.487 1.388 0 CA-C-N 114.713 -1.13 . . . . 0.0 108.881 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . 0.441 ' O ' HD13 ' S' ' 39' ' ' LEU . 12.2 p-80 -47.11 -19.8 0.14 Allowed 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.804 -1.089 . . . . 0.0 112.926 -179.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.473 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -80.16 -65.71 0.27 Allowed Pre-proline 0 N--CA 1.484 1.254 0 C-N-CA 117.593 -1.643 . . . . 0.0 110.43 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.473 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -50.25 -24.52 11.7 Favored 'Trans proline' 0 C--N 1.32 -0.95 0 N-CA-C 110.066 -0.782 . . . . 0.0 110.066 179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . 0.51 ' O ' ' SD ' ' S' ' 42' ' ' MET . 73.1 mt -82.5 -39.1 22.91 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.929 179.833 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.2 OUTLIER -52.36 -38.26 58.31 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.846 -0.742 . . . . 0.0 109.898 179.888 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . 0.434 ' ND2' HH22 ' S' ' 48' ' ' ARG . 0.3 OUTLIER -76.23 13.13 0.97 Allowed 'General case' 0 C--N 1.299 -1.609 0 C-N-CA 118.748 -1.181 . . . . 0.0 110.16 179.856 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . 0.417 ' H ' ' C ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER -116.2 -54.9 2.44 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.994 -0.682 . . . . 0.0 112.568 -179.886 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . 0.589 ' CE ' HD12 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -82.85 -8.02 59.61 Favored 'General case' 0 N--CA 1.492 1.651 0 C-N-CA 118.13 -1.428 . . . . 0.0 112.057 -179.932 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -112.78 173.47 6.36 Favored 'General case' 0 N--CA 1.507 2.412 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 179.65 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.62 HG22 ' HD3' ' S' ' 45' ' ' PRO 0.295 0.3 OUTLIER -129.12 -140.63 0.0 OUTLIER Pre-proline 0 CA--C 1.566 1.57 0 CA-C-O 117.37 -1.3 . . . . 0.0 109.497 179.941 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.62 ' HD3' HG22 ' S' ' 44' ' ' THR . 12.1 Cg_endo -98.95 -44.4 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.501 0 CA-C-N 122.282 1.851 . . . . 0.0 111.102 179.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -52.49 -23.03 5.49 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.385 -0.926 . . . . 0.0 110.102 -179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 9.9 mp0 -68.5 -51.01 47.92 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.022 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . 0.434 HH22 ' ND2' ' S' ' 40' ' ' ASN . 4.8 mpt_? -55.76 -46.96 77.76 Favored 'General case' 0 C--N 1.301 -1.524 0 CA-C-N 115.459 -0.792 . . . . 0.0 112.442 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -66.49 -66.08 0.6 Allowed 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 113.898 1.073 . . . . 0.0 113.898 -179.687 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . 0.486 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -60.32 -61.59 2.49 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 114.12 1.156 . . . . 0.0 114.12 -179.597 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . 0.633 ' C ' HD12 ' S' ' 51' ' ' LEU . 0.2 OUTLIER -45.48 -38.11 5.91 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.567 -1.253 . . . . 0.0 111.529 -179.767 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . 0.41 ' N ' ' HG ' ' S' ' 51' ' ' LEU . . . -63.22 -40.66 99.33 Favored Glycine 0 N--CA 1.492 2.374 0 N-CA-C 108.279 -1.928 . . . . 0.0 108.279 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.531 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -54.74 -73.89 0.05 OUTLIER 'General case' 0 C--N 1.302 -1.489 0 CA-C-N 114.291 -0.954 . . . . 0.0 110.921 179.721 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.501 ' CD ' ' H ' ' S' ' 54' ' ' ARG . 1.3 mmt180 -37.43 -39.15 0.28 Allowed 'General case' 0 C--N 1.299 -1.6 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.262 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.1 t -64.11 -40.86 90.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.366 0 C-N-CA 117.742 -1.583 . . . . 0.0 109.246 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.531 ' N ' ' O ' ' S' ' 53' ' ' THR . 30.2 mtt180 -62.27 -51.59 67.11 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 118.691 -1.203 . . . . 0.0 109.325 179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 0.494 HG22 HD11 ' S' ' 61' ' ' LEU . 2.0 mt -54.76 -64.96 0.39 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.436 0 C-N-CA 119.174 -1.01 . . . . 0.0 111.784 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 86.2 t -43.29 -70.68 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.297 -1.704 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.915 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -52.79 -31.13 36.98 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.96 -34.38 64.25 Favored 'General case' 0 C--N 1.308 -1.225 0 C-N-CA 118.238 -1.385 . . . . 0.0 111.438 -179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . 0.494 HD11 HG22 ' S' ' 57' ' ' ILE . 15.3 mt -75.5 -39.39 58.56 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 118.095 -1.442 . . . . 0.0 110.292 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mt -60.04 -31.53 70.05 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.284 -0.967 . . . . 0.0 110.197 179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . 0.66 ' O ' ' N ' ' S' ' 65' ' ' GLU . 0.4 OUTLIER -83.81 5.08 26.37 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.405 -0.918 . . . . 0.0 110.629 179.907 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.443 ' C ' ' O ' ' S' ' 63' ' ' ARG . . . 19.88 36.83 0.01 OUTLIER Glycine 0 N--CA 1.506 3.364 0 O-C-N 124.429 1.081 . . . . 0.0 113.122 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . 0.66 ' N ' ' O ' ' S' ' 63' ' ' ARG . 2.4 mm-40 -89.42 -36.12 15.63 Favored 'General case' 0 C--N 1.306 -1.309 0 C-N-CA 119.439 -0.905 . . . . 0.0 110.82 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -168.15 111.54 0.61 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.367 -0.933 . . . . 0.0 111.428 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 90.2 p -159.09 64.6 0.4 Allowed 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.511 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.479 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.4 OUTLIER -133.16 -18.23 2.31 Favored 'General case' 0 N--CA 1.492 1.654 0 C-N-CA 119.774 -0.77 . . . . 0.0 112.381 -179.774 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . 0.678 ' O ' ' N ' ' S' ' 71' ' ' LEU . 1.9 tpt180 -68.45 31.31 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 114.37 1.248 . . . . 0.0 114.37 -179.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.479 ' H ' ' C ' ' S' ' 68' ' ' GLN . 49.3 mt-10 5.91 49.69 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.775 0 N-CA-C 114.663 1.357 . . . . 0.0 114.663 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . 0.678 ' N ' ' O ' ' S' ' 69' ' ' ARG . 0.6 OUTLIER -46.63 -21.0 0.15 Allowed 'General case' 0 N--CA 1.493 1.715 0 C-N-CA 119.641 -0.824 . . . . 0.0 112.357 -179.956 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.2 mtpt 52.73 -112.28 0.67 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.462 -0.895 . . . . 0.0 111.219 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . 0.497 ' O ' ' C ' ' S' ' 74' ' ' GLU . 52.7 t30 -129.09 6.16 5.39 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.292 -0.963 . . . . 0.0 113.405 -179.744 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 73' ' ' ASN . 2.5 mm-40 -42.77 -46.85 5.33 Favored 'General case' 0 C--N 1.284 -2.26 0 N-CA-C 106.094 -1.817 . . . . 0.0 106.094 179.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.3 tp -143.32 24.58 1.76 Allowed 'General case' 0 C--N 1.296 -1.729 0 CA-C-N 112.919 -1.946 . . . . 0.0 108.514 179.598 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -127.42 -99.79 1.06 Allowed Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.896 -1.621 . . . . 0.0 113.023 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . 0.418 ' HB2' HG21 ' S' ' 53' ' ' THR . . . -150.59 -67.66 0.19 Allowed 'General case' 0 N--CA 1.492 1.664 0 C-N-CA 119.062 -1.055 . . . . 0.0 112.765 -179.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -169.57 160.08 33.11 Favored Glycine 0 N--CA 1.488 2.147 0 C-N-CA 119.093 -1.527 . . . . 0.0 110.911 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.865 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -61.97 -39.87 85.23 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.273 -179.947 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.21 -58.48 6.89 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.333 -0.947 . . . . 0.0 112.329 -179.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.553 HG22 ' HE1' ' R' ' 109' ' ' TRP . 73.1 p -42.2 -59.29 1.84 Allowed 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.747 1.017 . . . . 0.0 113.747 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 34.1 pt -60.14 -3.16 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 C-N-CA 119.093 -1.043 . . . . 0.0 112.925 -179.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.446 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -107.81 -37.77 6.03 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.749 -0.78 . . . . 0.0 111.396 -179.901 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.34 19.19 1.0 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 118.97 -1.092 . . . . 0.0 111.482 -179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -102.9 -38.88 2.81 Favored Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.595 -1.288 . . . . 0.0 110.424 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -87.19 -51.55 5.92 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.688 -179.987 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -79.37 11.18 3.1 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.321 -0.951 . . . . 0.0 110.107 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . 0.441 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.1 OUTLIER -72.9 -31.5 64.71 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.331 -179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . 0.441 ' C ' ' O ' ' S' ' 88' ' ' SER . 7.3 mt -34.95 -50.49 0.48 Allowed 'General case' 0 N--CA 1.494 1.731 0 CA-C-N 115.816 -0.629 . . . . 0.0 111.539 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 9.0 mmtp -40.01 -66.72 0.28 Allowed 'General case' 0 C--N 1.304 -1.393 0 CA-C-O 121.576 0.703 . . . . 0.0 112.358 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -79.27 -46.47 17.71 Favored 'General case' 0 C--N 1.289 -2.062 0 CA-C-N 114.442 -1.253 . . . . 0.0 112.572 -179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -42.49 153.69 0.3 Allowed Pre-proline 0 N--CA 1.49 1.571 0 C-N-CA 119.525 -0.87 . . . . 0.0 111.252 -179.801 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -58.26 141.42 96.74 Favored 'Trans proline' 0 C--O 1.216 -0.6 0 C-N-CA 121.53 1.487 . . . . 0.0 112.139 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . 0.671 ' O ' HG12 ' S' ' 94' ' ' VAL . 63.4 t -109.71 11.13 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.087 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -99.21 -0.17 42.02 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.816 -0.753 . . . . 0.0 111.005 -179.94 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 70.0 mt -101.64 -21.0 14.79 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.809 -0.756 . . . . 0.0 111.171 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.11 -24.05 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.476 -0.89 . . . . 0.0 110.679 -179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 30.5 mt-30 -101.57 -22.32 14.51 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.88 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.616 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 17.7 t90 -82.13 -60.45 2.22 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.999 -1.081 . . . . 0.0 112.959 -179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.644 ' HA ' HG23 ' S' ' 103' ' ' VAL . 0.4 OUTLIER -50.41 -36.27 32.12 Favored 'General case' 0 C--N 1.286 -2.188 0 C-N-CA 117.529 -1.669 . . . . 0.0 114.998 -179.493 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.497 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.4 mt-10 -40.87 -32.14 0.21 Allowed 'General case' 0 C--N 1.297 -1.687 0 C-N-CA 117.842 -1.543 . . . . 0.0 107.439 179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . 0.527 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -88.56 -28.19 20.9 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.042 -1.89 . . . . 0.0 112.381 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.644 HG23 ' HA ' ' S' ' 100' ' ' LEU . 2.1 t -79.9 -35.91 16.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 115.233 -2.587 . . . . 0.0 108.331 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -61.5 -52.68 63.49 Favored 'General case' 0 C--N 1.307 -1.271 0 C-N-CA 118.951 -1.1 . . . . 0.0 108.054 179.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . 0.425 HD12 ' HA ' ' S' ' 105' ' ' LEU . 12.7 tp -56.48 -57.08 13.85 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 119.469 -0.892 . . . . 0.0 109.909 179.717 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 43.7 mttp -95.91 80.57 3.34 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.502 179.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.304 -1.411 0 CA-C-O 116.186 -1.864 . . . . 0.0 111.029 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.505 ' HE1' ' HA ' ' R' ' 81' ' ' THR . 1.0 OUTLIER . . . . . 0 N--CA 1.488 1.439 0 CA-C-O 116.409 -1.758 . . . . 0.0 110.474 . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.553 ' HE1' HG22 ' S' ' 81' ' ' THR . 0.7 OUTLIER . . . . . 0 N--CA 1.485 1.309 0 CA-C-O 116.219 -1.848 . . . . 0.0 109.994 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 . . . . . 0 N--CA 1.487 1.383 0 CA-C-O 121.061 0.458 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 59.2 m 51.08 62.45 11.4 Favored Pre-proline 0 C--N 1.303 -1.418 0 C-N-CA 119.942 -0.703 . . . . 0.0 111.768 179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -65.03 156.03 64.96 Favored 'Trans proline' 0 C--N 1.317 -1.124 0 C-N-CA 121.483 1.456 . . . . 0.0 111.139 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -109.52 -0.47 18.8 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.89 -0.724 . . . . 0.0 110.755 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 1.5 m 59.2 28.43 17.73 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.981 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.74 117.69 17.76 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.357 -0.937 . . . . 0.0 110.599 179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . 48.54 -173.86 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.48 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -106.16 133.22 51.21 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.698 -0.801 . . . . 0.0 110.72 -179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -90.11 40.31 1.0 Allowed 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.317 -0.953 . . . . 0.0 110.367 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -90.1 121.51 32.23 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.146 -179.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -67.67 124.85 24.42 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.662 -0.815 . . . . 0.0 110.952 179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -108.58 23.79 14.01 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.83 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.6 m170 -103.83 55.91 0.73 Allowed 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.334 179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.556 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.6 tt0 -113.09 -82.27 0.59 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.272 179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . 0.463 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.1 OUTLIER -49.52 -21.66 1.02 Allowed 'General case' 0 N--CA 1.495 1.809 0 CA-C-O 123.445 1.593 . . . . 0.0 106.937 179.571 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . 0.556 ' N ' ' C ' ' R' ' 17' ' ' GLN 0.257 43.2 t-105 -55.49 -51.66 66.25 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 111.607 -2.542 . . . . 0.0 109.042 179.663 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 4.3 tp -58.07 -21.95 48.17 Favored 'General case' 0 C--N 1.3 -1.584 0 CA-C-N 114.001 -1.454 . . . . 0.0 111.24 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.475 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.0 mmt85 -71.28 -72.07 0.23 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 118.75 -1.18 . . . . 0.0 109.354 179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.481 ' CD2' HG23 ' R' ' 23' ' ' VAL . 0.0 OUTLIER -35.5 -32.66 0.03 OUTLIER 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 119.294 -0.962 . . . . 0.0 111.193 179.658 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . 0.481 HG23 ' CD2' ' R' ' 22' ' ' PHE . 89.0 t -81.95 -58.16 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.805 179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -34.94 -45.2 0.25 Allowed 'General case' 0 N--CA 1.488 1.45 0 CA-C-N 114.643 -1.162 . . . . 0.0 112.385 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' R' ' 25' ' ' LEU . 0.7 OUTLIER -82.83 -40.2 20.67 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.726 -179.983 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . 0.412 ' CD1' HD11 ' R' ' 39' ' ' LEU . 4.8 tp -37.75 -52.63 1.28 Allowed 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.789 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.12 -51.85 28.3 Favored 'General case' 0 N--CA 1.497 1.876 0 C-N-CA 118.615 -1.234 . . . . 0.0 112.501 -179.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -51.02 -31.4 18.13 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.633 -0.827 . . . . 0.0 112.855 -179.728 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.476 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -83.39 -53.45 5.72 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.0 -1.08 . . . . 0.0 112.692 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . 0.411 ' O ' ' C ' ' R' ' 31' ' ' GLN . 61.5 t80 -36.51 -51.19 0.82 Allowed 'General case' 0 N--CA 1.492 1.637 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . 0.411 ' C ' ' O ' ' R' ' 30' ' ' TYR . 1.9 tt0 -38.45 -35.69 0.19 Allowed 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 119.865 -0.734 . . . . 0.0 111.576 -179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 62.4 t-20 -101.77 -80.82 0.5 Allowed 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.796 -0.762 . . . . 0.0 110.638 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 168.35 35.01 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 CA-C-O 121.689 0.757 . . . . 0.0 109.106 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . 0.421 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 2.1 mm? -100.86 -19.3 16.0 Favored 'General case' 0 C--N 1.3 -1.579 0 CA-C-N 114.875 -1.057 . . . . 0.0 110.434 -179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . 0.406 ' CG ' ' N ' ' R' ' 36' ' ' LEU . 6.3 p-80 -48.09 -41.2 25.61 Favored 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 114.842 -1.072 . . . . 0.0 112.754 -179.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.1 mt -58.06 -64.07 3.18 Favored Pre-proline 0 C--N 1.302 -1.494 0 C-N-CA 117.988 -1.485 . . . . 0.0 111.146 -179.667 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 3.9 Cg_endo -56.35 -17.26 20.46 Favored 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.955 1.103 . . . . 0.0 111.27 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -82.82 -56.46 3.81 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 120.269 -0.572 . . . . 0.0 112.099 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.446 ' C ' ' N ' ' R' ' 41' ' ' LEU . 2.6 mm? -51.71 -33.78 35.93 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 117.988 -1.485 . . . . 0.0 108.049 179.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -12.94 0.07 Allowed 'General case' 0 N--CA 1.486 1.368 0 CA-C-N 114.949 -1.023 . . . . 0.0 111.058 179.986 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . 0.446 ' N ' ' C ' ' R' ' 39' ' ' LEU . 11.6 mt -112.0 -58.01 2.19 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 120.0 -0.68 . . . . 0.0 111.349 -179.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . 0.498 ' N ' ' SD ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -87.03 39.11 0.84 Allowed 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 118.235 -1.386 . . . . 0.0 110.279 179.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 3.7 tp -160.48 170.62 20.58 Favored 'General case' 0 N--CA 1.497 1.89 0 CA-C-N 114.385 -1.28 . . . . 0.0 108.275 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.487 ' HB ' ' CD ' ' R' ' 45' ' ' PRO 0.314 0.1 OUTLIER -132.86 -153.68 0.01 OUTLIER Pre-proline 0 N--CA 1.491 1.619 0 C-N-CA 118.414 -1.314 . . . . 0.0 110.817 -179.955 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.487 ' CD ' ' HB ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -95.21 -40.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.217 -0.531 0 N-CA-C 110.01 -0.804 . . . . 0.0 110.01 179.4 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 44.9 m-20 -58.93 -34.19 71.45 Favored 'General case' 0 C--N 1.308 -1.225 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.111 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.47 ' N ' ' OE1' ' R' ' 47' ' ' GLU . 0.3 OUTLIER -63.23 -48.06 79.86 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-N 115.016 -0.993 . . . . 0.0 108.945 179.908 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -49.54 -37.94 28.94 Favored 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.016 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -77.64 -73.27 0.31 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.6 -0.84 . . . . 0.0 111.972 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.42 -48.03 37.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.45 -0.9 . . . . 0.0 111.906 -179.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.9 tt -45.51 -61.69 1.59 Allowed 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 119.182 -1.007 . . . . 0.0 111.176 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -53.57 -44.95 68.26 Favored Glycine 0 N--CA 1.494 2.524 0 C-N-CA 119.69 -1.243 . . . . 0.0 111.451 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.482 ' O ' ' N ' ' R' ' 55' ' ' VAL . 0.1 OUTLIER -52.57 -83.42 0.01 OUTLIER 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 119.913 -0.715 . . . . 0.0 110.61 179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.407 ' HG2' ' CE2' ' R' ' 1' ' ' TRP . 10.1 mtt85 -42.33 -21.77 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.828 -1.078 . . . . 0.0 111.798 -179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . 0.643 HG22 ' HB3' ' S' ' 42' ' ' MET . 2.3 t -82.04 -40.61 17.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.651 0 C-N-CA 119.544 -0.862 . . . . 0.0 111.027 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.402 HH11 ' HG3' ' R' ' 60' ' ' GLU . 0.0 OUTLIER -81.4 -30.93 33.45 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 118.594 -1.242 . . . . 0.0 112.825 -179.599 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 0.411 HG21 HD13 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -78.66 -42.51 25.41 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.286 0 C-N-CA 118.007 -1.477 . . . . 0.0 109.228 179.992 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 0.535 ' CG1' ' N ' ' R' ' 59' ' ' GLU . 2.9 p -62.1 -49.42 84.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.342 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.68 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.535 ' N ' ' CG1' ' R' ' 58' ' ' VAL . 3.9 pt-20 -66.91 -28.15 68.07 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 117.93 -1.508 . . . . 0.0 111.351 -179.897 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . 0.402 ' HG3' HH11 ' R' ' 56' ' ' ARG . 17.2 mm-40 -72.18 -44.9 62.32 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 119.067 -1.053 . . . . 0.0 112.253 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 40.0 mt -82.61 -7.15 59.66 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.497 -1.281 . . . . 0.0 111.983 -179.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.5 tp -66.37 -0.83 2.89 Favored 'General case' 0 N--CA 1.49 1.551 0 C-N-CA 118.708 -1.197 . . . . 0.0 110.871 179.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . 0.655 ' O ' ' N ' ' R' ' 65' ' ' GLU . 2.3 mtp180 -95.27 7.86 44.86 Favored 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 119.389 -0.924 . . . . 0.0 111.299 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . 0.443 ' C ' ' O ' ' R' ' 63' ' ' ARG . . . 19.05 37.15 0.01 OUTLIER Glycine 0 N--CA 1.503 3.162 0 O-C-N 124.422 1.076 . . . . 0.0 113.491 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.655 ' N ' ' O ' ' R' ' 63' ' ' ARG . 2.5 mm-40 -63.86 -35.86 82.01 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 119.425 -0.91 . . . . 0.0 109.943 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 7.5 mtm -140.23 166.22 25.28 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.489 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 9.6 t -171.98 70.9 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.231 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -130.79 -100.36 0.31 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 119.919 -0.712 . . . . 0.0 110.54 -179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.08 26.11 2.25 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.529 -0.868 . . . . 0.0 109.806 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . . . . . . . . . 13.6 mm-40 -129.32 26.26 5.42 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 114.109 -1.405 . . . . 0.0 109.073 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . 0.658 ' O ' HD13 ' R' ' 82' ' ' ILE . 1.3 mt -92.11 -19.62 22.11 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.198 -0.91 . . . . 0.0 111.422 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 27.6 mttt -134.41 -55.61 0.85 Allowed 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 119.285 -0.966 . . . . 0.0 112.405 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -72.93 2.27 7.19 Favored 'General case' 0 C--N 1.305 -1.327 0 C-N-CA 118.512 -1.275 . . . . 0.0 111.719 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . 0.401 ' OE2' ' CB ' ' R' ' 75' ' ' LEU . 0.4 OUTLIER -50.77 -43.79 58.53 Favored 'General case' 0 C--N 1.282 -2.332 0 N-CA-C 106.897 -1.52 . . . . 0.0 106.897 179.82 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' R' ' 77' ' ' ALA . 5.4 tp -136.84 28.76 2.9 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-N 114.052 -1.431 . . . . 0.0 108.862 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . 0.462 ' C ' ' O ' ' R' ' 75' ' ' LEU . . . 23.16 37.49 0.01 OUTLIER Glycine 0 N--CA 1.504 3.198 0 O-C-N 124.347 1.03 . . . . 0.0 112.499 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . 0.598 ' N ' ' O ' ' R' ' 75' ' ' LEU . . . -76.6 -83.46 0.07 Allowed 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 119.709 -0.797 . . . . 0.0 110.985 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . 0.52 ' C ' ' H ' ' R' ' 80' ' ' ALA . . . 178.09 155.82 15.14 Favored Glycine 0 N--CA 1.488 2.165 0 C-N-CA 119.527 -1.32 . . . . 0.0 110.557 -179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.773 ' N ' HD13 ' R' ' 79' ' ' ILE . 0.8 OUTLIER -71.48 25.63 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.301 -1.543 0 C-N-CA 119.887 -0.725 . . . . 0.0 112.168 -179.981 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.52 ' H ' ' C ' ' R' ' 78' ' ' GLY . . . -109.2 -39.69 5.17 Favored 'General case' 0 N--CA 1.486 1.362 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . 0.465 ' O ' ' N ' ' R' ' 83' ' ' THR . 18.2 p -94.91 -61.16 1.54 Allowed 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 114.623 -1.171 . . . . 0.0 110.857 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . 0.658 HD13 ' O ' ' R' ' 71' ' ' LEU . 1.8 pp -43.43 -22.29 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 119.319 -0.953 . . . . 0.0 110.998 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.465 ' N ' ' O ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -60.24 -81.98 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 119.508 -0.877 . . . . 0.0 111.036 -179.922 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.836 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -50.12 -26.01 4.06 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 118.738 -1.185 . . . . 0.0 110.015 179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.95 -47.37 19.65 Favored Glycine 0 N--CA 1.486 1.981 0 C-N-CA 119.493 -1.337 . . . . 0.0 110.307 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -113.51 -56.18 2.43 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 120.118 -0.633 . . . . 0.0 111.103 180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . 0.611 ' C ' ' H ' ' R' ' 89' ' ' LEU . 2.5 m-80 -43.41 -49.82 7.01 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.656 -179.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . 0.61 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.1 OUTLIER 62.78 -1.05 0.5 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.377 -1.329 . . . . 0.0 109.954 -179.96 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . 0.744 ' O ' ' N ' ' R' ' 91' ' ' ALA . 0.3 OUTLIER 27.59 33.37 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 113.685 -1.598 . . . . 0.0 111.172 -179.764 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . 0.61 ' N ' ' O ' ' R' ' 88' ' ' SER . 5.1 tptp 21.52 25.85 0.0 OUTLIER 'General case' 0 N--CA 1.51 2.527 0 CA-C-N 114.249 -1.341 . . . . 0.0 113.404 -179.612 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . 0.744 ' N ' ' O ' ' R' ' 89' ' ' LEU . . . -79.9 -20.65 45.33 Favored 'General case' 0 C--N 1.286 -2.171 0 C-N-CA 117.133 -1.827 . . . . 0.0 111.03 -179.637 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.487 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -61.12 161.02 18.21 Favored Pre-proline 0 N--CA 1.487 1.408 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.93 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . 0.487 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.9 Cg_endo -58.31 168.48 3.76 Favored 'Trans proline' 0 C--N 1.323 -0.8 0 C-N-CA 121.543 1.495 . . . . 0.0 111.525 179.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 12.5 t -91.46 -24.03 5.66 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 C-N-CA 119.422 -0.911 . . . . 0.0 110.532 -179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 10.8 tt0 -67.26 -9.23 38.56 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.515 -0.874 . . . . 0.0 110.996 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . 0.432 HD23 HD23 ' R' ' 100' ' ' LEU . 0.5 OUTLIER -66.33 -47.65 72.83 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.806 -0.758 . . . . 0.0 111.463 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -58.77 -31.55 68.48 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.229 -0.989 . . . . 0.0 111.157 -179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -73.99 -19.69 60.57 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 119.206 -0.998 . . . . 0.0 111.298 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.66 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 1.8 t90 -96.14 -70.22 0.72 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.311 -0.955 . . . . 0.0 112.629 -179.905 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.586 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.1 mm? -36.6 -52.35 0.87 Allowed 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -179.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.586 ' C ' ' O ' ' R' ' 100' ' ' LEU . 47.9 mt-10 -33.85 -42.06 0.11 Allowed 'General case' 0 C--N 1.294 -1.813 0 C-N-CA 118.574 -1.25 . . . . 0.0 108.087 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' O ' ' R' ' 100' ' ' LEU . 0.4 OUTLIER -85.17 -29.74 24.51 Favored 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 113.455 -1.702 . . . . 0.0 112.874 -179.949 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.66 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 4.7 t -80.79 -35.97 15.18 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.202 0 C-N-CA 116.603 -2.039 . . . . 0.0 110.837 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mt -70.37 -58.38 3.8 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 119.359 -0.936 . . . . 0.0 110.951 179.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 4.7 mt -47.51 -70.65 0.09 Allowed 'General case' 0 N--CA 1.492 1.66 0 C-N-CA 118.642 -1.223 . . . . 0.0 111.533 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 5.1 mptp? -52.71 -60.94 2.64 Favored 'General case' 0 N--CA 1.489 1.513 0 C-N-CA 119.621 -0.831 . . . . 0.0 111.993 -179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . 0.407 ' C ' ' O ' ' R' ' 103' ' ' VAL . 0.4 OUTLIER . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 116.385 -1.769 . . . . 0.0 111.172 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . 0.531 HE21 ' C ' ' S' ' 4' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.346 0 CA-C-O 121.029 0.442 . . . . 0.0 110.223 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . 0.431 ' N ' ' HD3' ' S' ' 6' ' ' PRO . 17.5 m 52.07 58.74 15.33 Favored Pre-proline 0 C--N 1.302 -1.479 0 C-N-CA 119.862 -0.735 . . . . 0.0 111.801 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . 0.431 ' HD3' ' N ' ' S' ' 5' ' ' SER . 1.0 OUTLIER -63.84 -44.7 12.51 Favored 'Trans proline' 0 C--N 1.314 -1.25 0 C-N-CA 121.246 1.297 . . . . 0.0 110.54 179.898 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 75.9 m-85 -61.29 137.8 58.24 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.753 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -82.33 -25.63 33.73 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.28 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . 0.431 ' O ' ' O ' ' S' ' 10' ' ' ALA . . . -163.45 -4.15 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.162 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . 0.431 ' O ' ' O ' ' S' ' 9' ' ' ALA . . . 52.67 168.01 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 CA-C-N 115.761 -0.654 . . . . 0.0 111.519 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 13.7 mtm -145.16 143.41 30.32 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.7 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . 0.449 ' O ' ' N ' ' S' ' 14' ' ' GLN . . . -58.12 -94.85 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.24 -0.984 . . . . 0.0 110.648 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 64.49 -73.25 0.06 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.877 -0.729 . . . . 0.0 111.162 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . 0.449 ' N ' ' O ' ' S' ' 12' ' ' ALA . 24.1 mt-30 -122.34 98.74 6.07 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.828 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 7.4 mtt180 -88.21 157.4 18.81 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.241 -0.984 . . . . 0.0 110.944 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . 0.451 ' O ' ' CG ' ' S' ' 16' ' ' HIS . 58.1 t-80 -142.68 12.69 1.9 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.884 -0.726 . . . . 0.0 109.926 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.449 ' C ' ' N ' ' S' ' 19' ' ' TRP . 5.3 mt-30 -88.94 -83.92 0.22 Allowed 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.658 -0.817 . . . . 0.0 109.928 179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.478 ' H ' ' HG3' ' S' ' 18' ' ' GLU . 24.5 mt-10 -43.58 -32.74 1.0 Allowed 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . 0.449 ' N ' ' C ' ' S' ' 17' ' ' GLN . 65.2 t-105 -48.5 -56.33 8.59 Favored 'General case' 0 C--N 1.301 -1.537 0 CA-C-N 112.881 -1.963 . . . . 0.0 109.65 179.621 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 3.4 tt -51.48 -35.9 42.05 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 113.693 -1.594 . . . . 0.0 111.679 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.559 ' O ' ' C ' ' S' ' 22' ' ' PHE . 50.4 mtt-85 -63.35 -73.24 0.12 Allowed 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.168 -1.013 . . . . 0.0 110.566 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.637 ' CE1' HD12 ' S' ' 26' ' ' LEU . 1.5 t80 -24.92 -50.68 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.388 0 CA-C-O 121.643 0.735 . . . . 0.0 111.34 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.414 ' O ' ' C ' ' S' ' 24' ' ' ASP . 24.8 t -70.56 -46.78 68.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.787 179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.494 ' N ' ' O ' ' S' ' 21' ' ' ARG . 16.8 t0 -36.64 -62.95 0.44 Allowed 'General case' 0 N--CA 1.494 1.727 0 C-N-CA 120.07 -0.652 . . . . 0.0 111.919 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.426 ' H ' ' HG ' ' S' ' 25' ' ' LEU . 0.3 OUTLIER -64.0 -49.88 70.7 Favored 'General case' 0 N--CA 1.489 1.502 0 C-N-CA 118.658 -1.217 . . . . 0.0 110.391 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.637 HD12 ' CE1' ' S' ' 22' ' ' PHE . 0.7 OUTLIER -40.1 -63.27 0.63 Allowed 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.396 -0.922 . . . . 0.0 112.879 -179.891 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.12 -57.04 6.39 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.404 -0.918 . . . . 0.0 112.606 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 71.0 m-80 -64.36 -16.84 63.02 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.461 -0.896 . . . . 0.0 112.099 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . 0.451 ' O ' ' N ' ' S' ' 31' ' ' GLN . . . -90.36 -47.9 7.46 Favored 'General case' 0 C--N 1.302 -1.499 0 C-N-CA 118.933 -1.107 . . . . 0.0 112.491 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . 0.413 ' C ' ' O ' ' S' ' 29' ' ' ALA . 0.4 OUTLIER -40.19 -26.8 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.376 -179.93 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.3 tt0 -75.71 -37.93 59.01 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.695 -0.802 . . . . 0.0 111.384 179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 18.1 t-20 -95.1 -8.33 36.85 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.155 -1.018 . . . . 0.0 111.6 -179.908 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 3.5 t0 84.71 23.05 0.1 Allowed 'General case' 0 N--CA 1.498 1.974 0 O-C-N 123.626 0.579 . . . . 0.0 110.794 179.852 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -88.88 -16.46 31.88 Favored 'General case' 0 C--N 1.302 -1.462 0 CA-C-N 115.155 -0.93 . . . . 0.0 109.025 179.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . 0.476 ' O ' HD22 ' S' ' 39' ' ' LEU . 26.4 p-80 -54.95 -25.3 28.6 Favored 'General case' 0 C--N 1.296 -1.745 0 CA-C-N 113.97 -1.468 . . . . 0.0 113.018 -179.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.479 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 5.6 mt -70.75 -63.34 1.63 Allowed Pre-proline 0 C--N 1.3 -1.548 0 C-N-CA 118.423 -1.311 . . . . 0.0 111.417 -179.712 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.479 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.7 Cg_endo -54.61 -36.54 89.6 Favored 'Trans proline' 0 C--N 1.317 -1.112 0 C-N-CA 120.636 0.89 . . . . 0.0 111.57 179.849 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . 0.511 ' O ' ' SD ' ' S' ' 42' ' ' MET . 19.7 mt -74.8 -37.52 62.33 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 118.779 -1.168 . . . . 0.0 110.656 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.476 HD22 ' O ' ' S' ' 35' ' ' HIS . 0.1 OUTLIER -53.07 -38.31 62.4 Favored 'General case' 0 N--CA 1.49 1.525 0 C-N-CA 119.155 -1.018 . . . . 0.0 110.384 179.904 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 -76.27 7.62 4.12 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.95 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.57 -55.62 2.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.724 -0.79 . . . . 0.0 112.457 -179.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . 0.643 ' HB3' HG22 ' R' ' 55' ' ' VAL . 0.0 OUTLIER -78.67 6.38 8.96 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 118.496 -1.282 . . . . 0.0 111.474 -179.742 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 68.6 mt -127.38 -175.62 3.5 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.517 -0.92 . . . . 0.0 108.517 179.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.68 HG22 ' HD3' ' S' ' 45' ' ' PRO 0.299 0.3 OUTLIER -129.23 -147.34 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.364 0 C-N-CA 118.681 -1.207 . . . . 0.0 109.51 -179.91 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.68 ' HD3' HG22 ' S' ' 44' ' ' THR . 8.0 Cg_endo -96.55 -42.3 0.02 OUTLIER 'Trans proline' 0 C--O 1.218 -0.492 0 CA-C-N 120.147 1.088 . . . . 0.0 110.566 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -52.27 -29.94 25.48 Favored 'General case' 0 C--N 1.302 -1.487 0 CA-C-N 115.145 -0.934 . . . . 0.0 109.891 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -59.92 -54.21 48.8 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 118.978 -1.089 . . . . 0.0 109.645 -179.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -52.1 -39.82 60.37 Favored 'General case' 0 C--N 1.299 -1.61 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.471 -180.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . 0.431 ' O ' ' OG1' ' S' ' 53' ' ' THR . 85.6 mt-10 -82.34 -68.65 0.68 Allowed 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 118.831 -1.148 . . . . 0.0 112.49 -179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -49.68 -50.01 45.25 Favored 'General case' 0 N--CA 1.493 1.721 0 N-CA-C 113.198 0.814 . . . . 0.0 113.198 -179.721 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . 0.662 ' C ' HD12 ' S' ' 51' ' ' LEU . 0.4 OUTLIER -60.08 -40.97 91.43 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 118.155 -1.418 . . . . 0.0 110.7 -179.947 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . 0.463 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -61.4 -30.96 75.65 Favored Glycine 0 N--CA 1.494 2.503 0 N-CA-C 108.687 -1.765 . . . . 0.0 108.687 179.774 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.518 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -65.16 -79.03 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.662 0 CA-C-N 114.748 -0.726 . . . . 0.0 110.733 179.889 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . . . . . . . . . 5.7 mtt-85 -41.35 -24.11 0.03 OUTLIER 'General case' 0 C--N 1.302 -1.475 0 CA-C-N 115.671 -0.695 . . . . 0.0 110.494 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . 0.485 ' N ' ' O ' ' S' ' 53' ' ' THR . 12.9 t -71.42 -44.28 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.314 0 C-N-CA 117.957 -1.497 . . . . 0.0 107.627 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.518 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.3 OUTLIER -59.55 -48.65 80.81 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 115.363 -0.835 . . . . 0.0 108.997 179.817 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . . . . . . . . . 2.4 mt -57.44 -63.31 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.527 0 CA-C-N 114.464 -1.244 . . . . 0.0 111.968 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 79.5 t -46.5 -59.92 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.654 0 C-N-CA 118.243 -1.383 . . . . 0.0 111.467 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -61.02 -18.8 59.75 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 120.023 -0.671 . . . . 0.0 112.502 -179.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -79.95 -39.38 30.32 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 118.657 -1.217 . . . . 0.0 111.002 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 74.5 mt -72.15 -29.7 64.3 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 118.858 -1.137 . . . . 0.0 110.95 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 1.8 mt -52.97 -66.59 0.36 Allowed 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 118.981 -1.088 . . . . 0.0 109.719 179.737 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . 0.678 ' O ' ' N ' ' S' ' 65' ' ' GLU . 0.0 OUTLIER -78.61 -44.0 25.01 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 179.773 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.431 ' C ' ' N ' ' S' ' 66' ' ' MET . . . 13.75 38.65 0.0 OUTLIER Glycine 0 N--CA 1.503 3.101 0 CA-C-N 113.724 -1.58 . . . . 0.0 114.469 179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . 0.678 ' N ' ' O ' ' S' ' 63' ' ' ARG . 0.0 OUTLIER -47.05 -25.41 0.82 Allowed 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 118.542 -1.263 . . . . 0.0 109.177 179.726 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . 0.431 ' N ' ' C ' ' S' ' 64' ' ' GLY . 0.5 OUTLIER -139.5 109.46 6.38 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 114.769 -1.105 . . . . 0.0 109.144 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 11.5 p -168.75 82.68 0.15 Allowed 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.297 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.585 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.0 OUTLIER -125.26 -17.16 5.74 Favored 'General case' 0 C--N 1.302 -1.477 0 CA-C-N 115.349 -0.841 . . . . 0.0 110.521 -179.832 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . 0.685 ' O ' ' N ' ' S' ' 71' ' ' LEU . 1.4 tpt180 -68.41 27.45 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.54 0 CA-C-N 115.332 -0.849 . . . . 0.0 112.609 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.585 ' H ' ' C ' ' S' ' 68' ' ' GLN . 6.6 mt-10 13.11 40.09 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.311 0 N-CA-C 114.959 1.466 . . . . 0.0 114.959 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . 0.685 ' N ' ' O ' ' S' ' 69' ' ' ARG . 5.7 mp 11.13 -73.67 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.156 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . 0.568 ' N ' ' O ' ' S' ' 70' ' ' GLU . 1.1 tptm 84.31 -156.66 0.01 OUTLIER 'General case' 0 N--CA 1.497 1.877 0 O-C-N 123.791 0.682 . . . . 0.0 109.992 -179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . 0.52 ' ND2' ' O ' ' S' ' 77' ' ' ALA . 14.4 t-20 -107.74 6.51 27.69 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 119.319 -0.952 . . . . 0.0 112.281 -179.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . 0.482 ' C ' ' O ' ' S' ' 73' ' ' ASN . 1.4 mt-10 -44.99 -44.67 10.09 Favored 'General case' 0 C--N 1.286 -2.195 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 1.5 tp -145.0 21.4 1.59 Allowed 'General case' 0 C--N 1.3 -1.573 0 CA-C-N 112.84 -1.982 . . . . 0.0 108.929 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -129.94 -100.02 0.9 Allowed Glycine 0 N--CA 1.499 2.841 0 C-N-CA 118.829 -1.653 . . . . 0.0 112.96 -179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . 0.52 ' O ' ' ND2' ' S' ' 73' ' ' ASN . . . -147.29 -59.34 0.27 Allowed 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.202 -0.999 . . . . 0.0 112.688 -179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 179.24 161.06 26.09 Favored Glycine 0 N--CA 1.491 2.331 0 C-N-CA 118.666 -1.731 . . . . 0.0 111.593 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.937 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -59.73 -28.69 41.13 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.281 0 CA-C-N 115.093 -0.554 . . . . 0.0 111.249 -179.91 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.448 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.38 -55.29 16.54 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.508 -0.877 . . . . 0.0 113.248 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.751 HG22 ' HE1' ' R' ' 109' ' ' TRP . 80.9 p -46.52 -51.61 15.03 Favored 'General case' 0 C--N 1.303 -1.438 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -179.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . 0.409 ' H ' HG23 ' S' ' 82' ' ' ILE . 7.3 pt -70.81 11.47 0.18 Allowed 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 C-N-CA 119.165 -1.014 . . . . 0.0 113.304 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -120.9 -46.48 2.34 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.062 179.89 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . 0.482 ' C ' ' H ' ' S' ' 86' ' ' SER . 3.0 ptm180 -63.89 -23.02 67.19 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.055 -1.058 . . . . 0.0 110.974 -179.942 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -57.55 -4.9 1.54 Allowed Glycine 0 N--CA 1.487 2.067 0 C-N-CA 119.217 -1.468 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . 0.482 ' H ' ' C ' ' S' ' 84' ' ' ARG . 1.0 OUTLIER -157.24 -12.92 0.09 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.21 -0.996 . . . . 0.0 112.542 179.994 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -92.91 -22.6 19.14 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.72 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . 0.414 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.4 OUTLIER -75.85 -37.51 58.91 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.495 -0.882 . . . . 0.0 111.58 179.985 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . 0.414 ' C ' ' O ' ' S' ' 88' ' ' SER . 26.4 mt -37.62 -43.7 0.64 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 120.229 -0.589 . . . . 0.0 111.844 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 5.9 mmtp -42.66 -64.3 0.64 Allowed 'General case' 0 N--CA 1.488 1.46 0 C-N-CA 119.336 -0.946 . . . . 0.0 110.879 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -76.84 -49.47 15.69 Favored 'General case' 0 C--N 1.288 -2.068 0 C-N-CA 118.726 -1.19 . . . . 0.0 110.825 -179.788 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . 0.624 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -59.28 164.84 4.38 Favored Pre-proline 0 N--CA 1.489 1.492 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.035 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . 0.624 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 21.4 Cg_exo -45.55 133.39 12.99 Favored 'Trans proline' 0 C--N 1.321 -0.913 0 C-N-CA 121.871 1.714 . . . . 0.0 112.49 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 4.1 t -108.92 -5.25 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 CA-C-N 115.506 -0.77 . . . . 0.0 110.251 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -59.94 -7.16 1.58 Allowed 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.332 -0.849 . . . . 0.0 111.932 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 2.7 mt -75.8 -32.96 60.1 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.196 -1.002 . . . . 0.0 111.716 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -37.47 72.93 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 119.35 -0.94 . . . . 0.0 111.456 179.96 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -72.47 -30.47 64.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.83 -0.748 . . . . 0.0 112.051 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.544 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 16.7 t90 -88.2 -61.77 1.64 Allowed 'General case' 0 N--CA 1.488 1.474 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -179.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.657 ' HA ' HG23 ' S' ' 103' ' ' VAL . 0.3 OUTLIER -52.36 -32.61 39.23 Favored 'General case' 0 C--N 1.286 -2.175 0 N-CA-C 115.435 1.642 . . . . 0.0 115.435 -179.64 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.491 ' C ' ' O ' ' S' ' 100' ' ' LEU . 0.4 OUTLIER -43.78 -27.95 0.38 Allowed 'General case' 0 C--N 1.3 -1.553 0 C-N-CA 117.751 -1.58 . . . . 0.0 106.953 179.844 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . 0.526 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.8 mt-10 -94.98 -28.24 15.24 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 113.122 -1.853 . . . . 0.0 112.942 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.657 HG23 ' HA ' ' S' ' 100' ' ' LEU . 2.1 t -77.65 -28.65 15.91 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 C-N-CA 114.893 -2.723 . . . . 0.0 108.322 -179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -75.66 -56.82 4.32 Favored 'General case' 0 C--N 1.306 -1.288 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.458 179.657 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 6.5 mt -60.78 -69.42 0.23 Allowed 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.709 -1.196 . . . . 0.0 110.957 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . 0.466 ' CG ' ' N ' ' S' ' 107' ' ' SER . 1.7 ttmm -96.86 162.38 13.44 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.406 -179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . 0.466 ' N ' ' CG ' ' S' ' 106' ' ' LYS . 81.8 p . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 116.243 -1.837 . . . . 0.0 110.844 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.407 ' CE2' ' HG2' ' R' ' 54' ' ' ARG . 32.0 m-90 . . . . . 0 N--CA 1.486 1.364 0 CA-C-O 116.478 -1.725 . . . . 0.0 110.152 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.751 ' HE1' HG22 ' S' ' 81' ' ' THR . 11.5 m-90 . . . . . 0 N--CA 1.487 1.421 0 CA-C-O 116.418 -1.753 . . . . 0.0 110.114 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 4.9 mp0 . . . . . 0 N--CA 1.485 1.292 0 CA-C-O 120.881 0.372 . . . . 0.0 110.171 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . 0.519 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.2 OUTLIER -87.8 -46.08 0.48 Allowed Pre-proline 0 C--N 1.305 -1.354 0 C-N-CA 118.971 -1.092 . . . . 0.0 112.304 179.984 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . 0.519 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.7 Cg_endo -68.39 141.68 52.06 Favored 'Trans proline' 0 C--N 1.32 -0.924 0 C-N-CA 120.699 0.933 . . . . 0.0 111.019 -179.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.13 179.47 2.35 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 118.991 -1.084 . . . . 0.0 110.852 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -134.61 -27.87 1.29 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 115.564 -0.744 . . . . 0.0 109.647 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -112.97 58.98 0.65 Allowed 'General case' 0 N--CA 1.487 1.378 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.436 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -82.23 120.86 25.9 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.857 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 21.8 mmt -88.09 123.26 32.59 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 119.389 -0.925 . . . . 0.0 110.747 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.89 113.92 7.58 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.531 -0.868 . . . . 0.0 111.534 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -60.78 103.91 0.3 Allowed 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.595 -0.842 . . . . 0.0 110.343 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.8 mm100 -43.29 147.46 0.37 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.429 -0.909 . . . . 0.0 111.38 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.7 mtm180 -97.33 78.61 2.72 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.588 -0.845 . . . . 0.0 111.374 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . 0.424 ' H ' ' H ' ' R' ' 17' ' ' GLN . 0.9 OUTLIER -157.1 -4.74 0.1 Allowed 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.412 -0.813 . . . . 0.0 109.076 -179.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.424 ' H ' ' H ' ' R' ' 16' ' ' HIS . 1.1 mt-30 -91.42 -85.56 0.23 Allowed 'General case' 0 N--CA 1.485 1.295 0 CA-C-N 115.572 -0.74 . . . . 0.0 109.231 179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . 0.436 ' OE1' ' O ' ' S' ' 52' ' ' GLY . 0.5 OUTLIER -45.52 -33.96 3.02 Favored 'General case' 0 N--CA 1.488 1.456 0 CA-C-O 123.106 1.431 . . . . 0.0 107.66 179.626 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 10.1 t-105 -52.71 -58.55 6.46 Favored 'General case' 0 C--N 1.296 -1.733 0 CA-C-N 112.925 -1.943 . . . . 0.0 108.175 179.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 1.2 mt -58.68 -28.66 65.96 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.775 -1.557 . . . . 0.0 111.695 179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.535 ' O ' ' C ' ' R' ' 22' ' ' PHE . 10.4 mmt-85 -56.3 -68.02 0.25 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 117.885 -1.526 . . . . 0.0 110.144 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.535 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -33.3 -40.09 0.06 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 118.416 -1.314 . . . . 0.0 111.049 179.613 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . 0.428 ' N ' ' O ' ' R' ' 21' ' ' ARG . 14.9 t -72.05 -47.47 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 C-N-CA 119.469 -0.893 . . . . 0.0 110.44 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.458 ' N ' ' O ' ' R' ' 21' ' ' ARG . 36.0 t70 -45.5 -21.34 0.09 Allowed 'General case' 0 N--CA 1.486 1.357 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.241 -179.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.08 -43.37 6.36 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 119.529 -0.868 . . . . 0.0 110.994 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 tt -47.74 -38.0 14.46 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 115.636 -0.711 . . . . 0.0 112.325 -179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 11.3 tttp -76.64 -38.55 54.46 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 -179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -82.88 -2.2 54.17 Favored 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 119.113 -1.035 . . . . 0.0 113.63 -179.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.478 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -115.47 -30.97 6.06 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.144 -1.022 . . . . 0.0 113.426 -179.925 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -44.01 -38.95 3.8 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.111 -1.035 . . . . 0.0 112.164 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -75.76 -29.71 58.9 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.848 -1.141 . . . . 0.0 111.524 -179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . 0.517 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.5 m-20 -87.86 -11.32 48.14 Favored 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 118.981 -1.088 . . . . 0.0 111.377 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . 0.517 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 2.5 t70 81.19 24.69 0.27 Allowed 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 120.319 -0.552 . . . . 0.0 110.773 179.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . 0.478 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 1.7 mm? -95.7 -22.15 17.73 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.821 0.82 . . . . 0.0 109.828 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . 0.425 ' O ' HD13 ' R' ' 39' ' ' LEU . 37.9 p-80 -52.82 -18.26 1.79 Allowed 'General case' 0 C--N 1.295 -1.804 0 CA-C-N 114.227 -1.352 . . . . 0.0 113.068 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.474 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 5.5 mt -78.82 -65.69 0.31 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 118.503 -1.279 . . . . 0.0 111.704 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.474 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.1 Cg_endo -50.93 -28.13 23.0 Favored 'Trans proline' 0 C--N 1.32 -0.934 0 C-N-CA 120.541 0.828 . . . . 0.0 110.227 179.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . 0.508 ' O ' ' SD ' ' R' ' 42' ' ' MET . 7.2 mt -82.54 -34.83 27.72 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 119.354 -0.939 . . . . 0.0 111.482 179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -58.14 -26.36 62.58 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.775 179.755 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -88.87 15.28 8.67 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 118.825 -1.15 . . . . 0.0 109.204 179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . 0.55 HD23 HH21 ' S' ' 54' ' ' ARG . 1.8 tp -114.2 -63.6 1.43 Allowed 'General case' 0 N--CA 1.494 1.757 0 CA-C-N 115.376 -0.829 . . . . 0.0 113.007 -179.691 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' R' ' 38' ' ' LEU . 0.6 OUTLIER -62.56 7.46 0.07 Allowed 'General case' 0 N--CA 1.5 2.032 0 C-N-CA 117.443 -1.703 . . . . 0.0 112.253 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' R' ' 41' ' ' LEU . 2.3 pp -150.95 -177.25 5.9 Favored 'General case' 0 N--CA 1.505 2.283 0 C-N-CA 119.598 -0.841 . . . . 0.0 110.389 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.6 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.312 0.3 OUTLIER -119.04 -150.82 0.01 OUTLIER Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.327 -179.846 . . . . . . . . 4 4 . 1 . 005 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.6 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.6 Cg_endo -93.37 -42.69 0.03 OUTLIER 'Trans proline' 0 C--O 1.213 -0.745 0 CA-C-N 119.228 0.76 . . . . 0.0 110.614 179.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -53.35 -21.98 6.64 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.001 -1.08 . . . . 0.0 109.391 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.5 ' HG3' ' H ' ' R' ' 44' ' ' THR . 2.3 mt-10 -76.71 -41.89 43.48 Favored 'General case' 0 C--N 1.303 -1.451 0 CA-C-N 115.17 -0.923 . . . . 0.0 110.018 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.4 ttp180 -62.63 -30.43 71.35 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.635 -0.711 . . . . 0.0 109.63 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 17.7 mt-10 -73.6 -62.97 1.3 Allowed 'General case' 0 N--CA 1.486 1.349 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.915 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.489 ' C ' HH21 ' R' ' 54' ' ' ARG . . . -52.73 -31.37 37.52 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.574 179.853 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.0 mt -56.36 -61.27 2.52 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 119.446 -0.902 . . . . 0.0 109.97 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.28 -53.37 9.47 Favored Glycine 0 N--CA 1.484 1.843 0 C-N-CA 119.119 -1.515 . . . . 0.0 110.009 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.48 ' O ' HG22 ' R' ' 57' ' ' ILE . 0.1 OUTLIER -39.71 -80.1 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 C-N-CA 120.415 -0.514 . . . . 0.0 111.559 179.918 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.489 HH21 ' C ' ' R' ' 50' ' ' ALA . 20.7 mtt180 -38.11 -53.74 1.39 Allowed 'General case' 0 N--CA 1.495 1.799 0 CA-C-N 115.224 -0.898 . . . . 0.0 112.51 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 5.8 t -63.21 -31.18 51.77 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.75 0 C-N-CA 118.76 -1.176 . . . . 0.0 111.95 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 1.1 ptm180 -78.67 -33.59 46.94 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 118.161 -1.416 . . . . 0.0 111.468 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 0.798 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -82.67 -34.99 12.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 C-N-CA 117.754 -1.578 . . . . 0.0 108.264 -179.999 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 0.798 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.6 t -59.61 -53.49 47.65 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.412 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.419 179.673 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.471 ' O ' ' N ' ' R' ' 63' ' ' ARG . 27.2 mt-10 -58.65 -46.84 86.26 Favored 'General case' 0 C--N 1.307 -1.259 0 C-N-CA 119.503 -0.879 . . . . 0.0 110.012 179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -48.36 -31.1 5.65 Favored 'General case' 0 C--N 1.307 -1.282 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.768 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . 0.412 HD23 ' O ' ' R' ' 66' ' ' MET . 96.3 mt -96.92 -24.68 15.73 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.529 -0.868 . . . . 0.0 111.189 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.1 tp -97.06 -0.51 47.07 Favored 'General case' 0 N--CA 1.489 1.524 0 C-N-CA 119.365 -0.934 . . . . 0.0 111.484 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . 0.471 ' N ' ' O ' ' R' ' 59' ' ' GLU . 14.6 tpp180 -63.83 -71.43 0.17 Allowed 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 118.654 -1.219 . . . . 0.0 109.017 179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -127.73 -68.71 0.15 Allowed Glycine 0 N--CA 1.49 2.274 0 N-CA-C 109.268 -1.533 . . . . 0.0 109.268 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.502 ' O ' ' C ' ' R' ' 66' ' ' MET . 31.5 mt-10 -153.39 -48.02 0.09 Allowed 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 120.166 -0.614 . . . . 0.0 109.839 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . 0.502 ' C ' ' O ' ' R' ' 65' ' ' GLU . 0.0 OUTLIER -8.21 111.23 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 O-C-N 124.771 1.294 . . . . 0.0 113.514 179.986 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 97.5 p -154.59 60.39 0.68 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.377 -0.929 . . . . 0.0 111.044 179.795 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . 0.531 ' C ' ' H ' ' R' ' 70' ' ' GLU . 2.9 mt-30 -130.41 -43.56 1.15 Allowed 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 120.039 -0.665 . . . . 0.0 110.486 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.15 31.5 0.07 Allowed 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 120.079 -0.649 . . . . 0.0 110.901 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . 0.531 ' H ' ' C ' ' R' ' 68' ' ' GLN . 0.2 OUTLIER -89.03 10.2 22.48 Favored 'General case' 0 C--N 1.298 -1.633 0 CA-C-N 115.321 -0.854 . . . . 0.0 110.893 -179.866 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mt -51.37 176.87 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.211 -0.996 . . . . 0.0 110.666 -179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 1.7 tttm -118.66 118.4 31.54 Favored 'General case' 0 N--CA 1.49 1.537 0 CA-C-N 115.661 -0.699 . . . . 0.0 109.961 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 35.7 m-20 -101.24 -107.07 0.23 Allowed 'General case' 0 C--N 1.309 -1.176 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.335 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 31.7 mt-10 -153.73 -61.57 0.14 Allowed 'General case' 0 C--N 1.28 -2.443 0 CA-C-N 114.513 -1.221 . . . . 0.0 109.881 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . . . . . . . . . 46.5 mt -85.72 -24.27 27.02 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.308 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -47.3 -71.56 0.53 Allowed Glycine 0 N--CA 1.489 2.175 0 C-N-CA 119.637 -1.268 . . . . 0.0 110.642 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -150.53 -101.44 0.07 Allowed 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 119.169 -1.012 . . . . 0.0 110.794 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -178.66 155.46 16.52 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 119.221 -1.466 . . . . 0.0 110.723 -179.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.794 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -46.74 -47.67 7.63 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.289 0 C-N-CA 120.287 -0.565 . . . . 0.0 111.466 -179.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.423 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -59.83 -62.15 2.09 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 118.768 -1.173 . . . . 0.0 110.637 -179.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 43.9 m -39.23 -47.76 1.7 Allowed 'General case' 0 C--N 1.296 -1.735 0 N-CA-C 113.547 0.943 . . . . 0.0 113.547 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 4.6 pt -77.32 -13.11 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.862 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -179.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.48 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -87.72 -58.94 2.39 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.607 -1.237 . . . . 0.0 112.099 -179.985 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.633 ' NE ' ' CD1' ' R' ' 1' ' ' TRP . 0.0 OUTLIER -65.92 6.6 0.35 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.362 -179.887 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . 0.482 ' HA3' HD11 ' R' ' 57' ' ' ILE . . . -102.51 -33.82 4.35 Favored Glycine 0 N--CA 1.492 2.378 0 C-N-CA 119.69 -1.243 . . . . 0.0 110.412 -179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 1.5 t -83.07 -30.59 27.9 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.477 -179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -93.63 8.42 40.94 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 119.12 -1.032 . . . . 0.0 110.956 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -46.41 -27.26 1.02 Allowed 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.531 -0.867 . . . . 0.0 111.29 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 90.2 mt -44.11 -28.09 0.46 Allowed 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.395 -0.922 . . . . 0.0 110.202 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . 0.409 ' O ' ' C ' ' R' ' 91' ' ' ALA . 18.3 mttt -80.9 -71.45 0.47 Allowed 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.309 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -36.72 -63.18 0.43 Allowed 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.163 -1.38 . . . . 0.0 111.959 -179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -40.72 109.06 0.59 Allowed Pre-proline 0 N--CA 1.488 1.438 0 C-N-CA 119.897 -0.721 . . . . 0.0 110.915 179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -55.92 156.41 19.68 Favored 'Trans proline' 0 C--O 1.215 -0.629 0 C-N-CA 120.667 0.911 . . . . 0.0 111.83 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.5 -41.41 90.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 C-N-CA 119.546 -0.862 . . . . 0.0 111.38 179.951 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.8 mt-10 -66.44 -27.93 68.2 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.078 -1.049 . . . . 0.0 110.803 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -59.68 -39.05 83.24 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.545 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.76 -27.83 63.39 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.467 -179.891 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -75.31 -22.37 57.74 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.104 -1.039 . . . . 0.0 109.96 179.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.699 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 2.9 t90 -95.56 -66.48 0.91 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.909 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.509 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.2 mm? -41.16 -38.01 1.0 Allowed 'General case' 0 C--N 1.308 -1.217 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.509 ' C ' ' O ' ' R' ' 100' ' ' LEU . 7.3 mt-10 -41.31 -39.16 1.33 Allowed 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 117.874 -1.53 . . . . 0.0 107.702 179.894 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.403 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.1 mt-10 -90.01 -27.63 19.63 Favored 'General case' 0 C--N 1.3 -1.554 0 CA-C-N 113.428 -1.715 . . . . 0.0 112.427 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.699 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.3 t -89.05 -7.94 10.87 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.466 0 C-N-CA 117.361 -1.736 . . . . 0.0 110.746 -179.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 8.6 tp -97.93 -54.03 3.21 Favored 'General case' 0 C--N 1.306 -1.319 0 C-N-CA 120.341 -0.543 . . . . 0.0 110.507 179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -69.28 -68.3 0.41 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 118.76 -1.176 . . . . 0.0 110.765 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 2.7 tttp -48.68 -23.93 1.2 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.91 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 19.5 t . . . . . 0 C--N 1.306 -1.319 0 CA-C-O 116.357 -1.782 . . . . 0.0 110.785 -179.974 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 . . . . . 0 N--CA 1.486 1.341 0 N-CA-C 110.035 -0.357 . . . . 0.0 110.035 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.44 164.0 0.53 Allowed Pre-proline 0 N--CA 1.487 1.386 0 C-N-CA 119.393 -0.923 . . . . 0.0 110.479 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -60.04 -20.86 62.84 Favored 'Trans proline' 0 C--N 1.317 -1.12 0 C-N-CA 121.129 1.219 . . . . 0.0 110.452 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.62 145.9 55.48 Favored 'General case' 0 C--N 1.304 -1.37 0 CA-C-N 115.467 -0.788 . . . . 0.0 111.16 -179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . 0.516 ' O ' ' HB2' ' S' ' 9' ' ' ALA . 74.4 m -103.62 -107.4 0.27 Allowed 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 119.772 -0.771 . . . . 0.0 110.606 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . 0.516 ' HB2' ' O ' ' S' ' 8' ' ' SER . . . 174.49 139.33 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.197 -1.001 . . . . 0.0 111.202 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.57 105.2 2.16 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.543 -0.863 . . . . 0.0 110.68 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . 0.461 ' CG ' ' O ' ' S' ' 11' ' ' MET . 3.2 ptp -57.12 98.55 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.329 0 C-N-CA 119.042 -1.063 . . . . 0.0 110.404 179.965 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -143.19 -54.73 0.39 Allowed 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 119.487 -0.885 . . . . 0.0 110.717 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -79.29 -10.1 59.74 Favored 'General case' 0 C--N 1.302 -1.485 0 C-N-CA 119.089 -1.044 . . . . 0.0 110.453 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -85.99 100.16 11.95 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 119.071 -1.052 . . . . 0.0 109.766 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.97 120.46 5.38 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 118.887 -1.125 . . . . 0.0 110.392 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -160.23 -25.17 0.06 Allowed 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.326 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.429 ' O ' ' C ' ' S' ' 18' ' ' GLU . 0.3 OUTLIER -85.53 -69.57 0.65 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.151 -1.02 . . . . 0.0 109.693 179.896 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.429 ' C ' ' O ' ' S' ' 17' ' ' GLN . 3.3 mp0 -43.55 -41.39 4.47 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 123.133 1.444 . . . . 0.0 107.862 179.794 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.265 42.3 t-105 -52.73 -53.72 43.79 Favored 'General case' 0 C--N 1.297 -1.717 0 CA-C-N 111.958 -2.383 . . . . 0.0 108.899 179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 9.4 tp -57.11 -37.54 72.11 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 113.8 -1.545 . . . . 0.0 110.759 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.507 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.6 mmt180 -51.0 -70.75 0.08 Allowed 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 118.283 -1.367 . . . . 0.0 109.28 -179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.507 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.53 -42.93 0.06 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 119.59 -0.844 . . . . 0.0 111.333 179.724 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 3.6 t -81.6 -33.15 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 C-N-CA 119.707 -0.797 . . . . 0.0 112.119 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.498 ' N ' ' O ' ' S' ' 21' ' ' ARG . 55.6 t0 -53.42 -34.64 58.58 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 120.075 -0.65 . . . . 0.0 112.273 -179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -94.96 -44.55 7.65 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.203 -0.999 . . . . 0.0 111.664 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.73 HD21 HD22 ' S' ' 39' ' ' LEU . 0.1 OUTLIER -45.01 -49.5 11.27 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.198 -1.001 . . . . 0.0 112.298 -179.799 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -49.95 -71.18 0.07 Allowed 'General case' 0 C--N 1.299 -1.592 0 C-N-CA 119.37 -0.932 . . . . 0.0 112.743 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -61.19 -5.86 1.76 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 119.791 -0.764 . . . . 0.0 113.054 -179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -94.55 -46.16 7.09 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 118.927 -1.109 . . . . 0.0 111.712 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -45.71 -52.5 10.84 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.344 -0.942 . . . . 0.0 111.618 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -42.0 -30.72 0.29 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.849 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.43 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 56.5 m-20 -99.5 -84.72 0.41 Allowed 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 119.625 -0.83 . . . . 0.0 110.658 179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.553 ' H ' HD22 ' S' ' 34' ' ' LEU . 0.5 OUTLIER 170.95 23.43 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.802 0 C-N-CA 119.253 -0.979 . . . . 0.0 112.151 -179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . 0.848 HD22 ' N ' ' S' ' 34' ' ' LEU . 1.3 mm? -94.43 -14.63 25.03 Favored 'General case' 0 N--CA 1.493 1.678 0 C-N-CA 119.0 -1.08 . . . . 0.0 109.856 179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . 0.688 ' O ' HD23 ' S' ' 39' ' ' LEU . 38.4 p-80 -48.76 -28.56 3.72 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.735 -179.874 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.453 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.8 mt -72.74 -63.33 1.14 Allowed Pre-proline 0 C--N 1.303 -1.439 0 C-N-CA 118.285 -1.366 . . . . 0.0 111.419 -179.811 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.453 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -52.28 -21.62 13.75 Favored 'Trans proline' 0 C--N 1.321 -0.882 0 C-N-CA 121.088 1.192 . . . . 0.0 111.376 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 23.5 mt -86.12 -44.51 12.18 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.299 -0.96 . . . . 0.0 110.534 179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.73 HD22 HD21 ' S' ' 26' ' ' LEU . 0.9 OUTLIER -49.39 -45.55 46.25 Favored 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.12 -1.032 . . . . 0.0 109.858 179.77 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . 0.542 ' O ' ' N ' ' R' ' 1' ' ' TRP . 1.0 OUTLIER -60.87 -4.0 0.89 Allowed 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 115.367 -0.833 . . . . 0.0 112.618 -179.959 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 mp -103.66 -59.25 1.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.47 -0.892 . . . . 0.0 112.091 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . 0.48 ' N ' ' SD ' ' S' ' 42' ' ' MET . 0.0 OUTLIER -95.64 22.66 6.9 Favored 'General case' 0 N--CA 1.499 1.979 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.586 -179.805 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . 0.476 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.1 OUTLIER -169.39 123.85 0.81 Allowed 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -179.904 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.586 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.75 -41.54 0.0 OUTLIER Pre-proline 0 N--CA 1.484 1.261 0 C-N-CA 117.084 -1.846 . . . . 0.0 114.855 179.989 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.586 ' HD2' ' H ' ' S' ' 44' ' ' THR . 19.1 Cg_endo -79.43 -109.22 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.219 0 C-N-CA 121.12 1.213 . . . . 0.0 113.196 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . 0.444 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 2.3 m-20 -50.66 -12.8 0.11 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.52 -0.872 . . . . 0.0 110.488 -179.781 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . 0.473 ' N ' ' C ' ' S' ' 45' ' ' PRO . 8.9 mm-40 -75.94 -71.82 0.36 Allowed 'General case' 0 C--N 1.297 -1.676 0 C-N-CA 119.544 -0.862 . . . . 0.0 110.582 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -49.55 -15.43 0.16 Allowed 'General case' 0 C--N 1.292 -1.896 0 CA-C-N 115.152 -0.931 . . . . 0.0 110.894 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' C ' ' S' ' 47' ' ' GLU . 9.8 mm-40 -91.45 -69.11 0.75 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.433 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.04 -27.69 69.28 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 118.973 -1.091 . . . . 0.0 111.211 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 2.1 tt -61.54 -63.59 1.22 Allowed 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.856 -0.738 . . . . 0.0 110.629 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . 0.436 ' O ' ' OE1' ' R' ' 18' ' ' GLU . . . -45.72 -48.15 13.05 Favored Glycine 0 N--CA 1.486 1.994 0 N-CA-C 109.013 -1.635 . . . . 0.0 109.013 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.509 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.2 OUTLIER -45.43 -74.54 0.03 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 CA-C-O 121.616 0.722 . . . . 0.0 111.86 179.862 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.55 HH21 HD23 ' R' ' 41' ' ' LEU . 0.0 OUTLIER -35.24 -58.99 0.54 Allowed 'General case' 0 C--N 1.296 -1.739 0 CA-C-N 114.71 -1.132 . . . . 0.0 112.873 179.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 16.1 t -59.62 -25.28 31.23 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 C-N-CA 117.465 -1.694 . . . . 0.0 110.971 -179.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.509 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -79.3 -38.72 34.63 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.296 -1.362 . . . . 0.0 111.443 -179.97 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 0.751 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -79.08 -34.65 16.79 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 C-N-CA 117.801 -1.56 . . . . 0.0 108.827 -179.843 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . 0.751 ' N ' HD13 ' S' ' 57' ' ' ILE . 78.1 t -68.68 -63.11 1.01 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 C-N-CA 118.267 -1.373 . . . . 0.0 110.183 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 13.2 tt0 -50.19 -31.14 13.02 Favored 'General case' 0 C--N 1.301 -1.51 0 C-N-CA 118.412 -1.315 . . . . 0.0 110.193 179.93 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . 0.415 ' CG ' ' O ' ' S' ' 56' ' ' ARG . 7.7 mm-40 -62.12 -62.68 1.61 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.551 -0.86 . . . . 0.0 112.089 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . 0.501 ' C ' HD12 ' S' ' 61' ' ' LEU . 4.6 pp -62.45 -8.63 6.46 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 117.738 -1.585 . . . . 0.0 109.716 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . 0.598 ' O ' ' N ' ' S' ' 64' ' ' GLY . 2.3 tp -79.97 33.02 0.27 Allowed 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.525 -0.87 . . . . 0.0 109.717 179.823 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . 0.488 ' H ' ' C ' ' S' ' 61' ' ' LEU . 19.7 mtm180 22.64 35.87 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.979 0 O-C-N 124.555 1.16 . . . . 0.0 113.736 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.598 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -96.28 -30.06 8.02 Favored Glycine 0 N--CA 1.489 2.223 0 N-CA-C 109.254 -1.538 . . . . 0.0 109.254 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -119.52 -73.23 0.65 Allowed 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 120.344 -0.542 . . . . 0.0 110.563 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . 0.449 ' O ' ' CB ' ' S' ' 67' ' ' SER . 1.5 mmt -121.27 -134.55 0.31 Allowed 'General case' 0 N--CA 1.491 1.594 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.453 179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . 0.546 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.3 OUTLIER 165.08 -64.41 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 119.941 -0.704 . . . . 0.0 109.671 -179.992 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.513 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.9 OUTLIER -29.61 -33.65 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.74 179.745 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . 0.546 ' N ' ' O ' ' S' ' 67' ' ' SER . 1.6 tpt180 -70.75 33.14 0.04 OUTLIER 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 120.212 -0.595 . . . . 0.0 112.025 -179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.513 ' H ' ' C ' ' S' ' 68' ' ' GLN . 5.0 tt0 -81.24 -21.09 39.72 Favored 'General case' 0 C--N 1.299 -1.594 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.459 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 10.7 mt -83.07 140.82 32.45 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.156 -1.017 . . . . 0.0 111.13 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.58 126.93 27.43 Favored 'General case' 0 N--CA 1.489 1.492 0 CA-C-N 115.591 -0.731 . . . . 0.0 111.249 -179.971 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -99.2 -103.13 0.22 Allowed 'General case' 0 C--N 1.306 -1.305 0 CA-C-O 121.83 0.824 . . . . 0.0 110.839 179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 26.8 mt-10 -140.61 -56.97 0.52 Allowed 'General case' 0 C--N 1.283 -2.3 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.139 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 tp -121.01 13.37 11.32 Favored 'General case' 0 N--CA 1.491 1.608 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.25 -55.83 27.98 Favored Glycine 0 N--CA 1.492 2.416 0 C-N-CA 119.816 -1.183 . . . . 0.0 110.996 179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -163.71 -68.98 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 118.984 -1.087 . . . . 0.0 111.225 -179.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . 0.419 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . 149.38 131.18 1.93 Allowed Glycine 0 N--CA 1.488 2.134 0 C-N-CA 119.372 -1.394 . . . . 0.0 110.371 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.901 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.78 -36.0 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.233 0 C-N-CA 120.539 -0.464 . . . . 0.0 111.237 -179.981 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -68.91 -44.26 73.52 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.583 -0.847 . . . . 0.0 112.314 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.448 HG22 ' HE1' ' R' ' 109' ' ' TRP . 25.3 p -62.54 -40.9 98.29 Favored 'General case' 0 C--N 1.303 -1.431 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -179.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 23.0 pt -73.35 -15.07 16.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 C-N-CA 119.344 -0.943 . . . . 0.0 112.758 -179.756 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.434 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -81.51 -57.21 3.57 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.492 -1.283 . . . . 0.0 111.391 -179.991 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.4 ptm85 -68.68 -4.55 16.11 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.008 -1.077 . . . . 0.0 110.747 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -78.86 -25.55 60.0 Favored Glycine 0 N--CA 1.488 2.104 0 C-N-CA 119.321 -1.418 . . . . 0.0 110.124 -179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 41.8 p -105.94 -34.91 7.46 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.058 -0.657 . . . . 0.0 110.657 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . 0.48 ' O ' ' N ' ' S' ' 89' ' ' LEU . 24.3 m120 -77.0 12.99 1.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.909 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -38.71 -26.02 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.455 0 CA-C-N 115.506 -0.77 . . . . 0.0 112.294 -179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . 0.48 ' N ' ' O ' ' S' ' 87' ' ' ASN . 1.0 OUTLIER -42.02 -66.37 0.36 Allowed 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.442 -0.903 . . . . 0.0 111.646 179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -80.49 -62.09 1.78 Allowed 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 118.687 -1.205 . . . . 0.0 111.669 -179.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.35 -70.85 0.09 Allowed 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.588 -1.187 . . . . 0.0 112.168 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . -72.64 148.54 90.19 Favored Pre-proline 0 N--CA 1.489 1.498 0 C-N-CA 119.032 -1.067 . . . . 0.0 110.908 -179.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -55.0 159.54 9.38 Favored 'Trans proline' 0 C--N 1.325 -0.667 0 C-N-CA 121.066 1.177 . . . . 0.0 110.996 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 94.7 t -83.24 -32.96 9.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 C-N-CA 118.981 -1.088 . . . . 0.0 110.917 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -67.46 -20.95 65.55 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.648 -0.821 . . . . 0.0 111.05 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 1.2 tp -62.02 -36.35 81.29 Favored 'General case' 0 C--N 1.303 -1.448 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.576 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -16.29 38.75 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.256 179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -101.49 -35.47 9.16 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 115.619 -0.719 . . . . 0.0 111.234 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.625 ' CH2' HG21 ' S' ' 103' ' ' VAL . 19.6 t90 -66.6 -62.29 1.53 Allowed 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 119.38 -0.928 . . . . 0.0 111.911 -179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.529 ' O ' ' C ' ' S' ' 101' ' ' GLU . 0.6 OUTLIER -57.07 -32.57 66.39 Favored 'General case' 0 C--N 1.294 -1.837 0 N-CA-C 114.247 1.202 . . . . 0.0 114.247 -179.711 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.529 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.9 mm-40 -42.77 -29.65 0.33 Allowed 'General case' 0 C--N 1.298 -1.661 0 C-N-CA 117.692 -1.603 . . . . 0.0 106.746 179.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . 0.528 ' N ' ' C ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -94.99 -26.41 16.11 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 112.987 -1.915 . . . . 0.0 112.157 179.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.625 HG21 ' CH2' ' S' ' 99' ' ' TRP . 14.0 t -83.28 -14.83 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.5 0 C-N-CA 115.964 -2.294 . . . . 0.0 108.102 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . 0.404 ' HA ' HD12 ' S' ' 104' ' ' LEU . 19.9 tp -83.56 -53.48 5.64 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 114.358 -1.292 . . . . 0.0 109.203 179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 86.4 mt -77.8 -80.03 0.11 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 118.956 -1.098 . . . . 0.0 110.918 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . 0.469 ' O ' ' O ' ' S' ' 102' ' ' GLU . 16.2 mtpt -95.51 -160.05 0.76 Allowed 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.473 -0.891 . . . . 0.0 111.166 -179.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' S' ' 102' ' ' GLU . 65.5 p . . . . . 0 N--CA 1.491 1.59 0 CA-C-O 116.445 -1.74 . . . . 0.0 111.533 179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.633 ' CD1' ' NE ' ' R' ' 84' ' ' ARG . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.288 0 CA-C-O 116.255 -1.831 . . . . 0.0 110.296 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.467 ' HB3' HG23 ' R' ' 44' ' ' THR . 1.1 m-90 . . . . . 0 N--CA 1.483 1.223 0 CA-C-O 116.351 -1.785 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 . . . . . 0 N--CA 1.486 1.335 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . 0.568 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.0 OUTLIER -84.96 -43.44 0.68 Allowed Pre-proline 0 C--N 1.306 -1.316 0 C-N-CA 119.293 -0.963 . . . . 0.0 112.41 -179.934 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . 0.568 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.0 OUTLIER -70.26 117.3 5.04 Favored 'Trans proline' 0 C--N 1.32 -0.972 0 C-N-CA 121.027 1.151 . . . . 0.0 111.414 -179.827 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.61 123.8 36.17 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 119.181 -1.008 . . . . 0.0 110.755 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 1.1 p -157.4 76.68 0.83 Allowed 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 119.586 -0.846 . . . . 0.0 110.728 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -83.76 -168.97 2.34 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.364 -0.935 . . . . 0.0 110.882 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.94 143.37 32.22 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.988 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -114.18 165.92 12.16 Favored 'General case' 0 N--CA 1.485 1.316 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.423 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -81.91 139.62 34.54 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.967 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -132.17 13.29 4.68 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 119.964 -0.694 . . . . 0.0 110.405 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 17.7 mm100 51.84 91.5 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.776 -0.77 . . . . 0.0 111.433 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -84.11 95.0 8.47 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.152 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . 0.464 ' O ' ' CG ' ' R' ' 16' ' ' HIS . 22.1 t-80 -111.62 6.74 20.18 Favored 'General case' 0 N--CA 1.49 1.571 0 CA-C-N 115.663 -0.698 . . . . 0.0 111.6 -179.807 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' R' ' 18' ' ' GLU . 1.0 OUTLIER -91.05 -80.19 0.35 Allowed 'General case' 0 N--CA 1.495 1.824 0 C-N-CA 119.358 -0.937 . . . . 0.0 111.36 -179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.0 OUTLIER -44.33 -35.06 2.18 Favored 'General case' 0 N--CA 1.494 1.756 0 CA-C-O 123.231 1.491 . . . . 0.0 107.824 179.858 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 28.1 t-105 -52.69 -61.34 2.35 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-N 112.33 -2.214 . . . . 0.0 109.16 179.687 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -47.11 -44.4 21.37 Favored 'General case' 0 C--N 1.293 -1.889 0 CA-C-N 114.211 -1.359 . . . . 0.0 111.459 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.551 ' O ' ' C ' ' R' ' 22' ' ' PHE . 1.0 OUTLIER -47.77 -73.1 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 118.645 -1.222 . . . . 0.0 109.639 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.551 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -25.45 -47.83 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 120.269 -0.572 . . . . 0.0 111.156 179.666 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . 0.435 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.5 t -71.14 -53.32 21.76 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 118.956 -1.097 . . . . 0.0 111.478 179.778 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 32.9 t0 -35.68 -65.19 0.26 Allowed 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 120.175 -0.61 . . . . 0.0 111.647 -179.773 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 2.7 mt -54.11 -48.43 70.75 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.13 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -51.37 -46.44 62.76 Favored 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 119.615 -0.834 . . . . 0.0 112.545 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 47.8 tttm -61.6 -45.0 95.96 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 114.214 1.19 . . . . 0.0 114.214 -179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 37.3 m-20 -74.73 -36.02 62.66 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 114.309 1.225 . . . . 0.0 114.309 -179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.473 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -70.25 -29.26 66.02 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 118.622 -1.231 . . . . 0.0 113.077 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . 0.429 ' CD2' ' N ' ' R' ' 31' ' ' GLN . 23.7 t80 -42.01 -60.25 1.48 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.005 -179.891 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . 0.429 ' N ' ' CD2' ' R' ' 30' ' ' TYR . 1.8 tt0 -60.43 -28.84 68.6 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.084 -1.046 . . . . 0.0 110.703 -179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . 0.436 ' OD1' ' NE1' ' S' ' 99' ' ' TRP . 0.2 OUTLIER -80.78 -15.86 55.32 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.392 -0.923 . . . . 0.0 110.534 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . 0.406 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 74.15 23.98 2.02 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.949 179.901 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -100.82 -10.52 20.65 Favored 'General case' 0 C--N 1.3 -1.569 0 CA-C-N 114.724 -1.125 . . . . 0.0 108.712 179.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 22.4 p-80 -53.77 -15.57 1.33 Allowed 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.306 -1.315 . . . . 0.0 113.225 -179.73 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -77.75 -65.4 0.36 Allowed Pre-proline 0 N--CA 1.484 1.25 0 C-N-CA 117.544 -1.663 . . . . 0.0 110.662 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.8 Cg_exo -50.19 -31.76 29.99 Favored 'Trans proline' 0 C--N 1.321 -0.889 0 N-CA-C 109.686 -0.929 . . . . 0.0 109.686 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 5.6 mt -73.39 -40.41 64.35 Favored 'General case' 0 N--CA 1.484 1.266 0 CA-C-N 115.061 -0.972 . . . . 0.0 110.443 179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.477 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -60.01 -22.5 62.68 Favored 'General case' 0 N--CA 1.487 1.406 0 CA-C-N 115.619 -0.719 . . . . 0.0 109.205 179.976 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -91.53 11.48 23.98 Favored 'General case' 0 C--N 1.299 -1.628 0 C-N-CA 119.258 -0.977 . . . . 0.0 109.513 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -115.19 -64.22 1.35 Allowed 'General case' 0 N--CA 1.494 1.767 0 CA-C-N 115.318 -0.855 . . . . 0.0 112.933 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . 0.489 ' SD ' ' O ' ' R' ' 22' ' ' PHE . 3.4 ptp -73.71 8.96 1.62 Allowed 'General case' 0 N--CA 1.496 1.85 0 C-N-CA 117.369 -1.732 . . . . 0.0 112.246 -179.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 65.5 mt -128.77 -174.07 3.15 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 179.518 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.647 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.306 0.3 OUTLIER -134.97 -145.12 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.191 0 C-N-CA 119.093 -1.043 . . . . 0.0 109.305 179.908 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.647 ' HD3' HG22 ' R' ' 44' ' ' THR . 10.2 Cg_endo -98.62 -43.41 0.02 OUTLIER 'Trans proline' 0 N--CA 1.477 0.554 0 CA-C-N 120.614 1.255 . . . . 0.0 111.16 179.481 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -54.53 -27.45 38.51 Favored 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 119.313 -0.955 . . . . 0.0 110.208 180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.417 ' CG ' ' H ' ' R' ' 44' ' ' THR . 5.1 mm-40 -61.56 -49.8 75.19 Favored 'General case' 0 C--N 1.304 -1.371 0 C-N-CA 119.043 -1.063 . . . . 0.0 109.983 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.98 -34.72 66.01 Favored 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.444 -0.902 . . . . 0.0 109.927 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 29.2 mt-10 -75.56 -71.46 0.37 Allowed 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.127 -1.029 . . . . 0.0 112.521 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.445 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.88 -46.49 51.7 Favored 'General case' 0 N--CA 1.495 1.806 0 C-N-CA 119.66 -0.816 . . . . 0.0 112.304 -179.847 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 3.2 tt -52.68 -45.09 66.65 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.542 -0.863 . . . . 0.0 110.776 -179.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.74 -42.04 97.79 Favored Glycine 0 N--CA 1.488 2.128 0 C-N-CA 118.91 -1.614 . . . . 0.0 109.302 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.5 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.3 OUTLIER -49.55 -78.91 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 114.835 -0.682 . . . . 0.0 112.022 179.993 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.1 -37.06 0.8 Allowed 'General case' 0 N--CA 1.498 1.942 0 C-N-CA 119.774 -0.77 . . . . 0.0 111.088 179.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 33.3 t -72.31 -34.24 48.55 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.8 0 C-N-CA 118.593 -1.243 . . . . 0.0 110.227 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.5 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.1 OUTLIER -73.42 -38.31 65.6 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.304 -0.958 . . . . 0.0 111.553 -179.937 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 0.994 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -77.19 -39.86 29.16 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 C-N-CA 117.577 -1.649 . . . . 0.0 109.631 -179.798 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 0.994 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.2 t -63.21 -68.76 0.25 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.482 0 C-N-CA 117.438 -1.705 . . . . 0.0 109.325 179.517 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.522 ' N ' HG12 ' R' ' 58' ' ' VAL . 16.7 tt0 -43.16 -36.27 1.65 Allowed 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.956 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -65.67 -54.32 29.07 Favored 'General case' 0 N--CA 1.494 1.751 0 C-N-CA 118.971 -1.091 . . . . 0.0 112.109 -179.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 34.7 mt -78.88 -6.31 55.8 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.439 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 5.1 tp -104.77 5.98 33.69 Favored 'General case' 0 N--CA 1.491 1.617 0 C-N-CA 119.621 -0.831 . . . . 0.0 110.981 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -80.84 -72.5 0.42 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.416 -0.914 . . . . 0.0 111.196 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -125.92 -69.16 0.18 Allowed Glycine 0 N--CA 1.494 2.528 0 N-CA-C 110.093 -1.203 . . . . 0.0 110.093 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.525 ' O ' ' C ' ' R' ' 66' ' ' MET . 80.2 mt-10 -151.85 -74.09 0.15 Allowed 'General case' 0 C--N 1.301 -1.504 0 C-N-CA 119.592 -0.843 . . . . 0.0 110.469 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . 0.525 ' C ' ' O ' ' R' ' 65' ' ' GLU . 20.2 mtp 7.35 97.23 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.142 0 O-C-N 124.732 1.27 . . . . 0.0 113.093 -179.903 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 4.2 p -143.3 60.37 1.4 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.767 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . 0.501 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.3 OUTLIER -126.67 -24.28 3.58 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.255 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -75.37 29.09 0.1 Allowed 'General case' 0 C--N 1.305 -1.345 0 C-N-CA 119.974 -0.69 . . . . 0.0 111.147 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . 0.501 ' H ' ' C ' ' R' ' 68' ' ' GLN . 12.6 mt-10 -86.16 19.27 2.73 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.436 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 16.7 mt -58.39 140.64 53.32 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.389 -179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 3.4 tttm -106.05 88.29 2.77 Favored 'General case' 0 C--N 1.304 -1.396 0 CA-C-N 115.273 -0.876 . . . . 0.0 109.997 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -79.33 -102.25 0.02 OUTLIER 'General case' 0 C--N 1.306 -1.292 0 CA-C-O 121.731 0.777 . . . . 0.0 112.121 -179.858 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 13.7 mt-10 -136.6 -65.99 0.54 Allowed 'General case' 0 C--N 1.282 -2.333 0 CA-C-N 114.142 -1.39 . . . . 0.0 110.965 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . . . . . . . . . 2.2 mt -103.51 5.51 36.87 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.825 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -50.97 -51.97 32.62 Favored Glycine 0 N--CA 1.489 2.192 0 C-N-CA 119.556 -1.307 . . . . 0.0 110.408 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -166.94 -95.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.145 -1.022 . . . . 0.0 111.102 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -175.16 131.99 2.08 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 119.43 -1.367 . . . . 0.0 110.295 -179.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.827 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -45.34 -44.54 3.62 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 119.685 -0.806 . . . . 0.0 110.258 -179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.41 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -64.9 -62.95 1.25 Allowed 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 118.797 -1.161 . . . . 0.0 109.678 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 23.0 m -33.85 -49.23 0.32 Allowed 'General case' 0 C--N 1.306 -1.298 0 CA-C-N 114.938 -1.028 . . . . 0.0 113.092 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . 0.438 HD13 HG21 ' R' ' 82' ' ' ILE . 30.3 pt -73.73 -34.85 42.06 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 C-N-CA 119.006 -1.078 . . . . 0.0 113.014 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.529 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.1 OUTLIER -55.55 -67.42 0.28 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 118.715 -1.194 . . . . 0.0 110.83 179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.27 -6.62 1.0 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.889 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -70.5 -48.42 36.7 Favored Glycine 0 N--CA 1.489 2.184 0 C-N-CA 119.414 -1.375 . . . . 0.0 110.3 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.68 -7.53 54.4 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.616 -0.834 . . . . 0.0 110.718 -179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . 0.529 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.2 OUTLIER -109.89 12.91 23.69 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.99 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -41.36 -23.89 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.767 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . 0.468 ' N ' ' O ' ' R' ' 87' ' ' ASN . 4.2 mt -50.85 -33.82 25.42 Favored 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.558 -0.857 . . . . 0.0 111.737 -179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -97.39 -19.26 18.59 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.631 -0.828 . . . . 0.0 111.264 179.948 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -54.46 -62.81 1.42 Allowed 'General case' 0 C--N 1.291 -1.942 0 C-N-CA 118.976 -1.09 . . . . 0.0 112.31 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.612 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -99.95 164.98 15.42 Favored Pre-proline 0 N--CA 1.493 1.708 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.305 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . 0.612 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 4.0 Cg_exo -58.83 171.87 1.86 Allowed 'Trans proline' 0 C--N 1.322 -0.851 0 C-N-CA 121.465 1.443 . . . . 0.0 111.611 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . 0.521 ' O ' HG12 ' R' ' 94' ' ' VAL . 75.3 t -82.11 -8.91 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 119.386 -0.926 . . . . 0.0 110.787 179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 53.7 mt-10 -65.37 -30.36 71.18 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.598 -0.841 . . . . 0.0 111.049 179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . 0.483 ' HG ' HD23 ' R' ' 100' ' ' LEU . 0.7 OUTLIER -60.71 -44.09 97.02 Favored 'General case' 0 N--CA 1.488 1.452 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.718 -179.946 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -47.53 -44.89 26.16 Favored 'General case' 0 C--N 1.302 -1.482 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.17 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -73.03 -24.22 60.7 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.337 -0.945 . . . . 0.0 111.348 -179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.587 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 3.6 t90 -92.04 -66.19 0.95 Allowed 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.158 179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.483 HD23 ' HG ' ' R' ' 96' ' ' LEU . 2.1 mm? -43.17 -28.07 0.27 Allowed 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 118.729 -1.188 . . . . 0.0 112.865 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.456 ' C ' ' O ' ' R' ' 100' ' ' LEU . 3.5 mt-10 -46.98 -38.81 11.31 Favored 'General case' 0 C--N 1.296 -1.727 0 C-N-CA 117.491 -1.684 . . . . 0.0 106.823 179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.475 ' O ' ' N ' ' R' ' 107' ' ' SER . 3.0 mt-10 -90.67 -30.9 16.85 Favored 'General case' 0 C--N 1.299 -1.619 0 CA-C-N 113.42 -1.718 . . . . 0.0 112.908 179.993 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.587 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.5 t -85.88 -12.37 11.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 C-N-CA 117.331 -1.747 . . . . 0.0 111.224 -179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . 0.413 HD12 ' HA ' ' R' ' 104' ' ' LEU . 18.8 tp -96.98 -55.3 2.91 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 120.083 -0.647 . . . . 0.0 110.625 179.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . 0.493 ' N ' HD22 ' R' ' 105' ' ' LEU . 4.0 mm? -72.49 -74.55 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.923 -1.111 . . . . 0.0 111.32 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . 0.438 ' O ' ' O ' ' R' ' 107' ' ' SER . 11.0 ttpt -72.22 -77.51 0.1 Allowed 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 119.513 -0.875 . . . . 0.0 110.955 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . 0.475 ' N ' ' O ' ' R' ' 102' ' ' GLU . 0.3 OUTLIER . . . . . 0 N--CA 1.488 1.427 0 CA-C-O 116.521 -1.704 . . . . 0.0 111.013 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 . . . . . 0 N--CA 1.485 1.306 0 CA-C-O 120.741 0.305 . . . . 0.0 110.2 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -78.24 165.53 49.65 Favored Pre-proline 0 N--CA 1.486 1.358 0 C-N-CA 119.171 -1.011 . . . . 0.0 110.34 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -56.87 -14.49 14.09 Favored 'Trans proline' 0 C--N 1.317 -1.107 0 C-N-CA 121.195 1.263 . . . . 0.0 110.529 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 1.9 m-85 -132.83 -172.14 2.84 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.093 -0.958 . . . . 0.0 109.787 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . 0.468 ' O ' ' N ' ' S' ' 10' ' ' ALA . 23.3 t -161.17 42.7 0.16 Allowed 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.014 -1.075 . . . . 0.0 110.945 179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -52.2 90.89 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.45 -0.9 . . . . 0.0 110.719 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . 0.468 ' N ' ' O ' ' S' ' 8' ' ' SER . . . -64.25 149.15 48.58 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.243 -0.983 . . . . 0.0 110.965 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 3.8 ptp -104.77 50.39 0.79 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.846 -0.742 . . . . 0.0 110.999 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.12 -37.74 88.43 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.775 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 29.6 tt0 -120.62 158.11 28.08 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.528 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . 0.508 HE21 ' C ' ' S' ' 14' ' ' GLN . 0.0 OUTLIER -164.76 108.06 0.88 Allowed 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 119.237 -0.985 . . . . 0.0 110.923 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.35 99.95 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.272 -0.971 . . . . 0.0 111.157 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . 0.401 ' H ' ' H ' ' S' ' 17' ' ' GLN . 0.3 OUTLIER -171.34 -4.07 0.01 OUTLIER 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.169 -1.049 . . . . 0.0 108.169 -179.99 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.422 ' O ' ' C ' ' S' ' 18' ' ' GLU . 8.7 tt0 -82.01 -86.01 0.1 Allowed 'General case' 0 N--CA 1.485 1.325 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.051 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.422 ' C ' ' O ' ' S' ' 17' ' ' GLN . 1.0 OUTLIER -40.43 -34.83 0.37 Allowed 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 122.648 1.213 . . . . 0.0 109.156 179.789 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 69.3 t-105 -51.26 -60.91 2.61 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 113.041 -1.891 . . . . 0.0 110.457 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -52.32 -31.97 35.75 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 114.303 -1.317 . . . . 0.0 111.645 179.976 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.506 ' O ' ' C ' ' S' ' 22' ' ' PHE . 11.7 mmm-85 -59.68 -71.56 0.12 Allowed 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 118.642 -1.223 . . . . 0.0 110.075 179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.506 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.1 t80 -32.74 -50.47 0.26 Allowed 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 119.341 -0.944 . . . . 0.0 111.096 179.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . . . . . . . . . 61.7 t -65.31 -44.81 94.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.427 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.419 ' O ' ' C ' ' S' ' 25' ' ' LEU . 25.7 t0 -48.14 -75.88 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.651 -0.82 . . . . 0.0 111.609 -179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.419 ' C ' ' O ' ' S' ' 24' ' ' ASP . 1.2 mt -39.91 -44.78 1.73 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.757 -0.777 . . . . 0.0 110.756 179.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.557 HD21 ' CD1' ' S' ' 39' ' ' LEU . 0.2 OUTLIER -54.41 -57.39 11.49 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.164 -1.014 . . . . 0.0 112.01 179.971 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.75 -49.86 0.8 Allowed 'General case' 0 N--CA 1.492 1.662 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -85.59 -32.62 21.99 Favored 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 118.922 -1.111 . . . . 0.0 113.355 -179.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . 0.463 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -66.75 -39.85 88.08 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 119.072 -1.051 . . . . 0.0 112.541 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -58.21 -38.32 76.54 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 118.93 -1.108 . . . . 0.0 112.028 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -53.0 -21.79 4.89 Favored 'General case' 0 C--N 1.302 -1.46 0 C-N-CA 118.712 -1.195 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.46 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 35.3 m120 -111.57 -76.27 0.6 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.976 -0.69 . . . . 0.0 111.829 -179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.46 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.0 OUTLIER 172.06 1.28 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 118.644 -1.222 . . . . 0.0 113.02 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . 0.978 HD22 ' H ' ' S' ' 34' ' ' LEU . 0.9 OUTLIER -75.01 -18.51 60.35 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 119.609 -0.836 . . . . 0.0 111.558 -179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 15.4 p-80 -51.12 -22.68 2.63 Favored 'General case' 0 C--N 1.293 -1.866 0 C-N-CA 119.494 -0.882 . . . . 0.0 112.746 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.467 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.4 mt -73.35 -64.03 0.89 Allowed Pre-proline 0 N--CA 1.486 1.338 0 C-N-CA 118.327 -1.349 . . . . 0.0 110.234 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.467 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 1.9 Cg_endo -53.45 -32.73 64.09 Favored 'Trans proline' 0 C--N 1.322 -0.864 0 C-N-CA 120.769 0.979 . . . . 0.0 110.455 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . 0.421 HD21 HD21 ' R' ' 96' ' ' LEU . 21.8 mt -74.12 -39.7 63.17 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.19 179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.557 ' CD1' HD21 ' S' ' 26' ' ' LEU . 0.2 OUTLIER -52.97 -44.2 66.98 Favored 'General case' 0 C--N 1.304 -1.379 0 C-N-CA 119.275 -0.97 . . . . 0.0 109.332 179.802 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . 0.462 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.1 OUTLIER -66.94 -0.92 3.44 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 111.536 -179.823 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 tp -105.32 -67.36 0.92 Allowed 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.623 -0.831 . . . . 0.0 112.964 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . 0.457 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 2.0 mmm -91.04 47.6 1.42 Allowed 'General case' 0 N--CA 1.501 2.09 0 C-N-CA 118.761 -1.175 . . . . 0.0 111.624 -179.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . 0.848 HD23 ' O ' ' S' ' 43' ' ' LEU . 0.3 OUTLIER 160.72 125.4 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 179.886 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.641 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -179.33 -41.86 0.0 OUTLIER Pre-proline 0 N--CA 1.487 1.376 0 C-N-CA 116.507 -2.077 . . . . 0.0 115.794 -179.694 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.641 ' HD2' ' H ' ' S' ' 44' ' ' THR . 5.5 Cg_endo -65.71 -110.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.138 0 C-N-CA 120.713 0.942 . . . . 0.0 113.343 -179.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . 0.483 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 0.2 OUTLIER -54.91 -12.14 0.76 Allowed 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 119.029 -1.068 . . . . 0.0 110.361 -179.735 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . 0.428 ' N ' ' C ' ' S' ' 45' ' ' PRO . 6.4 mm-40 -68.17 -64.39 0.87 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.607 179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 13.9 ttt180 -57.82 -33.45 68.62 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.255 -179.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -70.41 -63.12 1.15 Allowed 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 118.023 -1.471 . . . . 0.0 111.21 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.09 -37.52 83.01 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 119.19 -1.004 . . . . 0.0 111.336 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 mt -46.74 -57.57 4.72 Favored 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 118.64 -1.224 . . . . 0.0 109.293 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . 0.404 ' O ' ' C ' ' S' ' 53' ' ' THR . . . -52.2 -64.96 3.57 Favored Glycine 0 N--CA 1.484 1.852 0 N-CA-C 108.486 -1.846 . . . . 0.0 108.486 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.574 ' O ' HG22 ' S' ' 57' ' ' ILE . 0.2 OUTLIER -34.85 -73.74 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.678 0 CA-C-O 121.641 0.734 . . . . 0.0 112.78 179.906 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.486 ' CG ' ' CZ3' ' R' ' 109' ' ' TRP . 8.1 ttp85 -51.57 -46.11 63.31 Favored 'General case' 0 C--N 1.293 -1.884 0 CA-C-N 114.376 -1.284 . . . . 0.0 113.393 -179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 95.1 t -68.95 -19.08 23.61 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.882 0 C-N-CA 117.473 -1.691 . . . . 0.0 109.918 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.411 ' CD ' ' C ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -85.62 -37.06 19.93 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 118.542 -1.263 . . . . 0.0 110.804 -179.958 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 0.738 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -74.54 -38.38 45.83 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 117.429 -1.708 . . . . 0.0 107.902 179.942 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . 0.738 ' N ' HD13 ' S' ' 57' ' ' ILE . 0.9 OUTLIER -60.43 -50.95 78.29 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.371 0 C-N-CA 117.156 -1.817 . . . . 0.0 107.399 179.452 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . 0.446 ' N ' HG12 ' S' ' 58' ' ' VAL . 3.4 tt0 -51.7 -31.88 27.82 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.092 179.682 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -68.99 -57.58 5.28 Favored 'General case' 0 N--CA 1.494 1.73 0 C-N-CA 118.98 -1.088 . . . . 0.0 112.178 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . 0.646 ' C ' HD12 ' S' ' 61' ' ' LEU . 3.6 pp -61.43 -7.47 3.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 118.136 -1.425 . . . . 0.0 109.912 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . 0.611 ' O ' ' N ' ' S' ' 64' ' ' GLY . 7.0 tp -76.13 28.88 0.12 Allowed 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 119.494 -0.882 . . . . 0.0 110.586 179.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . 0.514 ' H ' ' C ' ' S' ' 61' ' ' LEU . 3.9 mtm180 19.37 40.03 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.075 0 O-C-N 124.361 1.038 . . . . 0.0 113.625 -179.764 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.611 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -108.43 -38.37 1.95 Allowed Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.895 -1.145 . . . . 0.0 110.262 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -112.02 -91.73 0.48 Allowed 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 120.031 -0.668 . . . . 0.0 111.176 -179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 5.0 tpp -108.66 -145.99 0.4 Allowed 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.869 -0.733 . . . . 0.0 111.526 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . 0.572 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.1 OUTLIER 176.28 -68.08 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 119.744 -0.783 . . . . 0.0 110.094 -179.863 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.537 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.0 OUTLIER -24.61 -36.71 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.56 0 O-C-N 124.213 0.945 . . . . 0.0 113.516 179.764 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . 0.572 ' N ' ' O ' ' S' ' 67' ' ' SER . 0.0 OUTLIER -69.32 31.53 0.03 OUTLIER 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 120.158 -0.617 . . . . 0.0 112.221 -179.969 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.537 ' H ' ' C ' ' S' ' 68' ' ' GLN . 0.9 OUTLIER -98.65 21.69 10.98 Favored 'General case' 0 C--N 1.298 -1.665 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.937 179.949 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 30.9 mt -87.92 -178.65 6.06 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.684 -0.807 . . . . 0.0 110.949 179.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 15.5 tttm -116.83 80.34 1.46 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.869 -0.732 . . . . 0.0 110.913 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -81.2 -102.93 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 CA-C-O 121.76 0.79 . . . . 0.0 110.7 179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -141.87 -65.63 0.42 Allowed 'General case' 0 C--N 1.279 -2.482 0 CA-C-N 114.182 -1.372 . . . . 0.0 109.505 179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.1 mp -82.42 5.96 18.76 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.684 -0.807 . . . . 0.0 109.162 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . 0.504 ' O ' ' HB2' ' S' ' 77' ' ' ALA . . . -68.87 -56.13 9.85 Favored Glycine 0 N--CA 1.488 2.106 0 C-N-CA 119.582 -1.294 . . . . 0.0 110.196 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . 0.504 ' HB2' ' O ' ' S' ' 76' ' ' GLY . . . 175.54 -91.23 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.004 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 175.79 167.89 35.36 Favored Glycine 0 N--CA 1.493 2.443 0 C-N-CA 119.363 -1.399 . . . . 0.0 110.823 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.808 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -62.77 -43.52 98.8 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.382 0 C-N-CA 119.957 -0.697 . . . . 0.0 110.234 179.988 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -58.25 -53.83 53.82 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.087 -1.045 . . . . 0.0 110.234 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.406 HG21 ' HB1' ' S' ' 77' ' ' ALA . 0.5 OUTLIER -43.14 -60.49 1.64 Allowed 'General case' 0 C--N 1.299 -1.622 0 CA-C-N 115.356 -0.838 . . . . 0.0 112.786 -179.973 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . 0.417 HG21 HD13 ' S' ' 82' ' ' ILE . 15.8 pt -68.46 10.47 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -179.654 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -106.7 -45.42 4.22 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 118.935 -1.106 . . . . 0.0 111.982 -179.998 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . 0.46 ' NH1' ' HB1' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -74.4 -32.79 62.82 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.785 -1.166 . . . . 0.0 111.489 -179.991 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -65.27 -45.59 90.41 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 119.242 -1.456 . . . . 0.0 110.23 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -66.45 -29.48 69.62 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.724 -0.791 . . . . 0.0 111.169 -179.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . 0.523 ' O ' ' N ' ' S' ' 89' ' ' LEU . 1.2 m-20 -100.8 15.91 26.83 Favored 'General case' 0 N--CA 1.492 1.638 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.6 -179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . 0.406 ' C ' ' O ' ' S' ' 87' ' ' ASN . 0.5 OUTLIER -37.85 -25.39 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 120.249 -0.581 . . . . 0.0 112.004 -179.936 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . 0.523 ' N ' ' O ' ' S' ' 87' ' ' ASN . 11.8 mt -57.38 -54.65 44.42 Favored 'General case' 0 N--CA 1.489 1.516 0 C-N-CA 119.392 -0.923 . . . . 0.0 111.298 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 2.2 mttt -94.83 -35.27 12.14 Favored 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.689 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -55.01 -49.12 72.31 Favored 'General case' 0 C--N 1.292 -1.904 0 CA-C-N 114.602 -1.181 . . . . 0.0 112.498 -179.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . 0.77 ' HB3' HH22 ' S' ' 97' ' ' ARG . . . -86.53 163.74 40.54 Favored Pre-proline 0 N--CA 1.489 1.516 0 C-N-CA 119.164 -1.014 . . . . 0.0 111.598 -179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . 0.596 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 3.0 Cg_exo -53.67 175.96 0.1 Allowed 'Trans proline' 0 C--N 1.324 -0.732 0 C-N-CA 121.546 1.497 . . . . 0.0 111.429 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 2.9 t -108.55 -33.67 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 C-N-CA 119.973 -0.691 . . . . 0.0 111.291 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -82.65 3.29 29.5 Favored 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.048 -1.061 . . . . 0.0 111.186 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.37 -31.25 24.84 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.034 -1.066 . . . . 0.0 110.798 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . 0.77 HH22 ' HB3' ' S' ' 92' ' ' ALA . 0.0 OUTLIER -63.8 -23.05 67.21 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.014 -1.074 . . . . 0.0 110.259 179.947 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -78.07 -14.34 59.53 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.033 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.747 ' CH2' HG21 ' S' ' 103' ' ' VAL . 21.4 t90 -107.36 -59.09 1.87 Allowed 'General case' 0 N--CA 1.489 1.48 0 CA-C-O 122.019 0.914 . . . . 0.0 111.513 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.524 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.7 OUTLIER -58.61 -34.04 70.69 Favored 'General case' 0 C--N 1.29 -2.021 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -179.782 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.517 ' C ' ' O ' ' S' ' 100' ' ' LEU . 5.0 mt-10 -43.3 -32.2 0.76 Allowed 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 117.29 -1.764 . . . . 0.0 106.571 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . 0.524 ' N ' ' C ' ' S' ' 100' ' ' LEU . 1.7 mt-10 -89.97 -23.78 21.44 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 112.637 -2.074 . . . . 0.0 112.437 179.82 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.747 HG21 ' CH2' ' S' ' 99' ' ' TRP . 21.9 t -88.17 -22.73 6.65 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 C-N-CA 116.255 -2.178 . . . . 0.0 109.975 -179.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . 0.563 HD21 HD11 ' S' ' 62' ' ' LEU . 21.6 tp -81.29 -55.23 4.86 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.787 -0.765 . . . . 0.0 110.032 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 5.6 mt -57.87 -81.6 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 118.325 -1.35 . . . . 0.0 110.274 179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . 0.45 ' O ' ' O ' ' S' ' 102' ' ' GLU . 0.4 OUTLIER -112.07 -177.83 3.27 Favored 'General case' 0 N--CA 1.493 1.713 0 C-N-CA 120.005 -0.678 . . . . 0.0 110.512 179.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 2.3 t . . . . . 0 N--CA 1.488 1.469 0 CA-C-O 116.417 -1.754 . . . . 0.0 110.838 179.955 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.456 ' N ' ' OD1' ' S' ' 40' ' ' ASN . 1.1 t-105 . . . . . 0 N--CA 1.484 1.258 0 CA-C-O 116.352 -1.785 . . . . 0.0 109.96 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.486 ' CZ3' ' CG ' ' S' ' 54' ' ' ARG . 0.4 OUTLIER . . . . . 0 N--CA 1.486 1.34 0 CA-C-O 116.37 -1.776 . . . . 0.0 110.012 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 . . . . . 0 N--CA 1.484 1.252 0 CA-C-O 121.001 0.429 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . 0.534 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.0 OUTLIER -84.73 -45.48 0.69 Allowed Pre-proline 0 C--N 1.305 -1.355 0 C-N-CA 119.309 -0.956 . . . . 0.0 111.83 -179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . 0.534 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.2 Cg_endo -70.18 149.43 64.17 Favored 'Trans proline' 0 C--N 1.321 -0.898 0 C-N-CA 120.969 1.112 . . . . 0.0 110.929 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -89.74 176.76 6.72 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.115 -1.034 . . . . 0.0 110.388 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -144.1 131.0 20.36 Favored 'General case' 0 C--N 1.303 -1.422 0 C-N-CA 119.48 -0.888 . . . . 0.0 110.597 179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -92.52 165.1 13.19 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.084 -179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -88.89 117.33 27.81 Favored 'General case' 0 C--N 1.305 -1.335 0 C-N-CA 119.516 -0.874 . . . . 0.0 110.65 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 6.9 mtp -64.79 -160.22 0.01 OUTLIER 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 119.161 -1.016 . . . . 0.0 110.175 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -167.75 -178.83 4.01 Favored 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.178 -1.009 . . . . 0.0 110.863 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . 0.429 ' O ' ' O ' ' R' ' 14' ' ' GLN . 3.2 tt0 -167.69 -5.77 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.511 0 C-N-CA 119.428 -0.909 . . . . 0.0 110.469 179.82 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . 0.429 ' O ' ' O ' ' R' ' 13' ' ' GLU . 31.8 mt-30 45.77 94.86 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.468 -0.893 . . . . 0.0 110.738 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -82.06 157.78 24.0 Favored 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.371 -0.932 . . . . 0.0 111.056 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 40.1 m170 -71.13 63.29 0.33 Allowed 'General case' 0 C--N 1.307 -1.257 0 CA-C-N 115.922 -0.581 . . . . 0.0 112.057 -179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.51 ' C ' ' N ' ' R' ' 19' ' ' TRP . 3.2 mt-30 -115.12 -76.86 0.57 Allowed 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 15.3 mt-10 -55.4 -17.93 5.88 Favored 'General case' 0 N--CA 1.491 1.576 0 CA-C-O 123.55 1.643 . . . . 0.0 106.666 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . 0.51 ' N ' ' C ' ' R' ' 17' ' ' GLN . 63.0 t-105 -57.22 -61.67 2.3 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 111.421 -2.627 . . . . 0.0 109.666 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 tp -50.04 -38.4 37.71 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.733 -1.121 . . . . 0.0 111.558 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.553 ' O ' ' N ' ' R' ' 24' ' ' ASP . 11.7 mtt-85 -54.28 -69.17 0.13 Allowed 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 118.273 -1.371 . . . . 0.0 110.121 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.526 ' CG ' HD22 ' S' ' 51' ' ' LEU . 0.1 OUTLIER -35.39 -43.1 0.23 Allowed 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 119.046 -1.061 . . . . 0.0 110.705 179.616 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 85.2 t -68.58 -38.44 79.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 C-N-CA 119.437 -0.905 . . . . 0.0 110.093 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' R' ' 21' ' ' ARG . 27.6 t70 -48.55 -75.57 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.096 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.419 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.2 OUTLIER -44.6 -45.21 9.39 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.102 -1.039 . . . . 0.0 109.857 179.877 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . 0.418 HD12 ' CE1' ' R' ' 22' ' ' PHE . 1.4 tt -42.39 -58.17 2.32 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.472 179.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . 0.536 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.5 OUTLIER -69.49 -61.66 1.7 Allowed 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.763 -0.775 . . . . 0.0 112.319 -179.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -46.11 -8.98 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 112.975 0.732 . . . . 0.0 112.975 -179.645 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.536 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -114.16 -29.19 7.04 Favored 'General case' 0 N--CA 1.498 1.973 0 C-N-CA 119.302 -0.959 . . . . 0.0 113.127 -179.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -48.54 -41.6 30.85 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 118.875 -1.13 . . . . 0.0 111.31 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -66.29 -22.54 66.3 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.113 -1.035 . . . . 0.0 111.495 179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . 0.529 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 22.1 t-20 -102.16 -10.98 19.15 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.83 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . 0.529 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 0.7 OUTLIER 81.66 13.2 0.63 Allowed 'General case' 0 N--CA 1.5 2.051 0 CA-C-O 121.643 0.735 . . . . 0.0 110.195 179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -86.91 -15.76 37.99 Favored 'General case' 0 C--N 1.302 -1.482 0 CA-C-N 114.647 -1.16 . . . . 0.0 109.267 179.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 -52.25 -30.45 27.69 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 113.881 -1.508 . . . . 0.0 113.439 179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.465 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 3.3 mt -66.64 -63.46 2.96 Favored Pre-proline 0 C--N 1.304 -1.401 0 C-N-CA 117.92 -1.512 . . . . 0.0 110.557 -179.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.471 ' O ' ' ND2' ' R' ' 40' ' ' ASN . 3.5 Cg_exo -52.75 -27.79 35.44 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 C-N-CA 120.536 0.824 . . . . 0.0 110.556 179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . 0.447 HD11 ' CZ3' ' S' ' 99' ' ' TRP . 15.1 mt -84.49 -36.43 22.26 Favored 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 119.455 -0.898 . . . . 0.0 110.778 179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.466 ' C ' ' H ' ' R' ' 41' ' ' LEU . 0.0 OUTLIER -51.47 -57.45 9.0 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.761 179.918 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . 0.471 ' ND2' ' O ' ' R' ' 37' ' ' PRO . 0.1 OUTLIER -64.13 2.51 0.55 Allowed 'General case' 0 C--N 1.298 -1.664 0 C-N-CA 119.049 -1.06 . . . . 0.0 111.113 -179.887 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . 0.466 ' H ' ' C ' ' R' ' 39' ' ' LEU . 3.7 tp -93.32 -64.11 1.13 Allowed 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.372 -0.931 . . . . 0.0 110.509 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . 0.463 ' O ' HD23 ' S' ' 51' ' ' LEU . 0.0 OUTLIER -79.53 12.57 2.43 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 117.431 -1.708 . . . . 0.0 109.406 179.881 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . 0.519 HD21 ' CE1' ' R' ' 22' ' ' PHE . 19.6 mt -132.34 169.96 15.76 Favored 'General case' 0 N--CA 1.496 1.869 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 179.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.608 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.29 0.2 OUTLIER -132.24 -135.52 0.0 OUTLIER Pre-proline 0 CA--C 1.57 1.735 0 CA-C-O 116.957 -1.497 . . . . 0.0 109.725 -179.968 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.608 ' HD3' HG22 ' R' ' 44' ' ' THR . 18.8 Cg_endo -100.45 -49.41 0.01 OUTLIER 'Trans proline' 0 N--CA 1.483 0.874 0 CA-C-N 123.127 2.152 . . . . 0.0 112.051 179.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -52.43 -22.05 4.32 Favored 'General case' 0 C--N 1.302 -1.493 0 CA-C-N 115.295 -0.866 . . . . 0.0 110.549 -179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -74.31 -52.8 11.19 Favored 'General case' 0 C--N 1.297 -1.677 0 C-N-CA 119.394 -0.922 . . . . 0.0 110.242 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 5.9 ttt180 -61.89 -13.14 21.97 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 119.507 -0.877 . . . . 0.0 110.318 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -88.42 -65.09 1.05 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.626 -0.83 . . . . 0.0 110.144 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.588 ' HB1' HH11 ' R' ' 54' ' ' ARG . . . -61.63 -44.18 97.47 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.735 -0.786 . . . . 0.0 111.077 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 1.4 tp -47.45 -60.63 2.39 Favored 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.778 -0.769 . . . . 0.0 110.665 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -50.04 -44.76 42.1 Favored Glycine 0 N--CA 1.49 2.25 0 C-N-CA 119.297 -1.43 . . . . 0.0 109.973 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.496 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.2 OUTLIER -48.21 -79.93 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.398 0 C-N-CA 120.176 -0.61 . . . . 0.0 112.092 -179.95 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.588 HH11 ' HB1' ' R' ' 50' ' ' ALA . 0.1 OUTLIER -39.91 -37.77 0.61 Allowed 'General case' 0 N--CA 1.494 1.726 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.199 -179.818 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . 0.595 HG22 ' HB3' ' S' ' 42' ' ' MET . 93.5 t -72.64 -35.27 50.06 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.726 179.905 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.496 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.9 OUTLIER -77.21 -39.45 48.64 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.151 -1.02 . . . . 0.0 111.821 -179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 0.794 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -73.38 -36.14 47.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 C-N-CA 117.713 -1.595 . . . . 0.0 108.383 -179.875 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 0.794 ' N ' HD13 ' R' ' 57' ' ' ILE . 3.1 t -56.28 -65.24 0.4 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.261 0 C-N-CA 118.07 -1.452 . . . . 0.0 109.39 179.621 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.507 ' N ' HG12 ' R' ' 58' ' ' VAL . 63.3 mt-10 -47.61 -44.55 26.76 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.246 -0.981 . . . . 0.0 110.88 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 20.1 tt0 -46.15 -44.36 15.78 Favored 'General case' 0 C--N 1.305 -1.343 0 C-N-CA 119.874 -0.731 . . . . 0.0 111.758 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 9.8 mt -99.15 -0.1 42.31 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.291 -0.964 . . . . 0.0 111.668 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.6 tp -96.98 13.13 30.0 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 119.194 -1.002 . . . . 0.0 111.448 179.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 65.3 mtt180 -85.22 -82.22 0.18 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.065 -1.054 . . . . 0.0 110.473 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -126.35 -65.14 0.16 Allowed Glycine 0 N--CA 1.49 2.27 0 N-CA-C 109.023 -1.631 . . . . 0.0 109.023 179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.441 ' O ' ' C ' ' R' ' 66' ' ' MET . 0.3 OUTLIER -142.88 -89.64 0.13 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.975 -0.69 . . . . 0.0 110.245 179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . 0.441 ' C ' ' O ' ' R' ' 65' ' ' GLU . 0.0 OUTLIER 29.51 94.61 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.674 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.354 -179.959 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 26.8 m -147.85 58.98 1.12 Allowed 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.219 -0.993 . . . . 0.0 111.07 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.04 -34.29 0.88 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 119.96 -0.696 . . . . 0.0 110.67 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.62 33.81 0.21 Allowed 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.657 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -106.48 26.11 10.3 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 119.85 -0.74 . . . . 0.0 112.011 -179.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 7.9 mt -74.89 143.74 43.67 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 118.675 -1.21 . . . . 0.0 110.547 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 35.9 tttm -67.28 119.21 11.77 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 119.742 -0.783 . . . . 0.0 111.734 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -96.49 -102.89 0.17 Allowed 'General case' 0 C--N 1.304 -1.379 0 CA-C-O 121.759 0.79 . . . . 0.0 110.387 179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 24.2 mt-10 -147.02 -59.32 0.28 Allowed 'General case' 0 C--N 1.278 -2.508 0 CA-C-N 114.214 -1.357 . . . . 0.0 109.405 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.504 ' N ' HD23 ' R' ' 75' ' ' LEU . 0.1 OUTLIER -100.81 -8.35 22.74 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.743 179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -43.14 -65.03 1.55 Allowed Glycine 0 N--CA 1.488 2.142 0 C-N-CA 119.705 -1.236 . . . . 0.0 110.836 179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -168.1 -96.35 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.118 -1.033 . . . . 0.0 111.248 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -161.73 155.27 26.46 Favored Glycine 0 N--CA 1.493 2.446 0 C-N-CA 119.48 -1.343 . . . . 0.0 110.279 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.749 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -54.77 -49.5 68.36 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 C-N-CA 119.783 -0.767 . . . . 0.0 110.785 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.444 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -61.14 -56.51 20.02 Favored 'General case' 0 N--CA 1.49 1.558 0 C-N-CA 119.036 -1.066 . . . . 0.0 111.217 -179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 4.0 m -38.87 -54.42 1.63 Allowed 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 113.31 0.855 . . . . 0.0 113.31 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 9.4 pt -64.72 -20.65 27.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 N-CA-C 114.301 1.223 . . . . 0.0 114.301 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.514 ' C ' ' H ' ' R' ' 85' ' ' GLY . 0.0 OUTLIER -75.32 -73.28 0.26 Allowed 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 118.389 -1.324 . . . . 0.0 111.677 -179.915 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.22 -6.24 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.583 0 C-N-CA 119.461 -0.896 . . . . 0.0 111.545 -179.95 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . 0.514 ' H ' ' C ' ' R' ' 83' ' ' THR . . . -69.25 -46.03 58.97 Favored Glycine 0 N--CA 1.49 2.287 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.741 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . 0.493 ' C ' ' H ' ' R' ' 88' ' ' SER . 33.8 t -102.77 -42.14 5.97 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.825 -0.75 . . . . 0.0 111.438 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -67.5 9.42 0.25 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.606 -0.837 . . . . 0.0 111.234 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . 0.527 ' O ' ' N ' ' R' ' 90' ' ' LYS . 0.4 OUTLIER -74.22 -22.91 59.15 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.031 -179.982 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . 0.4 ' C ' ' O ' ' R' ' 88' ' ' SER . 3.8 mt -37.29 -25.31 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.626 0 CA-C-N 115.545 -0.752 . . . . 0.0 111.996 179.92 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . 0.527 ' N ' ' O ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -108.71 -56.66 2.24 Favored 'General case' 0 N--CA 1.489 1.477 0 C-N-CA 119.892 -0.723 . . . . 0.0 111.318 179.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -61.84 -6.21 2.57 Favored 'General case' 0 C--N 1.291 -1.963 0 CA-C-N 114.663 -1.153 . . . . 0.0 112.585 -179.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.09 138.68 97.48 Favored Pre-proline 0 N--CA 1.489 1.505 0 C-N-CA 118.63 -1.228 . . . . 0.0 110.567 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_endo -63.01 128.28 22.56 Favored 'Trans proline' 0 C--O 1.214 -0.705 0 C-N-CA 121.016 1.144 . . . . 0.0 111.582 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . 0.581 ' O ' HG12 ' R' ' 94' ' ' VAL . 82.7 t -67.68 -5.5 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.41 0 C-N-CA 119.284 -0.966 . . . . 0.0 110.487 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -91.93 7.62 41.24 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.723 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.1 tp -104.35 -41.93 5.62 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.868 -0.733 . . . . 0.0 111.163 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -52.7 -47.2 67.41 Favored 'General case' 0 N--CA 1.489 1.517 0 CA-C-N 115.604 -0.726 . . . . 0.0 112.286 -179.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 80.9 mt-30 -60.04 -17.37 38.57 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.674 -0.81 . . . . 0.0 112.567 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.676 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 3.9 t90 -113.66 -65.26 1.2 Allowed 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 119.446 -0.902 . . . . 0.0 112.489 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.494 ' O ' ' C ' ' R' ' 101' ' ' GLU . 2.3 mm? -39.89 -38.56 0.7 Allowed 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 -179.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.494 ' C ' ' O ' ' R' ' 100' ' ' LEU . 11.2 mt-10 -43.79 -33.94 1.43 Allowed 'General case' 0 C--N 1.291 -1.966 0 C-N-CA 117.738 -1.585 . . . . 0.0 107.825 179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.441 ' N ' ' C ' ' R' ' 100' ' ' LEU . 6.4 mt-10 -91.75 -31.85 15.62 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 113.77 -1.559 . . . . 0.0 111.939 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.676 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 3.2 t -82.44 -10.99 12.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 117.288 -1.765 . . . . 0.0 110.287 179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . 0.422 ' HA ' HD12 ' R' ' 104' ' ' LEU . 34.0 tp -92.95 -50.44 5.55 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-N 115.406 -0.816 . . . . 0.0 109.631 179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' R' ' 107' ' ' SER . 1.0 OUTLIER -52.5 -66.44 0.38 Allowed 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 119.16 -1.016 . . . . 0.0 110.252 179.944 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 10.9 mmtm -49.41 -11.35 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.681 -0.807 . . . . 0.0 111.179 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . 0.47 ' N ' ' O ' ' R' ' 105' ' ' LEU . 10.4 m . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 116.324 -1.798 . . . . 0.0 110.788 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.486 1.354 0 CA-C-O 120.776 0.322 . . . . 0.0 110.294 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -145.98 160.71 42.56 Favored Pre-proline 0 N--CA 1.487 1.415 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.181 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -55.5 -33.35 85.98 Favored 'Trans proline' 0 C--N 1.318 -1.054 0 C-N-CA 121.311 1.341 . . . . 0.0 111.444 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -66.44 138.3 57.46 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.17 -1.012 . . . . 0.0 110.537 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 47.3 p -81.28 -179.37 7.33 Favored 'General case' 0 C--N 1.302 -1.468 0 C-N-CA 119.255 -0.978 . . . . 0.0 110.502 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -164.65 -31.53 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.881 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.28 -176.51 3.98 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.812 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -126.19 121.34 32.5 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.995 -0.682 . . . . 0.0 110.614 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -88.0 40.87 0.97 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.362 -0.935 . . . . 0.0 110.907 -179.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -138.77 131.59 29.31 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.776 -0.77 . . . . 0.0 110.859 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . 0.427 ' N ' ' NE2' ' S' ' 14' ' ' GLN . 2.7 mp0 -85.26 177.79 7.72 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.375 -0.93 . . . . 0.0 111.175 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . 0.49 ' C ' ' H ' ' S' ' 17' ' ' GLN . 0.2 OUTLIER -87.25 18.21 3.87 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 119.578 -0.849 . . . . 0.0 110.847 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 46.3 t-80 -66.11 7.73 0.27 Allowed 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.628 -0.829 . . . . 0.0 110.757 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.495 ' O ' ' N ' ' S' ' 20' ' ' LEU . 1.2 mp0 -92.65 -85.51 0.26 Allowed 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 119.721 -0.792 . . . . 0.0 110.76 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.437 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.6 mt-10 -42.93 -29.93 0.37 Allowed 'General case' 0 N--CA 1.497 1.891 0 CA-C-O 122.966 1.365 . . . . 0.0 108.276 179.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . 0.466 ' N ' ' C ' ' S' ' 17' ' ' GLN . 22.8 t-105 -56.45 -54.43 45.73 Favored 'General case' 0 C--N 1.294 -1.844 0 CA-C-N 112.729 -2.032 . . . . 0.0 107.927 179.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . 0.495 ' N ' ' O ' ' S' ' 17' ' ' GLN . 0.5 OUTLIER -57.64 -36.55 72.0 Favored 'General case' 0 C--N 1.296 -1.732 0 CA-C-N 113.573 -1.648 . . . . 0.0 111.455 179.882 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -54.82 -74.41 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 118.595 -1.242 . . . . 0.0 110.027 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.547 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.7 OUTLIER -27.13 -48.26 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 119.234 -0.986 . . . . 0.0 111.472 179.626 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' S' ' 21' ' ' ARG . 62.2 t -66.82 -49.75 71.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.439 -179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.484 ' N ' ' O ' ' S' ' 21' ' ' ARG . 15.6 t70 -41.07 -56.25 2.36 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.9 -0.72 . . . . 0.0 111.583 -179.93 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.56 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.2 OUTLIER -60.61 -45.32 94.45 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.624 -1.23 . . . . 0.0 110.272 179.925 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.405 HD22 ' HA ' ' S' ' 26' ' ' LEU . 0.2 OUTLIER -48.31 -43.71 33.27 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.389 179.991 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -49.05 -41.04 33.73 Favored 'General case' 0 N--CA 1.496 1.827 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.84 -9.86 18.67 Favored 'General case' 0 N--CA 1.497 1.895 0 C-N-CA 119.305 -0.958 . . . . 0.0 113.329 -179.686 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.77 -46.69 15.02 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 118.774 -1.171 . . . . 0.0 112.096 -179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . 0.408 ' C ' ' N ' ' S' ' 32' ' ' ASN . 17.7 t80 -49.93 -46.34 51.98 Favored 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 119.687 -0.805 . . . . 0.0 112.015 -179.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 2.0 tt0 -47.4 -19.68 0.18 Allowed 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.138 -1.025 . . . . 0.0 111.212 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.494 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 79.4 m-20 -110.67 -68.58 0.92 Allowed 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 119.864 -0.734 . . . . 0.0 111.213 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.494 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.1 OUTLIER 160.17 -13.42 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.822 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.53 -179.85 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . 0.435 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 1.4 mm? -54.94 -17.81 4.19 Favored 'General case' 0 N--CA 1.49 1.565 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.941 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . 0.434 ' ND1' ' O ' ' S' ' 33' ' ' ASP . 19.4 p-80 -50.17 -21.12 1.19 Allowed 'General case' 0 C--N 1.292 -1.904 0 C-N-CA 119.486 -0.886 . . . . 0.0 112.338 -179.982 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.459 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.3 mt -77.94 -64.1 0.42 Allowed Pre-proline 0 N--CA 1.484 1.239 0 C-N-CA 118.481 -1.288 . . . . 0.0 111.173 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.459 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.8 Cg_exo -51.4 -42.31 55.52 Favored 'Trans proline' 0 C--N 1.319 -0.993 0 C-N-CA 120.526 0.817 . . . . 0.0 110.495 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 52.8 mt -56.98 -54.6 44.82 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 119.589 -0.844 . . . . 0.0 110.416 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.478 HD12 ' HA ' ' S' ' 39' ' ' LEU . 0.4 OUTLIER -46.22 -53.21 11.0 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.816 179.864 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -52.36 -10.67 0.15 Allowed 'General case' 0 C--N 1.301 -1.509 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -179.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 mp -107.14 -60.37 1.69 Allowed 'General case' 0 N--CA 1.493 1.692 0 C-N-CA 119.358 -0.937 . . . . 0.0 112.726 -179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . 0.595 ' HB3' HG22 ' R' ' 55' ' ' VAL . 0.0 OUTLIER -89.62 28.51 1.29 Allowed 'General case' 0 N--CA 1.497 1.886 0 C-N-CA 119.193 -1.003 . . . . 0.0 111.462 -179.777 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . 0.715 HD23 ' C ' ' S' ' 43' ' ' LEU . 5.3 tt -178.13 127.95 0.13 Allowed 'General case' 0 N--CA 1.502 2.131 0 N-CA-C 109.41 -0.589 . . . . 0.0 109.41 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.506 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -178.98 -42.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.484 0 C-N-CA 116.514 -2.074 . . . . 0.0 116.276 179.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.506 ' HD2' ' H ' ' S' ' 44' ' ' THR . 19.1 Cg_endo -78.72 -107.17 0.01 OUTLIER 'Trans proline' 0 CA--C 1.553 1.464 0 C-N-CA 121.251 1.301 . . . . 0.0 114.12 -179.375 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -47.52 -16.85 0.07 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.118 -179.732 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . 0.52 ' O ' ' N ' ' S' ' 49' ' ' GLU . 22.0 mm-40 -69.42 -76.9 0.09 Allowed 'General case' 0 C--N 1.294 -1.818 0 CA-C-N 114.704 -1.135 . . . . 0.0 110.149 -179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' S' ' 47' ' ' GLU . 11.0 ttp85 -38.32 -27.13 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 120.241 -0.584 . . . . 0.0 111.245 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . 0.52 ' N ' ' O ' ' S' ' 47' ' ' GLU . 3.3 tt0 -77.47 -62.32 1.7 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 118.239 -1.385 . . . . 0.0 110.821 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . 0.463 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -59.47 -35.64 74.47 Favored 'General case' 0 N--CA 1.493 1.722 0 CA-C-N 115.59 -0.732 . . . . 0.0 112.774 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . 0.526 HD22 ' CG ' ' R' ' 22' ' ' PHE . 95.2 mt -55.41 -72.48 0.07 Allowed 'General case' 0 N--CA 1.494 1.769 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.419 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.78 -40.32 5.23 Favored Glycine 0 N--CA 1.492 2.372 0 C-N-CA 119.456 -1.354 . . . . 0.0 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.473 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -50.79 -80.5 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.616 -0.833 . . . . 0.0 112.496 -179.97 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.628 HH21 HG11 ' S' ' 58' ' ' VAL . 0.0 OUTLIER -39.42 -35.34 0.27 Allowed 'General case' 0 N--CA 1.498 1.946 0 CA-C-N 115.708 -0.678 . . . . 0.0 112.401 -179.924 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 71.3 t -74.66 -31.0 25.9 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.737 0 C-N-CA 118.452 -1.299 . . . . 0.0 111.013 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.473 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.5 -36.89 32.67 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.818 -1.153 . . . . 0.0 111.421 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 0.852 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -72.91 -40.11 59.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 C-N-CA 118.078 -1.449 . . . . 0.0 108.604 -179.939 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . 0.852 ' N ' HD13 ' S' ' 57' ' ' ILE . 19.3 t -59.46 -59.25 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 C-N-CA 117.463 -1.695 . . . . 0.0 108.837 179.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -52.1 -23.52 5.48 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.121 -1.032 . . . . 0.0 110.544 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -68.04 -58.09 5.07 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.121 -1.032 . . . . 0.0 111.631 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . 0.582 ' C ' ' H ' ' S' ' 63' ' ' ARG . 1.6 pp -64.85 -9.96 24.75 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 118.564 -1.254 . . . . 0.0 110.737 179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . 0.612 ' O ' ' N ' ' S' ' 64' ' ' GLY . 12.6 tp -72.65 28.62 0.06 Allowed 'General case' 0 N--CA 1.494 1.741 0 C-N-CA 119.552 -0.859 . . . . 0.0 109.814 179.863 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . 0.582 ' H ' ' C ' ' S' ' 61' ' ' LEU . 47.7 mtt-85 21.07 38.18 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.612 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -97.53 -31.17 6.89 Favored Glycine 0 N--CA 1.493 2.479 0 C-N-CA 119.695 -1.241 . . . . 0.0 110.567 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -142.17 -86.21 0.16 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.491 -0.883 . . . . 0.0 111.104 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 42.9 mtt -82.54 166.72 19.03 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.166 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . 0.562 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.1 OUTLIER -165.32 -78.75 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.588 -0.845 . . . . 0.0 109.163 179.971 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.502 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.5 OUTLIER -38.67 -22.24 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.498 0 CA-C-N 115.055 -0.975 . . . . 0.0 111.662 179.712 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . 0.562 ' N ' ' O ' ' S' ' 67' ' ' SER . 0.4 OUTLIER -65.79 31.7 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.945 179.973 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.502 ' H ' ' C ' ' S' ' 68' ' ' GLN . 26.6 mt-10 -99.25 13.91 31.38 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.705 -0.798 . . . . 0.0 110.788 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 4.7 mt -61.71 148.35 43.06 Favored 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 119.432 -0.907 . . . . 0.0 111.049 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -97.96 85.96 3.63 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 119.852 -0.739 . . . . 0.0 110.758 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 54.4 m-80 -92.01 -103.4 0.11 Allowed 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.709 -0.796 . . . . 0.0 111.305 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -140.95 -56.65 0.5 Allowed 'General case' 0 C--N 1.279 -2.491 0 CA-C-N 114.441 -1.254 . . . . 0.0 110.884 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.11 5.21 40.29 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.828 -0.749 . . . . 0.0 110.4 179.986 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -60.92 -58.61 12.86 Favored Glycine 0 N--CA 1.489 2.226 0 C-N-CA 119.551 -1.309 . . . . 0.0 110.907 -179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -161.85 -82.02 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.126 -1.03 . . . . 0.0 111.003 -179.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 157.23 132.3 1.44 Allowed Glycine 0 N--CA 1.49 2.265 0 C-N-CA 119.249 -1.453 . . . . 0.0 110.664 -179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.801 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -42.26 -45.6 1.05 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.313 0 C-N-CA 120.246 -0.582 . . . . 0.0 111.127 -179.943 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.45 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -62.83 -57.33 11.25 Favored 'General case' 0 N--CA 1.49 1.56 0 C-N-CA 119.167 -1.013 . . . . 0.0 111.622 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.531 ' CG2' HG21 ' S' ' 57' ' ' ILE . 23.6 m -47.24 -47.42 24.7 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 120.038 -0.665 . . . . 0.0 112.764 179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . 0.415 HD13 HG21 ' S' ' 82' ' ' ILE . 22.1 pt -75.14 -0.61 2.66 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 C-N-CA 119.225 -0.99 . . . . 0.0 113.662 -179.724 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.1 OUTLIER -90.6 -60.84 1.81 Allowed 'General case' 0 N--CA 1.495 1.814 0 C-N-CA 118.583 -1.247 . . . . 0.0 111.699 -179.837 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.13 -13.27 34.64 Favored 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.096 -1.042 . . . . 0.0 111.251 -179.869 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.53 -48.57 83.95 Favored Glycine 0 N--CA 1.489 2.216 0 C-N-CA 119.373 -1.394 . . . . 0.0 110.699 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 4.1 m -88.46 -25.26 22.71 Favored 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.48 -0.888 . . . . 0.0 111.161 179.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -94.54 8.75 41.12 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.757 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -52.07 -28.13 16.38 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.753 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . 0.532 ' H ' HD12 ' S' ' 89' ' ' LEU . 9.4 mp -42.42 -64.3 0.63 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.748 -0.781 . . . . 0.0 111.864 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' S' ' 91' ' ' ALA . 0.0 OUTLIER -95.77 -51.44 4.49 Favored 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.778 -179.869 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . 0.44 ' C ' ' O ' ' S' ' 90' ' ' LYS . . . -34.26 -51.87 0.46 Allowed 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 114.516 -1.22 . . . . 0.0 111.889 -179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . 0.567 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -82.83 162.71 54.31 Favored Pre-proline 0 C--N 1.303 -1.432 0 C-N-CA 119.248 -0.981 . . . . 0.0 110.464 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . 0.567 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 4.4 Cg_exo -56.39 144.67 82.28 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 121.475 1.45 . . . . 0.0 111.222 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . 0.421 ' C ' ' H ' ' S' ' 96' ' ' LEU . 6.0 t -85.15 -6.82 10.67 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 C-N-CA 119.286 -0.965 . . . . 0.0 110.614 -179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.22 4.48 1.64 Allowed 'General case' 0 C--N 1.303 -1.439 0 C-N-CA 119.438 -0.905 . . . . 0.0 110.655 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . 0.421 ' H ' ' C ' ' S' ' 94' ' ' VAL . 8.0 mp -97.02 -19.16 18.94 Favored 'General case' 0 N--CA 1.489 1.514 0 C-N-CA 119.498 -0.881 . . . . 0.0 111.011 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . 0.438 ' N ' ' CD ' ' S' ' 97' ' ' ARG . 3.5 mpt_? -64.2 -42.75 96.51 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.438 -0.905 . . . . 0.0 111.003 179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 42.0 mt-30 -86.51 -1.78 57.9 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.094 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.705 ' CH2' HG21 ' S' ' 103' ' ' VAL . 10.7 t90 -115.63 -66.14 1.12 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -179.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.573 ' C ' ' N ' ' S' ' 102' ' ' GLU . 0.6 OUTLIER -52.67 -38.06 59.83 Favored 'General case' 0 C--N 1.294 -1.84 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 -179.573 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.514 ' C ' ' O ' ' S' ' 100' ' ' LEU . 1.3 mm-40 -41.95 -26.95 0.1 Allowed 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 117.573 -1.651 . . . . 0.0 107.285 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . 0.573 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.3 mt-10 -95.57 -25.61 16.1 Favored 'General case' 0 C--N 1.305 -1.326 0 CA-C-N 113.462 -1.699 . . . . 0.0 112.127 179.861 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.705 HG21 ' CH2' ' S' ' 99' ' ' TRP . 8.2 t -84.22 -20.32 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 C-N-CA 116.148 -2.221 . . . . 0.0 108.119 -179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . 0.428 ' HA ' HD12 ' S' ' 104' ' ' LEU . 19.3 tp -81.43 -57.4 3.49 Favored 'General case' 0 C--N 1.305 -1.369 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.857 179.616 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 1.1 mt -49.06 -61.89 1.83 Allowed 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 118.672 -1.211 . . . . 0.0 109.446 179.734 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -74.24 170.21 16.02 Favored 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.323 -0.853 . . . . 0.0 109.683 179.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . 0.413 ' O ' ' OG ' ' S' ' 107' ' ' SER . 29.5 t . . . . . 0 N--CA 1.487 1.424 0 CA-C-O 116.247 -1.835 . . . . 0.0 110.703 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.234 0 CA-C-O 116.391 -1.766 . . . . 0.0 110.523 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.417 ' CZ3' ' CG ' ' S' ' 54' ' ' ARG . 1.1 m-90 . . . . . 0 N--CA 1.486 1.368 0 CA-C-O 116.386 -1.769 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 32.9 mt-30 . . . . . 0 N--CA 1.484 1.267 0 CA-C-O 120.931 0.396 . . . . 0.0 110.039 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . 0.539 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.3 OUTLIER -63.97 -44.78 79.51 Favored Pre-proline 0 C--N 1.306 -1.292 0 C-N-CA 119.515 -0.874 . . . . 0.0 112.473 -179.993 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . 0.539 ' CD ' ' N ' ' R' ' 5' ' ' SER . 4.4 Cg_exo -66.12 139.96 57.74 Favored 'Trans proline' 0 C--N 1.322 -0.846 0 C-N-CA 120.952 1.102 . . . . 0.0 111.601 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 27.7 m-85 -115.91 179.31 4.02 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 115.658 -0.701 . . . . 0.0 110.89 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 83.2 p -65.77 130.08 42.01 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.69 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -87.84 -134.92 0.09 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.092 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -80.56 102.01 9.5 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.642 -0.823 . . . . 0.0 110.635 179.928 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 1.6 ttm -86.91 159.46 19.03 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 119.372 -0.931 . . . . 0.0 111.14 -179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -45.64 108.38 0.13 Allowed 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 119.223 -0.991 . . . . 0.0 110.509 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . 0.434 ' O ' ' CG ' ' R' ' 13' ' ' GLU . 1.2 pt-20 -112.79 69.37 0.69 Allowed 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.161 -179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . 0.42 ' O ' ' O ' ' R' ' 13' ' ' GLU . 1.2 mt-30 45.02 91.14 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.971 -1.092 . . . . 0.0 110.136 -179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . 0.51 ' C ' ' H ' ' R' ' 17' ' ' GLN . 4.5 mmt85 -101.09 -176.47 3.17 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.577 -0.849 . . . . 0.0 112.326 -179.808 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . 0.714 ' NE2' HD21 ' S' ' 36' ' ' LEU . 10.1 t-80 -69.17 24.81 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.55 0 CA-C-N 114.928 -1.033 . . . . 0.0 111.151 179.984 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.537 ' O ' ' N ' ' R' ' 19' ' ' TRP . 4.3 mt-30 -85.59 -98.47 0.07 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.787 -0.765 . . . . 0.0 111.488 -179.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . 0.496 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.7 mt-10 -32.0 -37.08 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.507 0 CA-C-O 123.259 1.504 . . . . 0.0 108.989 179.732 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . 0.633 ' CD1' ' CD2' ' R' ' 16' ' ' HIS . 57.3 t-105 -50.09 -57.96 6.54 Favored 'General case' 0 C--N 1.288 -2.097 0 CA-C-N 112.553 -2.112 . . . . 0.0 109.604 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . 0.525 ' N ' ' O ' ' R' ' 17' ' ' GLN . 7.9 tp -54.64 -46.01 73.86 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 114.821 -1.081 . . . . 0.0 112.014 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -45.39 -68.4 0.2 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 118.667 -1.213 . . . . 0.0 109.456 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.448 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.1 OUTLIER -36.8 -38.81 0.19 Allowed 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 119.515 -0.874 . . . . 0.0 111.82 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 97.3 t -73.5 -50.06 32.71 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.741 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -41.5 -64.65 0.53 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.877 -0.729 . . . . 0.0 111.24 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.453 ' HG ' ' H ' ' R' ' 25' ' ' LEU . 0.8 OUTLIER -54.4 -48.42 71.61 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 119.9 -0.72 . . . . 0.0 110.979 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . 0.401 ' C ' ' O ' ' R' ' 25' ' ' LEU . 1.1 tt -35.31 -62.42 0.39 Allowed 'General case' 0 N--CA 1.493 1.678 0 CA-C-N 115.731 -0.668 . . . . 0.0 112.535 -179.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . 0.441 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.6 OUTLIER -57.5 -68.03 0.27 Allowed 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 119.059 -1.056 . . . . 0.0 112.02 -179.787 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 16.0 m-80 -44.57 -17.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.523 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.514 ' HB1' ' N ' ' R' ' 35' ' ' HIS . . . -95.93 -31.27 13.18 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.869 -1.132 . . . . 0.0 112.521 -179.766 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . 0.508 ' CE1' ' NZ ' ' S' ' 27' ' ' LYS . 15.1 t80 -55.86 -40.33 72.74 Favored 'General case' 0 C--N 1.3 -1.563 0 C-N-CA 118.86 -1.136 . . . . 0.0 111.716 -179.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -71.1 -21.97 62.15 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 119.427 -0.909 . . . . 0.0 111.805 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . 0.527 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 26.5 m120 -100.07 -16.1 17.99 Favored 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.553 -0.859 . . . . 0.0 110.929 179.963 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . 0.527 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 5.3 t70 83.73 23.56 0.13 Allowed 'General case' 0 N--CA 1.499 1.99 0 O-C-N 123.671 0.607 . . . . 0.0 110.314 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -98.58 -14.79 19.76 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.026 -0.988 . . . . 0.0 108.769 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . 0.514 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 1.9 p-80 -48.11 -35.12 10.84 Favored 'General case' 0 C--N 1.294 -1.847 0 CA-C-N 114.344 -1.298 . . . . 0.0 113.294 -179.887 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.458 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 6.0 mt -64.82 -63.07 3.99 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 118.024 -1.47 . . . . 0.0 111.697 -179.745 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -48.63 -35.03 28.59 Favored 'Trans proline' 0 C--N 1.315 -1.219 0 C-N-CA 120.917 1.078 . . . . 0.0 111.894 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . 0.405 HD11 ' CZ3' ' S' ' 99' ' ' TRP . 72.8 mt -76.81 -40.65 47.32 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.637 -0.825 . . . . 0.0 110.246 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.465 HD13 ' O ' ' R' ' 35' ' ' HIS . 0.3 OUTLIER -56.81 -22.17 34.32 Favored 'General case' 0 C--N 1.304 -1.381 0 CA-C-N 114.934 -1.03 . . . . 0.0 110.681 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 1.1 m-80 -89.44 6.64 39.86 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 119.176 -1.009 . . . . 0.0 111.117 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . 0.477 ' C ' ' H ' ' R' ' 43' ' ' LEU . 67.3 mt -114.54 -60.88 1.83 Allowed 'General case' 0 N--CA 1.491 1.618 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.227 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . 0.403 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -71.12 16.24 0.1 Allowed 'General case' 0 N--CA 1.496 1.867 0 C-N-CA 118.348 -1.341 . . . . 0.0 111.535 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . 0.477 ' H ' ' C ' ' R' ' 41' ' ' LEU . 4.8 mp -141.67 159.18 42.76 Favored 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 120.131 -0.627 . . . . 0.0 109.374 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.699 HG22 ' HD3' ' R' ' 45' ' ' PRO 0.288 0.3 OUTLIER -107.67 -148.94 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.623 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.453 -179.96 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.699 ' HD3' HG22 ' R' ' 44' ' ' THR . 9.4 Cg_endo -98.12 -39.17 0.02 OUTLIER 'Trans proline' 0 N--CA 1.474 0.357 0 CA-C-N 119.945 1.016 . . . . 0.0 110.524 179.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 36.8 m-20 -64.63 -23.56 67.3 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.379 -0.928 . . . . 0.0 110.165 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -64.9 -41.77 95.33 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.162 -1.015 . . . . 0.0 109.91 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -70.03 -34.8 73.73 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.57 -0.852 . . . . 0.0 111.245 179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.14 -64.42 0.89 Allowed 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 118.787 -1.165 . . . . 0.0 110.74 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.433 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -53.95 -39.71 66.18 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.73 -0.788 . . . . 0.0 111.181 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -48.61 -67.6 0.26 Allowed 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 119.612 -0.835 . . . . 0.0 110.862 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . 0.408 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -45.32 -52.82 8.35 Favored Glycine 0 N--CA 1.486 2.002 0 C-N-CA 119.283 -1.437 . . . . 0.0 110.644 -180.0 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.433 ' OG1' ' O ' ' R' ' 50' ' ' ALA . 0.2 OUTLIER -37.7 -78.58 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 120.174 -0.61 . . . . 0.0 111.276 179.996 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . . . . . . . . . 9.6 mtt85 -40.94 -51.89 3.16 Favored 'General case' 0 N--CA 1.495 1.78 0 CA-C-N 114.939 -1.028 . . . . 0.0 112.294 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 59.1 t -64.36 -26.16 39.68 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.787 0 C-N-CA 118.344 -1.343 . . . . 0.0 111.34 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.411 ' N ' ' O ' ' R' ' 53' ' ' THR . 0.0 OUTLIER -81.23 -39.28 25.62 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 118.399 -1.32 . . . . 0.0 110.826 179.981 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 0.92 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -74.33 -34.78 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.485 0 C-N-CA 117.718 -1.593 . . . . 0.0 108.465 179.94 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 0.92 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.3 t -61.43 -65.27 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 C-N-CA 118.004 -1.478 . . . . 0.0 109.414 179.533 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.482 ' N ' HG12 ' R' ' 58' ' ' VAL . 5.3 mm-40 -41.28 -50.73 3.67 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.96 -0.696 . . . . 0.0 111.882 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -57.64 -47.32 82.56 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 119.15 -1.02 . . . . 0.0 111.823 -179.813 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 80.9 mt -83.09 6.09 20.27 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 119.538 -0.865 . . . . 0.0 112.241 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.0 tp -128.12 26.63 5.75 Favored 'General case' 0 N--CA 1.492 1.675 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.365 179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 5.4 tmm_? -115.08 -61.26 1.77 Allowed 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 119.605 -0.838 . . . . 0.0 110.021 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -126.84 -94.56 0.89 Allowed Glycine 0 N--CA 1.49 2.278 0 N-CA-C 110.001 -1.24 . . . . 0.0 110.001 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.529 ' O ' ' C ' ' R' ' 66' ' ' MET . 9.7 mm-40 -136.49 -61.56 0.68 Allowed 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 120.11 -0.636 . . . . 0.0 110.363 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . 0.529 ' C ' ' O ' ' R' ' 65' ' ' GLU . 1.0 OUTLIER 3.2 101.75 0.01 OUTLIER 'General case' 0 N--CA 1.504 2.228 0 O-C-N 124.608 1.192 . . . . 0.0 113.129 -179.978 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 90.7 p -160.6 67.66 0.34 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.219 -0.992 . . . . 0.0 111.112 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . 0.499 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.9 OUTLIER -125.36 -56.5 1.52 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 120.032 -0.667 . . . . 0.0 110.382 179.904 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -75.63 31.63 0.11 Allowed 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 120.039 -0.664 . . . . 0.0 111.059 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . 0.499 ' H ' ' C ' ' R' ' 68' ' ' GLN . 0.0 OUTLIER -92.27 24.56 3.31 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.406 -0.815 . . . . 0.0 110.636 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 2.3 mp -78.99 178.24 8.17 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 119.47 -0.892 . . . . 0.0 110.988 -179.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -102.39 114.89 29.46 Favored 'General case' 0 N--CA 1.49 1.569 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.453 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . . . . . . . . . 29.8 m-80 -103.5 -107.02 0.27 Allowed 'General case' 0 C--N 1.307 -1.257 0 CA-C-O 121.61 0.719 . . . . 0.0 111.128 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -146.51 -21.69 0.43 Allowed 'General case' 0 C--N 1.281 -2.395 0 CA-C-N 114.7 -1.136 . . . . 0.0 111.603 179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . . . . . . . . . 4.6 mt -123.62 -10.5 7.86 Favored 'General case' 0 N--CA 1.49 1.528 0 C-N-CA 120.105 -0.638 . . . . 0.0 110.467 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -54.96 -67.42 2.21 Favored Glycine 0 N--CA 1.487 2.089 0 C-N-CA 119.628 -1.273 . . . . 0.0 110.944 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -171.6 -74.54 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.366 0 C-N-CA 119.109 -1.036 . . . . 0.0 111.002 179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . 174.45 138.36 2.69 Favored Glycine 0 N--CA 1.491 2.363 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.491 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.879 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -40.28 -38.99 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.213 0 C-N-CA 120.411 -0.515 . . . . 0.0 111.221 -179.891 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . . . . . . . . . . . -65.93 -61.62 1.95 Allowed 'General case' 0 C--N 1.301 -1.509 0 C-N-CA 119.047 -1.061 . . . . 0.0 110.891 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 48.9 m -38.75 -38.87 0.45 Allowed 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 113.505 0.928 . . . . 0.0 113.505 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 13.4 pt -82.27 -22.64 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.45 -179.698 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -64.85 -55.19 21.0 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 118.693 -1.203 . . . . 0.0 111.663 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.465 ' NE ' ' CD1' ' R' ' 1' ' ' TRP . 0.0 OUTLIER -72.91 -9.71 58.99 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.171 -1.012 . . . . 0.0 111.484 -179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -76.01 -32.79 52.01 Favored Glycine 0 N--CA 1.49 2.274 0 C-N-CA 119.089 -1.529 . . . . 0.0 110.775 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . 0.483 ' C ' ' H ' ' R' ' 88' ' ' SER . 0.0 OUTLIER -84.88 -55.82 3.89 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.484 -0.886 . . . . 0.0 111.213 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . 0.402 ' O ' ' C ' ' R' ' 88' ' ' SER . 25.1 m-80 -69.06 11.61 0.2 Allowed 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.324 -0.951 . . . . 0.0 111.264 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . 0.483 ' H ' ' C ' ' R' ' 86' ' ' SER . 0.3 OUTLIER -42.61 -31.27 0.43 Allowed 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.661 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 1.5 mt -50.22 -45.1 53.54 Favored 'General case' 0 C--N 1.301 -1.501 0 C-N-CA 119.271 -0.972 . . . . 0.0 110.875 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . 0.533 ' O ' ' N ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -107.47 -54.57 2.46 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 119.772 -0.771 . . . . 0.0 111.112 -179.93 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . 0.409 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.68 -27.78 0.01 OUTLIER 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.237 -1.347 . . . . 0.0 112.643 -179.886 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.533 ' N ' ' O ' ' R' ' 90' ' ' LYS . . . -88.0 156.12 52.26 Favored Pre-proline 0 N--CA 1.49 1.535 0 C-N-CA 118.674 -1.21 . . . . 0.0 110.698 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -51.84 129.58 30.86 Favored 'Trans proline' 0 C--N 1.325 -0.7 0 C-N-CA 121.445 1.43 . . . . 0.0 111.402 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . 0.416 HG23 ' H ' ' R' ' 94' ' ' VAL . 4.7 t -62.14 -12.47 8.17 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 C-N-CA 119.667 -0.813 . . . . 0.0 110.992 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -91.45 4.62 52.06 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.403 -0.919 . . . . 0.0 111.514 -179.93 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.5 tp -90.24 -49.86 6.31 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 118.833 -1.147 . . . . 0.0 111.415 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -44.1 -38.8 3.84 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.2 -1.0 . . . . 0.0 110.798 179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 55.7 mt-30 -58.7 -41.18 85.68 Favored 'General case' 0 C--N 1.304 -1.406 0 C-N-CA 119.691 -0.804 . . . . 0.0 111.516 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.668 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.3 t90 -84.85 -63.16 1.38 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.281 -0.967 . . . . 0.0 112.323 -179.855 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.474 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.6 mm? -41.06 -38.2 0.98 Allowed 'General case' 0 C--N 1.303 -1.427 0 C-N-CA 118.952 -1.099 . . . . 0.0 113.96 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.474 ' C ' ' O ' ' R' ' 100' ' ' LEU . 5.6 mm-40 -44.99 -29.65 0.87 Allowed 'General case' 0 C--N 1.298 -1.665 0 C-N-CA 117.851 -1.54 . . . . 0.0 107.856 179.838 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.465 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.6 mt-10 -94.58 -30.94 14.11 Favored 'General case' 0 C--N 1.301 -1.502 0 CA-C-N 113.304 -1.771 . . . . 0.0 111.818 179.928 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.668 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.6 t -89.67 -6.64 10.81 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.428 0 C-N-CA 117.466 -1.694 . . . . 0.0 110.503 -179.947 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 13.7 tp -104.02 -49.35 3.64 Favored 'General case' 0 C--N 1.299 -1.613 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.25 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.67 -68.5 0.64 Allowed 'General case' 0 C--N 1.309 -1.172 0 C-N-CA 119.755 -0.778 . . . . 0.0 112.255 -179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 45.1 tttp -57.33 -11.71 1.99 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 119.955 -0.698 . . . . 0.0 111.821 -179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 1.1 p . . . . . 0 C--N 1.303 -1.455 0 CA-C-O 116.326 -1.797 . . . . 0.0 110.964 179.919 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 19.2 tt0 . . . . . 0 N--CA 1.487 1.412 0 N-CA-C 110.316 -0.253 . . . . 0.0 110.316 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.55 164.24 16.61 Favored Pre-proline 0 N--CA 1.489 1.478 0 C-N-CA 119.665 -0.814 . . . . 0.0 110.829 -179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -59.09 -63.63 0.13 Allowed 'Trans proline' 0 C--N 1.322 -0.828 0 C-N-CA 121.472 1.448 . . . . 0.0 111.401 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -94.14 74.94 4.04 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.751 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 83.1 p -158.17 34.94 0.24 Allowed 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.186 -1.006 . . . . 0.0 111.203 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -96.32 -8.84 31.59 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.408 -0.917 . . . . 0.0 111.159 179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -94.91 140.41 29.97 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.554 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . 0.444 ' N ' ' SD ' ' S' ' 11' ' ' MET . 0.7 OUTLIER -116.58 81.96 1.71 Allowed 'General case' 0 N--CA 1.492 1.666 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.333 179.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.15 109.3 3.98 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.113 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -115.43 124.51 51.34 Favored 'General case' 0 N--CA 1.488 1.469 0 C-N-CA 119.847 -0.741 . . . . 0.0 110.909 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . 0.476 ' O ' ' N ' ' S' ' 17' ' ' GLN . 2.0 mt-30 -73.21 108.82 6.31 Favored 'General case' 0 C--N 1.302 -1.484 0 C-N-CA 119.199 -1.0 . . . . 0.0 109.556 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . 0.492 ' C ' ' H ' ' S' ' 17' ' ' GLN . 6.1 mtp180 -38.01 -32.41 0.06 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 119.815 -0.754 . . . . 0.0 111.325 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . 0.548 ' O ' ' CG ' ' S' ' 16' ' ' HIS . 43.6 t-80 -69.15 13.55 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.798 -0.761 . . . . 0.0 110.451 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.492 ' H ' ' C ' ' S' ' 15' ' ' ARG . 1.5 tp60 -91.26 -97.19 0.12 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 119.785 -0.766 . . . . 0.0 110.416 -179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.403 ' C ' ' O ' ' S' ' 17' ' ' GLN . 0.6 OUTLIER -44.36 -27.99 0.49 Allowed 'General case' 0 N--CA 1.494 1.729 0 CA-C-O 122.537 1.161 . . . . 0.0 108.638 179.786 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . 0.451 ' N ' ' C ' ' S' ' 17' ' ' GLN . 11.2 t-105 -48.87 -63.92 0.95 Allowed 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 113.782 -1.554 . . . . 0.0 108.444 179.761 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -44.51 -39.07 4.56 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-N 114.079 -1.419 . . . . 0.0 111.266 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.525 ' O ' ' N ' ' S' ' 24' ' ' ASP . 5.8 mmp_? -51.63 -71.12 0.07 Allowed 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 118.181 -1.408 . . . . 0.0 109.344 179.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.522 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -28.92 -44.7 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 119.797 -0.761 . . . . 0.0 111.202 179.656 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.424 ' N ' ' O ' ' S' ' 21' ' ' ARG . 99.1 t -70.32 -48.78 58.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.709 179.907 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.525 ' N ' ' O ' ' S' ' 21' ' ' ARG . 63.5 t0 -42.94 -72.83 0.05 Allowed 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.636 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.415 ' HG ' ' H ' ' S' ' 25' ' ' LEU . 0.2 OUTLIER -43.26 -45.97 6.03 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 119.711 -0.796 . . . . 0.0 109.952 179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -40.82 -59.71 1.35 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.58 -0.848 . . . . 0.0 111.941 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . 0.508 ' NZ ' ' CE1' ' R' ' 30' ' ' TYR . 0.1 OUTLIER -50.36 -70.35 0.09 Allowed 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.682 -0.807 . . . . 0.0 112.461 -179.84 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -49.16 -24.72 1.81 Allowed 'General case' 0 N--CA 1.491 1.599 0 N-CA-C 112.948 0.722 . . . . 0.0 112.948 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.73 -56.03 3.46 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 118.898 -1.121 . . . . 0.0 112.262 -179.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -47.86 -33.41 7.42 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 119.657 -0.817 . . . . 0.0 111.157 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -52.37 -28.9 21.37 Favored 'General case' 0 C--N 1.301 -1.507 0 C-N-CA 118.881 -1.128 . . . . 0.0 110.229 -179.975 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.492 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 7.4 m120 -111.45 -65.44 1.17 Allowed 'General case' 0 N--CA 1.489 1.487 0 CA-C-N 115.687 -0.688 . . . . 0.0 111.028 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.492 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.0 OUTLIER 164.24 -11.54 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 119.753 -0.779 . . . . 0.0 111.751 179.921 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . 0.514 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 3.7 mm? -59.11 -16.7 20.89 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 120.177 -0.609 . . . . 0.0 111.821 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . 0.444 ' ND1' ' O ' ' S' ' 33' ' ' ASP . 11.4 p-80 -48.43 -18.15 0.21 Allowed 'General case' 0 C--N 1.287 -2.135 0 C-N-CA 119.356 -0.938 . . . . 0.0 112.134 -179.981 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.714 HD21 ' NE2' ' R' ' 16' ' ' HIS . 6.2 mt -80.92 -65.63 0.26 Allowed Pre-proline 0 C--N 1.308 -1.219 0 C-N-CA 117.995 -1.482 . . . . 0.0 110.931 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.48 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.2 Cg_exo -50.31 -28.79 21.51 Favored 'Trans proline' 0 C--N 1.319 -0.987 0 C-N-CA 120.624 0.882 . . . . 0.0 110.975 179.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 16.6 mt -77.36 -41.54 39.91 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.326 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.493 ' C ' ' H ' ' S' ' 41' ' ' LEU . 0.3 OUTLIER -52.29 -43.34 64.42 Favored 'General case' 0 C--N 1.3 -1.57 0 C-N-CA 119.376 -0.93 . . . . 0.0 109.756 179.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . 0.416 ' O ' ' OXT' ' R' ' 1' ' ' TRP . 3.5 m-80 -71.39 13.12 0.26 Allowed 'General case' 0 C--N 1.297 -1.684 0 C-N-CA 119.447 -0.901 . . . . 0.0 110.83 -179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . 0.493 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.1 tp -113.71 -54.38 2.61 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 120.044 -0.662 . . . . 0.0 112.344 -179.915 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.22 7.12 17.16 Favored 'General case' 0 N--CA 1.497 1.912 0 C-N-CA 118.665 -1.214 . . . . 0.0 112.725 -179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 2.1 pp -177.03 153.35 0.98 Allowed 'General case' 0 N--CA 1.503 2.177 0 C-N-CA 119.998 -0.681 . . . . 0.0 110.305 179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.577 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.7 OUTLIER -179.05 -42.38 0.0 OUTLIER Pre-proline 0 N--CA 1.483 1.175 0 C-N-CA 117.783 -1.567 . . . . 0.0 114.762 179.873 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.577 ' HD2' ' H ' ' S' ' 44' ' ' THR . 14.4 Cg_endo -77.15 -105.23 0.01 OUTLIER 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 121.037 1.158 . . . . 0.0 112.88 -179.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . 0.4 ' OD1' ' O ' ' S' ' 46' ' ' ASP . 34.8 t0 -55.25 -6.18 0.15 Allowed 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.7 -0.8 . . . . 0.0 110.693 -179.856 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . 0.502 ' H ' ' C ' ' S' ' 45' ' ' PRO . 8.4 mm-40 -82.92 -59.45 2.49 Favored 'General case' 0 C--N 1.297 -1.699 0 C-N-CA 119.723 -0.791 . . . . 0.0 109.972 -179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . 0.621 ' NH1' ' CE3' ' R' ' 19' ' ' TRP . 19.4 tpt180 -54.83 -24.88 24.97 Favored 'General case' 0 C--N 1.305 -1.357 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.918 179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . 0.422 ' O ' ' OG1' ' S' ' 53' ' ' THR . 31.8 mt-10 -82.24 -71.13 0.5 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.147 -1.021 . . . . 0.0 111.745 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.53 -51.13 68.07 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 119.355 -0.938 . . . . 0.0 112.048 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -40.26 -61.84 0.84 Allowed 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 119.734 -0.786 . . . . 0.0 111.899 -179.848 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.38 -40.99 78.83 Favored Glycine 0 N--CA 1.489 2.177 0 C-N-CA 118.948 -1.596 . . . . 0.0 110.596 -179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.551 ' O ' HG22 ' S' ' 57' ' ' ILE . 0.2 OUTLIER -48.9 -77.27 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 120.12 -0.632 . . . . 0.0 112.221 179.954 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.78 ' HE ' ' N ' ' S' ' 54' ' ' ARG . 0.0 OUTLIER -44.15 -29.49 0.63 Allowed 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 119.296 -0.962 . . . . 0.0 110.805 -179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 96.8 t -81.52 -28.57 10.32 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.481 0 C-N-CA 118.269 -1.372 . . . . 0.0 110.527 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.464 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.0 OUTLIER -80.65 -36.03 33.07 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 119.502 -0.879 . . . . 0.0 110.843 -179.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 0.784 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -74.6 -38.94 46.55 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.326 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 179.869 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . 0.784 ' N ' HD13 ' S' ' 57' ' ' ILE . 3.1 t -55.81 -68.05 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.472 0 C-N-CA 118.635 -1.226 . . . . 0.0 109.369 179.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . 0.553 ' N ' HG12 ' S' ' 58' ' ' VAL . 11.8 tt0 -48.11 -33.24 7.92 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.766 -0.774 . . . . 0.0 111.886 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 6.1 mm-40 -67.78 -48.41 66.4 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.078 -1.049 . . . . 0.0 112.18 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . 0.755 ' O ' HD12 ' S' ' 61' ' ' LEU . 0.5 OUTLIER -61.58 -18.92 61.39 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 118.131 -1.428 . . . . 0.0 108.698 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . 0.614 ' O ' ' N ' ' S' ' 64' ' ' GLY . 1.7 tp -77.92 26.06 0.2 Allowed 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 114.814 -1.085 . . . . 0.0 109.858 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . 0.504 ' H ' ' C ' ' S' ' 61' ' ' LEU . 61.5 mtt180 19.34 38.67 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.095 0 O-C-N 124.398 1.061 . . . . 0.0 113.832 -179.843 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.614 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -70.59 -31.16 68.1 Favored Glycine 0 N--CA 1.49 2.288 0 C-N-CA 119.251 -1.452 . . . . 0.0 109.72 -179.975 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 81.7 mt-10 -116.44 -68.08 0.95 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 120.227 -0.589 . . . . 0.0 110.335 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 84.1 mtp -125.44 -133.51 0.26 Allowed 'General case' 0 N--CA 1.492 1.645 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.069 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . 0.569 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.3 OUTLIER 173.04 -71.78 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 118.903 -1.119 . . . . 0.0 110.544 -179.972 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.486 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.0 OUTLIER -22.99 -39.91 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.53 0 O-C-N 124.395 1.059 . . . . 0.0 113.405 179.947 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . 0.569 ' N ' ' O ' ' S' ' 67' ' ' SER . 6.4 tpt180 -71.96 32.43 0.06 Allowed 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 119.914 -0.714 . . . . 0.0 112.333 -179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.486 ' H ' ' C ' ' S' ' 68' ' ' GLN . 0.0 OUTLIER -111.68 6.95 20.2 Favored 'General case' 0 N--CA 1.495 1.783 0 CA-C-N 115.795 -0.639 . . . . 0.0 110.755 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 10.9 mt -83.42 145.83 28.77 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.349 -0.94 . . . . 0.0 111.514 -179.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 26.6 tttm -69.6 93.18 0.68 Allowed 'General case' 0 N--CA 1.49 1.546 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.911 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -84.59 -101.71 0.05 Allowed 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.782 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 8.0 pt-20 -141.12 -26.25 0.72 Allowed 'General case' 0 C--N 1.278 -2.522 0 CA-C-N 114.43 -1.259 . . . . 0.0 110.834 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 2.8 tp -126.68 7.85 6.88 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 120.166 -0.614 . . . . 0.0 110.027 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -54.39 -71.11 0.76 Allowed Glycine 0 N--CA 1.49 2.234 0 C-N-CA 119.577 -1.296 . . . . 0.0 110.897 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -170.74 -86.14 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.305 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -167.69 128.02 1.65 Allowed Glycine 0 N--CA 1.49 2.288 0 C-N-CA 118.913 -1.613 . . . . 0.0 111.367 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.84 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -38.71 -41.32 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.307 0 CA-C-N 115.393 -0.403 . . . . 0.0 111.099 179.929 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.447 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -66.62 -42.72 86.36 Favored 'General case' 0 C--N 1.301 -1.5 0 C-N-CA 118.807 -1.157 . . . . 0.0 110.835 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 19.1 m -53.17 -49.58 66.36 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 24.8 pt -72.8 11.13 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 -179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.447 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -105.96 -63.55 1.24 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 118.881 -1.128 . . . . 0.0 111.965 -179.9 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . 0.448 ' H ' ' HD2' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -58.29 -21.57 49.38 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 118.459 -1.297 . . . . 0.0 110.876 179.99 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -61.39 -29.96 72.93 Favored Glycine 0 N--CA 1.488 2.132 0 C-N-CA 119.345 -1.407 . . . . 0.0 110.714 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -100.55 -27.32 13.48 Favored 'General case' 0 N--CA 1.491 1.624 0 C-N-CA 119.554 -0.858 . . . . 0.0 111.266 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -101.79 10.29 40.07 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 119.719 -0.793 . . . . 0.0 110.578 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . 0.423 ' O ' ' C ' ' S' ' 89' ' ' LEU . 0.3 OUTLIER -46.48 -21.99 0.23 Allowed 'General case' 0 N--CA 1.489 1.492 0 C-N-CA 119.908 -0.717 . . . . 0.0 111.265 -179.945 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . 0.423 ' C ' ' O ' ' S' ' 88' ' ' SER . 75.8 mt -37.69 -72.05 0.07 Allowed 'General case' 0 N--CA 1.491 1.586 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.531 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . 0.498 ' O ' ' N ' ' S' ' 92' ' ' ALA . 0.0 OUTLIER -58.93 -55.68 32.0 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 118.803 -1.159 . . . . 0.0 110.823 -179.991 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.84 -24.17 0.02 OUTLIER 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.87 -179.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . 0.518 ' HB1' ' HD2' ' S' ' 93' ' ' PRO . . . -120.37 162.34 34.52 Favored Pre-proline 0 N--CA 1.492 1.646 0 C-N-CA 119.766 -0.774 . . . . 0.0 110.618 179.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . 0.518 ' HD2' ' HB1' ' S' ' 92' ' ' ALA . 1.2 Cg_endo -61.6 -178.33 0.28 Allowed 'Trans proline' 0 C--N 1.319 -0.98 0 C-N-CA 121.236 1.291 . . . . 0.0 111.394 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 24.5 t -100.5 -16.48 7.14 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.283 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.116 179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -70.41 -6.07 33.0 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.588 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.3 -24.91 62.23 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.993 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 13.7 mtt85 -78.22 -14.39 59.47 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.58 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 5.4 mm100 -104.77 -10.48 17.39 Favored 'General case' 0 N--CA 1.49 1.533 0 C-N-CA 119.996 -0.682 . . . . 0.0 110.979 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.794 ' CH2' HG21 ' S' ' 103' ' ' VAL . 22.7 t90 -107.02 -58.14 1.98 Allowed 'General case' 0 C--N 1.303 -1.434 0 CA-C-O 122.201 1.0 . . . . 0.0 112.459 -179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.575 HD21 HD13 ' S' ' 104' ' ' LEU . 0.6 OUTLIER -53.64 -37.56 63.22 Favored 'General case' 0 C--N 1.284 -2.257 0 N-CA-C 115.797 1.777 . . . . 0.0 115.797 -179.585 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.53 ' C ' ' O ' ' S' ' 100' ' ' LEU . 8.1 mt-10 -43.81 -32.14 0.99 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 116.939 -1.904 . . . . 0.0 106.215 179.699 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . 0.534 ' N ' ' C ' ' S' ' 100' ' ' LEU . 2.5 tt0 -83.79 -27.48 28.79 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 112.683 -2.053 . . . . 0.0 112.054 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.794 HG21 ' CH2' ' S' ' 99' ' ' TRP . 45.0 t -85.74 -32.12 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 C-N-CA 116.01 -2.276 . . . . 0.0 111.304 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . 0.575 HD13 HD21 ' S' ' 100' ' ' LEU . 2.1 mp -97.14 -55.83 2.73 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 119.053 -1.059 . . . . 0.0 113.417 179.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 15.5 mt -75.79 -81.27 0.08 Allowed 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 118.703 -1.199 . . . . 0.0 113.416 -179.658 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . 0.42 ' O ' ' O ' ' S' ' 102' ' ' GLU . 7.2 tttm -86.61 108.25 18.52 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 119.024 -1.07 . . . . 0.0 112.124 -179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.487 1.396 0 CA-C-O 116.328 -1.796 . . . . 0.0 110.832 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.465 ' CD1' ' NE ' ' R' ' 84' ' ' ARG . 29.9 m-90 . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 116.312 -1.804 . . . . 0.0 109.963 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . . . . . . . . . 12.1 m-90 . . . . . 0 N--CA 1.488 1.445 0 CA-C-O 116.477 -1.725 . . . . 0.0 110.436 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 . . . . . 0 N--CA 1.486 1.338 0 CA-C-O 120.793 0.33 . . . . 0.0 110.207 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 3.2 m -172.08 67.99 0.42 Allowed Pre-proline 0 C--N 1.305 -1.357 0 C-N-CA 119.059 -1.057 . . . . 0.0 111.661 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -65.8 -55.09 0.45 Allowed 'Trans proline' 0 C--N 1.313 -1.299 0 C-N-CA 121.373 1.382 . . . . 0.0 110.359 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 44.4 t80 -138.73 24.27 2.63 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-N 115.393 -0.822 . . . . 0.0 109.701 179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -39.35 108.28 0.08 Allowed 'General case' 0 N--CA 1.486 1.359 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.722 -179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -99.99 -0.38 39.4 Favored 'General case' 0 N--CA 1.487 1.413 0 C-N-CA 119.954 -0.698 . . . . 0.0 110.319 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -109.6 -88.2 0.5 Allowed 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.715 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 18.2 mmt -71.18 132.7 45.39 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.445 -0.902 . . . . 0.0 110.833 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -165.25 -29.38 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 119.6 -0.84 . . . . 0.0 110.588 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -131.88 63.25 1.62 Allowed 'General case' 0 N--CA 1.492 1.63 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.027 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -89.17 -6.38 56.99 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.106 -1.037 . . . . 0.0 110.786 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.3 mtm180 -133.7 108.05 8.3 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 119.763 -0.775 . . . . 0.0 111.19 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 9.1 t-80 -163.58 -13.52 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 CA-C-N 115.462 -0.79 . . . . 0.0 109.459 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.424 ' C ' ' N ' ' R' ' 19' ' ' TRP . 4.8 tt0 -88.78 -79.25 0.32 Allowed 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.626 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . 0.413 ' C ' ' O ' ' R' ' 17' ' ' GLN . 1.2 mp0 -41.9 -34.57 0.69 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 123.339 1.542 . . . . 0.0 108.3 179.694 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CZ3' ' CD ' ' S' ' 48' ' ' ARG . 21.9 t-105 -57.19 -55.66 31.86 Favored 'General case' 0 C--N 1.289 -2.05 0 CA-C-N 112.381 -2.19 . . . . 0.0 110.038 179.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . 0.4 ' N ' ' O ' ' R' ' 17' ' ' GLN . 6.6 tp -56.55 -27.62 58.12 Favored 'General case' 0 C--N 1.3 -1.571 0 CA-C-N 114.495 -1.23 . . . . 0.0 111.788 179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.592 ' O ' ' N ' ' R' ' 24' ' ' ASP . 0.0 OUTLIER -65.33 -62.71 1.37 Allowed 'General case' 0 N--CA 1.494 1.753 0 C-N-CA 118.558 -1.257 . . . . 0.0 109.578 179.975 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.499 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.2 OUTLIER -33.85 -43.93 0.15 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 119.375 -0.93 . . . . 0.0 110.305 179.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 19.7 t -73.27 -35.57 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.421 0 C-N-CA 119.549 -0.861 . . . . 0.0 110.2 179.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.592 ' N ' ' O ' ' R' ' 21' ' ' ARG . 34.7 t0 -59.56 -69.79 0.19 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 119.967 -0.693 . . . . 0.0 110.645 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -44.24 -41.29 5.75 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.246 -0.981 . . . . 0.0 109.689 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mt -48.86 -62.39 1.55 Allowed 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.497 -0.881 . . . . 0.0 112.225 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 3.1 mmmp? -59.94 -38.21 81.76 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 119.384 -0.926 . . . . 0.0 112.528 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 76.2 m-20 -61.52 -35.33 77.42 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.369 -0.932 . . . . 0.0 112.502 -179.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.605 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -94.31 -39.73 10.34 Favored 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.355 -179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -47.74 -29.48 3.13 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 119.474 -0.89 . . . . 0.0 112.035 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -52.32 -30.92 30.67 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 118.856 -1.138 . . . . 0.0 110.375 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -109.11 -79.68 0.58 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 120.055 -0.658 . . . . 0.0 111.234 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 p30 173.51 31.07 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.875 0 C-N-CA 120.081 -0.648 . . . . 0.0 110.097 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . 0.605 ' HB2' ' HB1' ' R' ' 29' ' ' ALA . 1.3 mm? -94.64 -21.95 18.47 Favored 'General case' 0 C--N 1.302 -1.489 0 CA-C-O 121.862 0.839 . . . . 0.0 110.202 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . 0.475 ' O ' HD22 ' R' ' 39' ' ' LEU . 13.8 p-80 -49.61 -23.49 1.71 Allowed 'General case' 0 C--N 1.288 -2.077 0 CA-C-N 114.296 -1.32 . . . . 0.0 113.962 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.495 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.3 mt -74.08 -66.02 0.54 Allowed Pre-proline 0 N--CA 1.487 1.412 0 C-N-CA 118.164 -1.414 . . . . 0.0 111.316 -179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.495 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 1.4 Cg_endo -52.74 -29.54 42.62 Favored 'Trans proline' 0 C--N 1.318 -1.034 0 C-N-CA 120.619 0.879 . . . . 0.0 110.301 179.776 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . 0.446 HD11 HD21 ' S' ' 96' ' ' LEU . 9.0 mp -82.04 -29.27 32.02 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.743 -0.783 . . . . 0.0 110.845 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.475 HD22 ' O ' ' R' ' 35' ' ' HIS . 0.0 OUTLIER -59.34 -30.66 68.53 Favored 'General case' 0 N--CA 1.485 1.3 0 N-CA-C 107.682 -1.229 . . . . 0.0 107.682 179.78 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . 0.453 ' CG ' HH12 ' R' ' 48' ' ' ARG . 0.8 OUTLIER -77.06 11.46 1.8 Allowed 'General case' 0 C--N 1.298 -1.67 0 C-N-CA 118.716 -1.194 . . . . 0.0 109.199 179.776 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . 0.458 ' H ' ' C ' ' R' ' 39' ' ' LEU . 0.2 OUTLIER -111.28 -69.0 0.89 Allowed 'General case' 0 N--CA 1.491 1.604 0 CA-C-N 115.122 -0.945 . . . . 0.0 111.335 -179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . 0.413 ' SD ' ' N ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -90.35 41.47 1.05 Allowed 'General case' 0 N--CA 1.504 2.228 0 C-N-CA 118.437 -1.305 . . . . 0.0 108.878 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . 0.421 ' O ' ' O ' ' R' ' 39' ' ' LEU . 4.5 tt 173.89 135.02 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.511 -1.662 . . . . 0.0 106.511 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.5 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -171.25 -38.31 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.892 0 C-N-CA 114.799 -2.76 . . . . 0.0 117.47 -179.437 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.5 ' CD ' ' H ' ' R' ' 44' ' ' THR . 71.7 Cg_endo -98.69 -105.31 0.0 OUTLIER 'Trans proline' 0 C--N 1.311 -1.442 0 C-N-CA 121.564 1.509 . . . . 0.0 114.869 -179.217 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -45.1 -28.84 0.78 Allowed 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 119.757 -0.777 . . . . 0.0 109.058 -179.694 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.765 ' OE1' HD11 ' S' ' 43' ' ' LEU . 7.7 mm-40 -57.66 -67.18 0.36 Allowed 'General case' 0 C--N 1.292 -1.895 0 C-N-CA 118.348 -1.341 . . . . 0.0 109.409 179.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . 0.538 HH21 ' NE2' ' S' ' 14' ' ' GLN . 1.9 tpp180 -42.92 -24.68 0.07 Allowed 'General case' 0 C--N 1.303 -1.432 0 CA-C-N 115.094 -0.957 . . . . 0.0 111.063 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . 0.468 ' N ' ' O ' ' R' ' 47' ' ' GLU . 11.9 mt-10 -96.03 -69.41 0.76 Allowed 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.125 -1.03 . . . . 0.0 113.509 -179.792 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.832 ' HB1' ' HE ' ' R' ' 54' ' ' ARG . . . -58.8 -27.27 64.89 Favored 'General case' 0 N--CA 1.499 2.011 0 N-CA-C 114.527 1.306 . . . . 0.0 114.527 -179.578 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . 1.027 HD23 ' N ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -71.71 -37.92 70.59 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 118.039 -1.464 . . . . 0.0 112.306 -179.671 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . 1.027 ' N ' HD23 ' R' ' 51' ' ' LEU . . . -71.21 -36.25 63.79 Favored Glycine 0 N--CA 1.489 2.185 0 N-CA-C 108.556 -1.817 . . . . 0.0 108.556 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.533 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -64.25 -79.65 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.899 0 CA-C-N 114.341 -0.929 . . . . 0.0 109.997 179.922 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.832 ' HE ' ' HB1' ' R' ' 50' ' ' ALA . 17.1 mtt-85 -32.44 -55.59 0.34 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.213 -1.358 . . . . 0.0 112.977 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 2.1 p -62.89 -30.31 49.24 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.459 0 C-N-CA 117.439 -1.704 . . . . 0.0 111.486 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.639 ' NH1' ' HE ' ' S' ' 21' ' ' ARG . 11.1 mmt180 -76.69 -45.29 30.16 Favored 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 118.749 -1.18 . . . . 0.0 111.297 179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -58.59 -65.61 0.42 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.986 0 C-N-CA 118.044 -1.462 . . . . 0.0 110.292 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 0.717 HG13 ' N ' ' R' ' 59' ' ' GLU . 9.4 p -45.71 -58.12 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.503 0 C-N-CA 117.963 -1.495 . . . . 0.0 111.203 -179.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.717 ' N ' HG13 ' R' ' 58' ' ' VAL . 78.6 mt-10 -54.64 -28.19 45.18 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.723 -1.191 . . . . 0.0 112.706 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -79.38 -51.73 9.02 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 118.937 -1.105 . . . . 0.0 112.98 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 13.3 mt -67.88 -9.82 48.02 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 118.655 -1.218 . . . . 0.0 111.532 -179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -73.55 -37.06 65.7 Favored 'General case' 0 C--N 1.304 -1.399 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.762 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 31.9 ttm-85 -111.19 -45.4 3.43 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 120.033 -0.667 . . . . 0.0 110.955 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . 0.545 ' C ' ' H ' ' R' ' 66' ' ' MET . . . -58.35 -27.22 60.32 Favored Glycine 0 N--CA 1.492 2.378 0 C-N-CA 119.454 -1.355 . . . . 0.0 110.511 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . . . . . . . . . 2.3 mt-10 61.23 -25.22 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.485 0 N-CA-C 113.31 0.856 . . . . 0.0 113.31 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . 0.545 ' H ' ' C ' ' R' ' 64' ' ' GLY . 30.5 mmm -140.22 109.03 5.97 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 119.683 -0.807 . . . . 0.0 110.588 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 17.5 p -173.67 76.73 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 119.653 -0.819 . . . . 0.0 109.875 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . 0.433 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.0 OUTLIER -125.3 -34.31 2.74 Favored 'General case' 0 N--CA 1.487 1.403 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.244 -179.906 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -78.31 27.25 0.2 Allowed 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 119.618 -0.833 . . . . 0.0 111.521 -179.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . 0.5 ' CG ' ' H ' ' R' ' 71' ' ' LEU . 0.9 OUTLIER -43.53 -65.09 0.54 Allowed 'General case' 0 C--N 1.297 -1.711 0 C-N-CA 118.915 -1.114 . . . . 0.0 110.546 179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . 0.5 ' H ' ' CG ' ' R' ' 70' ' ' GLU . 1.0 OUTLIER 178.61 -11.76 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.165 -1.014 . . . . 0.0 111.465 179.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 20.7 tttm 48.44 78.37 0.08 Allowed 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 118.697 -1.201 . . . . 0.0 109.948 -179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . 0.593 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.5 OUTLIER -90.31 12.45 18.22 Favored 'General case' 0 C--N 1.303 -1.437 0 C-N-CA 119.268 -0.973 . . . . 0.0 110.83 -179.904 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 52.62 -74.78 0.01 OUTLIER 'General case' 0 C--N 1.285 -2.23 0 CA-C-N 113.695 -1.593 . . . . 0.0 111.211 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.593 ' N ' ' O ' ' R' ' 73' ' ' ASN . 1.0 OUTLIER -58.31 -28.96 65.52 Favored 'General case' 0 C--N 1.294 -1.836 0 CA-C-N 115.432 -0.804 . . . . 0.0 110.418 -179.968 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -70.38 -44.81 57.7 Favored Glycine 0 N--CA 1.486 2.011 0 C-N-CA 119.354 -1.403 . . . . 0.0 109.675 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . 0.422 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . -167.05 90.53 0.37 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 119.8 -0.76 . . . . 0.0 110.186 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . 0.422 ' C ' ' O ' ' R' ' 77' ' ' ALA . . . -34.65 135.33 0.35 Allowed Glycine 0 N--CA 1.495 2.584 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.974 179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.878 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -35.6 -35.98 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.175 0 CA-C-N 115.057 -0.571 . . . . 0.0 111.103 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.504 ' HB1' ' NH2' ' R' ' 84' ' ' ARG . . . -58.17 -65.83 0.58 Allowed 'General case' 0 C--N 1.301 -1.523 0 C-N-CA 118.826 -1.149 . . . . 0.0 110.366 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . 0.434 ' HA ' ' HE1' ' R' ' 1' ' ' TRP . 53.2 m -40.42 -42.25 1.56 Allowed 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . 0.45 HG21 HD13 ' R' ' 82' ' ' ILE . 2.0 pt -85.71 -6.69 10.63 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.846 0 N-CA-C 114.7 1.37 . . . . 0.0 114.7 -179.671 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.414 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -78.81 -43.18 25.92 Favored 'General case' 0 N--CA 1.494 1.735 0 C-N-CA 118.209 -1.397 . . . . 0.0 111.807 179.965 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.504 ' NH2' ' HB1' ' R' ' 80' ' ' ALA . 1.8 ptp180 -67.22 -23.53 65.74 Favored 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 119.29 -0.964 . . . . 0.0 111.653 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -46.78 -28.44 3.75 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.229 -1.462 . . . . 0.0 110.194 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 68.0 m -89.4 -32.33 17.32 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.576 -0.85 . . . . 0.0 111.278 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . 0.524 ' O ' ' N ' ' R' ' 89' ' ' LEU . 5.2 m-20 -86.27 10.66 14.1 Favored 'General case' 0 N--CA 1.489 1.499 0 C-N-CA 119.291 -0.963 . . . . 0.0 110.88 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -40.68 -21.56 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.602 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.698 -179.971 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . 0.524 ' N ' ' O ' ' R' ' 87' ' ' ASN . 72.1 mt -58.19 -67.23 0.37 Allowed 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.87 -0.732 . . . . 0.0 112.94 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . 0.406 ' HG3' ' H ' ' R' ' 90' ' ' LYS . 0.0 OUTLIER -91.8 -27.09 18.21 Favored 'General case' 0 N--CA 1.497 1.896 0 C-N-CA 119.136 -1.026 . . . . 0.0 113.466 -179.812 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -60.21 -50.84 72.08 Favored 'General case' 0 C--N 1.284 -2.271 0 C-N-CA 118.72 -1.192 . . . . 0.0 112.827 -179.646 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.57 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -91.66 162.46 31.3 Favored Pre-proline 0 N--CA 1.489 1.521 0 C-N-CA 119.152 -1.019 . . . . 0.0 111.373 -179.921 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . 0.57 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.8 Cg_exo -51.53 142.13 40.19 Favored 'Trans proline' 0 C--N 1.323 -0.781 0 C-N-CA 121.628 1.552 . . . . 0.0 112.038 -179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 23.6 t -92.61 -15.63 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.541 -0.864 . . . . 0.0 111.122 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -70.9 -3.8 21.1 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.04 -1.064 . . . . 0.0 110.284 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . 0.57 HD11 HD22 ' S' ' 38' ' ' LEU . 1.6 tp -67.6 -44.11 78.9 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.043 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.81 -19.15 0.89 Allowed 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.382 -179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -70.59 -34.25 71.97 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.037 -1.065 . . . . 0.0 110.704 179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.65 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 15.7 t90 -100.38 -57.46 2.11 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.505 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.524 HD13 ' HB ' ' R' ' 103' ' ' VAL . 2.0 mm? -41.54 -34.97 0.63 Allowed 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 118.72 -1.192 . . . . 0.0 113.556 179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' R' ' 100' ' ' LEU . 0.5 OUTLIER -44.48 -31.0 0.96 Allowed 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 117.851 -1.54 . . . . 0.0 108.449 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.451 ' N ' ' C ' ' R' ' 100' ' ' LEU . 1.8 mt-10 -95.53 -29.5 14.33 Favored 'General case' 0 C--N 1.301 -1.509 0 CA-C-N 114.081 -1.418 . . . . 0.0 111.803 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.65 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 4.2 t -81.16 -20.92 10.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 C-N-CA 116.792 -1.963 . . . . 0.0 110.678 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 6.8 tp -92.45 -55.35 3.44 Favored 'General case' 0 C--N 1.309 -1.189 0 C-N-CA 120.115 -0.634 . . . . 0.0 110.158 179.683 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 2.6 tp -50.78 -41.91 57.44 Favored 'General case' 0 C--N 1.308 -1.197 0 C-N-CA 120.06 -0.656 . . . . 0.0 111.291 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 9.8 tttt -40.53 -73.95 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 C-N-CA 119.688 -0.805 . . . . 0.0 111.297 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 1.3 m . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 116.32 -1.8 . . . . 0.0 110.717 -179.944 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . 0.422 ' O ' ' O ' ' S' ' 5' ' ' SER . 4.3 tt0 . . . . . 0 N--CA 1.485 1.28 0 CA-C-O 121.079 0.466 . . . . 0.0 110.396 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . 0.422 ' O ' ' O ' ' S' ' 4' ' ' GLN . 0.0 OUTLIER 57.35 157.11 0.08 OUTLIER Pre-proline 0 N--CA 1.492 1.635 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.641 -179.955 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -59.05 142.81 99.78 Favored 'Trans proline' 0 C--N 1.324 -0.756 0 C-N-CA 121.574 1.516 . . . . 0.0 111.999 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -108.04 -19.0 13.65 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 119.877 -0.729 . . . . 0.0 110.513 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 66.2 m -150.73 146.51 26.48 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.753 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -146.34 173.07 12.58 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.734 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -77.46 -59.25 2.86 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 119.287 -0.965 . . . . 0.0 111.205 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . 0.473 ' O ' ' HB3' ' S' ' 12' ' ' ALA . 7.9 tpt -164.43 -16.9 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 118.597 -1.241 . . . . 0.0 111.781 -179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . 0.473 ' HB3' ' O ' ' S' ' 11' ' ' MET . . . 61.19 -155.55 0.35 Allowed 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.063 -1.055 . . . . 0.0 110.556 179.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 pt-20 -139.66 5.81 2.22 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.29 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . 0.538 ' NE2' HH21 ' R' ' 48' ' ' ARG . 51.4 mt-30 -83.5 159.74 21.64 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.173 -1.011 . . . . 0.0 110.356 179.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 45.0 mtt180 -93.97 121.47 35.47 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.706 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 t-80 -129.26 -11.79 4.59 Favored 'General case' 0 N--CA 1.493 1.687 0 CA-C-N 115.593 -0.73 . . . . 0.0 110.321 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.525 ' OE1' ' N ' ' S' ' 17' ' ' GLN . 4.7 mp0 -89.83 -76.94 0.41 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.94 -0.704 . . . . 0.0 110.627 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.428 ' C ' ' O ' ' S' ' 17' ' ' GLN . 5.5 mt-10 -42.13 -30.99 0.33 Allowed 'General case' 0 N--CA 1.494 1.772 0 CA-C-O 122.721 1.248 . . . . 0.0 108.328 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . 0.472 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.254 56.0 t-105 -49.76 -56.04 11.75 Favored 'General case' 0 C--N 1.298 -1.67 0 CA-C-N 112.476 -2.147 . . . . 0.0 109.809 179.76 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 5.3 tp -52.43 -40.21 61.93 Favored 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 113.841 -1.527 . . . . 0.0 112.045 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.639 ' HE ' ' NH1' ' R' ' 56' ' ' ARG . 4.3 mtt-85 -59.21 -72.64 0.1 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 117.885 -1.526 . . . . 0.0 109.14 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.552 ' CD2' HD12 ' R' ' 51' ' ' LEU . 0.0 OUTLIER -32.1 -44.47 0.09 Allowed 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 119.564 -0.855 . . . . 0.0 111.17 179.62 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.464 ' O ' ' N ' ' S' ' 26' ' ' LEU . 71.0 t -63.28 -61.9 1.45 Allowed 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 C-N-CA 119.827 -0.749 . . . . 0.0 110.481 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.414 ' C ' ' O ' ' S' ' 23' ' ' VAL . 41.9 t0 -32.55 -55.37 0.35 Allowed 'General case' 0 N--CA 1.491 1.61 0 CA-C-N 115.031 -0.986 . . . . 0.0 112.137 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.479 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.7 OUTLIER -60.78 -42.23 97.14 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.802 -1.159 . . . . 0.0 110.351 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.464 ' N ' ' O ' ' S' ' 23' ' ' VAL . 1.0 OUTLIER -54.2 -56.38 18.86 Favored 'General case' 0 N--CA 1.49 1.548 0 C-N-CA 119.668 -0.813 . . . . 0.0 112.06 -179.964 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -58.46 -56.86 16.7 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 112.859 0.689 . . . . 0.0 112.859 -179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 m-80 -60.9 -49.87 75.72 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.269 -0.973 . . . . 0.0 112.385 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . 0.501 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -52.99 -37.93 61.81 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 118.714 -1.194 . . . . 0.0 111.383 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 43.7 t80 -52.1 -43.42 63.92 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 118.456 -1.297 . . . . 0.0 109.807 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -57.94 -37.72 74.63 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.277 -0.969 . . . . 0.0 109.5 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.5 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -89.68 -12.13 40.41 Favored 'General case' 0 C--N 1.304 -1.401 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.366 179.882 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.501 ' N ' ' O ' ' S' ' 29' ' ' ALA . 3.1 t70 78.57 3.91 2.59 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 115.719 -0.673 . . . . 0.0 109.3 179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.95 -0.06 33.55 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-N 114.958 -1.019 . . . . 0.0 108.714 179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . 0.464 ' N ' ' ND1' ' S' ' 35' ' ' HIS . 0.8 OUTLIER -56.91 -15.77 5.52 Favored 'General case' 0 C--N 1.292 -1.913 0 CA-C-N 114.311 -1.313 . . . . 0.0 111.666 179.938 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.454 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 9.0 mt -76.68 -63.88 0.52 Allowed Pre-proline 0 C--N 1.304 -1.373 0 C-N-CA 118.37 -1.332 . . . . 0.0 110.299 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.454 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.7 Cg_endo -52.32 -37.71 71.71 Favored 'Trans proline' 0 C--N 1.319 -0.991 0 N-CA-C 109.716 -0.917 . . . . 0.0 109.716 179.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . 0.57 HD22 HD11 ' R' ' 96' ' ' LEU . 3.8 mm? -66.65 -41.76 87.71 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.629 -0.828 . . . . 0.0 109.405 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.514 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.2 OUTLIER -59.08 -14.37 9.7 Favored 'General case' 0 C--N 1.311 -1.073 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 179.639 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . 0.411 ' HA ' ' HG1' ' S' ' 44' ' ' THR . 0.6 OUTLIER -91.21 -11.51 38.07 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 114.886 -1.052 . . . . 0.0 112.423 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 2.3 mt -101.61 -65.82 0.96 Allowed 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 119.563 -0.855 . . . . 0.0 112.668 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.16 37.54 0.73 Allowed 'General case' 0 N--CA 1.494 1.748 0 C-N-CA 118.38 -1.328 . . . . 0.0 110.29 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . 0.765 HD11 ' OE1' ' R' ' 47' ' ' GLU . 1.9 tp 172.5 132.51 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 CA-C-N 114.614 -1.175 . . . . 0.0 107.995 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.437 ' CB ' ' O ' ' S' ' 43' ' ' LEU . 0.7 OUTLIER -176.47 -48.13 0.0 OUTLIER Pre-proline 0 N--CA 1.486 1.335 0 C-N-CA 114.927 -2.709 . . . . 0.0 117.569 179.867 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . . . . . . . . . 42.0 Cg_endo -84.2 -101.81 0.0 OUTLIER 'Trans proline' 0 CA--C 1.548 1.223 0 N-CA-C 115.284 1.225 . . . . 0.0 115.284 -179.362 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -52.79 -23.36 6.73 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 119.977 -0.689 . . . . 0.0 110.837 -179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . 0.554 ' CD ' ' N ' ' S' ' 47' ' ' GLU . 0.0 OUTLIER -62.78 -55.23 28.34 Favored 'General case' 0 C--N 1.295 -1.801 0 C-N-CA 119.17 -1.012 . . . . 0.0 109.815 -179.982 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . 0.441 ' CD ' ' CZ3' ' R' ' 19' ' ' TRP . 14.7 mmm-85 -52.47 -39.78 61.55 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.505 179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -70.25 -71.75 0.23 Allowed 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.422 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . . . . . . . . . . . -48.31 -25.53 1.61 Allowed 'General case' 0 C--N 1.305 -1.346 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.557 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.14 -63.95 1.05 Allowed 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 119.383 -0.927 . . . . 0.0 111.142 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.26 -40.91 11.04 Favored Glycine 0 N--CA 1.483 1.798 0 C-N-CA 118.632 -1.747 . . . . 0.0 109.153 179.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.444 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -54.38 -82.2 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.831 -0.748 . . . . 0.0 112.943 -179.969 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.511 ' HB3' ' CE3' ' R' ' 109' ' ' TRP . 5.3 ptt180 -43.46 -40.79 3.99 Favored 'General case' 0 C--N 1.295 -1.788 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.668 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 66.1 t -64.61 -34.07 67.34 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.267 0 C-N-CA 117.73 -1.588 . . . . 0.0 110.588 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.444 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.6 OUTLIER -82.98 -36.03 25.41 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 118.023 -1.471 . . . . 0.0 112.578 -179.787 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 0.702 ' C ' HD12 ' S' ' 57' ' ' ILE . 0.3 OUTLIER -64.67 -40.1 87.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 115.861 -2.336 . . . . 0.0 106.597 179.843 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . . . . . . . . . 38.5 t -62.63 -67.76 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 118.512 -1.275 . . . . 0.0 109.218 179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . 0.452 ' O ' ' OE1' ' S' ' 59' ' ' GLU . 0.0 OUTLIER -45.34 -41.89 9.39 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.287 179.789 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . 0.425 ' O ' ' N ' ' S' ' 63' ' ' ARG . 16.6 mm-40 -58.75 -45.52 89.53 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.931 -1.108 . . . . 0.0 111.074 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 16.2 mt -51.31 -47.63 62.56 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 118.273 -1.371 . . . . 0.0 108.83 179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.52 -23.56 58.46 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 118.859 -1.136 . . . . 0.0 108.653 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . 0.45 ' C ' ' H ' ' S' ' 65' ' ' GLU . 4.3 tpt180 -91.74 22.7 3.98 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-N 115.1 -0.954 . . . . 0.0 109.941 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . . . . . . . . . . . -52.25 -8.84 0.52 Allowed Glycine 0 N--CA 1.492 2.432 0 C-N-CA 119.773 -1.203 . . . . 0.0 111.064 -179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . 0.45 ' H ' ' C ' ' S' ' 63' ' ' ARG . 4.5 mt-10 -47.71 -30.54 3.92 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 119.116 -1.034 . . . . 0.0 110.54 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -137.48 127.14 25.29 Favored 'General case' 0 C--N 1.304 -1.38 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.594 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 36.6 t -171.54 73.74 0.05 Allowed 'General case' 0 C--N 1.304 -1.404 0 C-N-CA 118.844 -1.143 . . . . 0.0 111.376 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -117.86 -50.09 2.51 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.616 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 6.4 tpt180 -97.56 27.17 4.46 Favored 'General case' 0 C--N 1.305 -1.335 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.115 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . . . . . . . . . 17.5 mt-10 -125.56 -13.22 6.57 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 114.93 -1.032 . . . . 0.0 111.923 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . 0.423 ' O ' ' C ' ' S' ' 72' ' ' LYS . 0.5 OUTLIER -48.83 155.68 0.56 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 118.279 -1.369 . . . . 0.0 111.186 -179.95 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . 0.423 ' C ' ' O ' ' S' ' 71' ' ' LEU . 0.9 OUTLIER -23.87 109.98 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.912 0 CA-C-N 114.608 -1.178 . . . . 0.0 113.919 179.903 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . 0.537 ' O ' ' N ' ' S' ' 75' ' ' LEU . 29.2 t30 -93.97 18.29 10.81 Favored 'General case' 0 N--CA 1.489 1.491 0 CA-C-O 122.231 1.015 . . . . 0.0 108.866 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 43.04 8.47 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 CA-C-N 112.382 -2.19 . . . . 0.0 113.449 179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . 0.537 ' N ' ' O ' ' S' ' 73' ' ' ASN . 8.8 mt -128.99 -46.29 1.25 Allowed 'General case' 0 N--CA 1.496 1.852 0 C-N-CA 119.284 -0.967 . . . . 0.0 111.465 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -66.62 -31.41 78.49 Favored Glycine 0 N--CA 1.492 2.43 0 C-N-CA 119.7 -1.238 . . . . 0.0 112.451 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . 0.403 ' O ' ' C ' ' S' ' 78' ' ' GLY . . . -176.74 99.75 0.05 Allowed 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 118.64 -1.224 . . . . 0.0 111.033 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . 0.418 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -36.35 142.05 0.18 Allowed Glycine 0 N--CA 1.494 2.558 0 C-N-CA 120.427 -0.892 . . . . 0.0 111.791 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.76 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -36.75 -30.77 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.303 -1.417 0 N-CA-C 112.53 0.567 . . . . 0.0 112.53 -179.961 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -45.98 -66.9 0.33 Allowed 'General case' 0 N--CA 1.494 1.745 0 C-N-CA 119.395 -0.922 . . . . 0.0 112.74 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . . . . . . . . . 1.5 m -40.11 -69.53 0.13 Allowed 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . 0.578 ' HA ' HD13 ' S' ' 57' ' ' ILE . 19.4 pt -52.62 -14.23 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.849 0 N-CA-C 115.621 1.712 . . . . 0.0 115.621 -179.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.537 ' O ' ' N ' ' S' ' 85' ' ' GLY . 0.0 OUTLIER -94.28 -60.39 1.74 Allowed 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 118.367 -1.333 . . . . 0.0 112.792 -179.905 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 2.5 ptm180 -50.16 -5.93 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 119.014 -1.074 . . . . 0.0 111.55 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . 0.537 ' N ' ' O ' ' S' ' 83' ' ' THR . . . -48.6 -58.05 7.83 Favored Glycine 0 N--CA 1.487 2.037 0 C-N-CA 119.584 -1.293 . . . . 0.0 110.845 179.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . 0.424 ' O ' ' OG ' ' S' ' 86' ' ' SER . 17.3 p -174.25 46.69 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.063 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 18.5 p-10 -98.56 -27.17 14.15 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.267 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . 0.463 ' C ' ' H ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -129.79 -38.35 1.49 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.877 -179.908 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 10.2 mt -63.0 -2.42 1.22 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.615 -0.834 . . . . 0.0 110.306 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . 0.463 ' H ' ' C ' ' S' ' 88' ' ' SER . 0.8 OUTLIER -68.89 -40.68 79.05 Favored 'General case' 0 C--N 1.296 -1.73 0 CA-C-N 115.017 -0.992 . . . . 0.0 113.026 -179.828 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -87.69 -22.66 24.53 Favored 'General case' 0 C--N 1.285 -2.238 0 N-CA-C 114.993 1.479 . . . . 0.0 114.993 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . 0.755 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . -52.02 -56.39 22.16 Favored Pre-proline 0 N--CA 1.49 1.541 0 C-N-CA 117.836 -1.546 . . . . 0.0 112.084 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . 0.755 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 31.4 Cg_endo -83.05 126.41 4.37 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 120.802 1.001 . . . . 0.0 110.03 179.861 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . 0.534 ' C ' ' H ' ' S' ' 96' ' ' LEU . 15.4 t -86.44 -37.3 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 C-N-CA 118.594 -1.242 . . . . 0.0 111.829 -179.942 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -58.66 -3.14 0.27 Allowed 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 118.945 -1.102 . . . . 0.0 109.901 179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . 0.534 ' H ' ' C ' ' S' ' 94' ' ' VAL . 0.2 OUTLIER -85.83 -29.84 23.44 Favored 'General case' 0 N--CA 1.487 1.389 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.486 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.33 -8.43 25.25 Favored 'General case' 0 N--CA 1.494 1.728 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -179.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -103.79 -6.12 21.76 Favored 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.18 -1.008 . . . . 0.0 111.336 -179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -113.22 -64.43 1.31 Allowed 'General case' 0 N--CA 1.496 1.865 0 N-CA-C 113.554 0.946 . . . . 0.0 113.554 -179.808 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 1.048 HD22 ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -9.2 -84.87 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 120.865 3.654 . . . . 0.0 120.865 -179.581 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 1.048 ' H ' HD22 ' S' ' 100' ' ' LEU . 3.5 mm-40 -92.71 -37.52 12.33 Favored 'General case' 0 C--N 1.278 -2.507 0 C-N-CA 119.273 -0.971 . . . . 0.0 110.462 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . 0.419 ' C ' ' O ' ' S' ' 101' ' ' GLU . 2.0 tt0 -53.57 -19.06 3.39 Favored 'General case' 0 C--N 1.301 -1.5 0 N-CA-C 104.864 -2.273 . . . . 0.0 104.864 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.591 ' N ' ' C ' ' S' ' 101' ' ' GLU . 95.2 t -108.15 -67.13 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 CA-C-N 113.674 -1.603 . . . . 0.0 112.161 179.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 9.7 mt -43.93 -55.52 4.54 Favored 'General case' 0 N--CA 1.5 2.051 0 C-N-CA 117.936 -1.506 . . . . 0.0 111.331 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . 0.408 ' HA ' HD12 ' S' ' 105' ' ' LEU . 12.9 tp -56.85 -71.05 0.1 Allowed 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.836 -179.8 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 30.9 mmtt -48.45 -38.12 19.0 Favored 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 119.333 -0.947 . . . . 0.0 111.97 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 1.4 t . . . . . 0 N--CA 1.49 1.531 0 CA-C-O 116.398 -1.763 . . . . 0.0 110.851 179.929 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.554 ' CD1' ' NH1' ' R' ' 54' ' ' ARG . 0.8 OUTLIER . . . . . 0 N--CA 1.486 1.347 0 CA-C-O 116.31 -1.805 . . . . 0.0 110.031 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.511 ' CE3' ' HB3' ' S' ' 54' ' ' ARG . 2.8 p90 . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 116.114 -1.898 . . . . 0.0 108.777 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 . . . . . 0 N--CA 1.485 1.307 0 CA-C-O 120.9 0.381 . . . . 0.0 110.033 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 84.2 p -165.03 68.47 1.31 Allowed Pre-proline 0 N--CA 1.487 1.377 0 C-N-CA 119.472 -0.891 . . . . 0.0 111.082 179.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.27 -36.48 35.78 Favored 'Trans proline' 0 C--N 1.315 -1.205 0 C-N-CA 121.65 1.567 . . . . 0.0 111.454 -179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 3.6 t80 67.07 37.14 3.87 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 119.415 -0.914 . . . . 0.0 110.768 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 14.7 t -150.93 9.72 0.59 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.38 -0.928 . . . . 0.0 110.814 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . 48.73 70.9 0.41 Allowed 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.819 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -174.58 176.43 2.32 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.782 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 4.5 ptt? -165.81 -19.96 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.907 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . 0.476 ' C ' ' H ' ' R' ' 14' ' ' GLN . . . -70.05 -78.6 0.07 Allowed 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.374 -0.93 . . . . 0.0 110.751 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 tt0 -76.09 30.68 0.12 Allowed 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 119.329 -0.949 . . . . 0.0 110.58 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . 0.476 ' H ' ' C ' ' R' ' 12' ' ' ALA . 4.8 tt0 -58.31 137.27 57.28 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 119.531 -0.868 . . . . 0.0 110.809 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 60.0 mtt85 -74.6 105.15 5.57 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.306 -0.957 . . . . 0.0 110.961 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 t-80 -147.25 -6.04 0.49 Allowed 'General case' 0 C--N 1.303 -1.453 0 C-N-CA 119.65 -0.82 . . . . 0.0 110.572 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.49 ' O ' ' N ' ' R' ' 20' ' ' LEU . 1.5 mt-30 -97.61 -79.59 0.46 Allowed 'General case' 0 N--CA 1.49 1.539 0 C-N-CA 119.744 -0.782 . . . . 0.0 109.648 179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . 0.552 ' H ' ' CD ' ' R' ' 18' ' ' GLU . 1.9 mp0 -47.21 -28.69 1.98 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.647 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . 0.48 ' N ' ' C ' ' R' ' 17' ' ' GLN . 10.9 t-105 -62.56 -53.23 57.78 Favored 'General case' 0 C--N 1.3 -1.572 0 CA-C-N 112.635 -2.075 . . . . 0.0 107.308 179.609 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . 0.49 ' N ' ' O ' ' R' ' 17' ' ' GLN . 0.8 OUTLIER -56.77 -38.06 71.94 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 113.37 -1.741 . . . . 0.0 110.249 179.708 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.518 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mtt180 -52.59 -70.07 0.1 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 118.352 -1.339 . . . . 0.0 108.625 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.518 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -28.55 -47.65 0.05 Allowed 'General case' 0 N--CA 1.477 0.914 0 O-C-N 123.552 0.532 . . . . 0.0 110.698 179.386 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . . . . . . . . . 22.6 t -68.94 -49.18 65.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.512 0 CA-C-N 115.516 -0.765 . . . . 0.0 110.675 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.502 ' N ' ' O ' ' R' ' 21' ' ' ARG . 21.6 t70 -46.45 -76.45 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 119.83 -0.748 . . . . 0.0 110.94 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.618 HD12 ' SD ' ' R' ' 42' ' ' MET . 0.4 OUTLIER -41.49 -41.53 2.11 Favored 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.828 -179.985 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.35 -59.25 4.17 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.052 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 24.2 tttt -71.5 -38.21 71.17 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 119.85 -0.74 . . . . 0.0 111.693 -179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -60.27 -15.22 23.01 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.664 -0.814 . . . . 0.0 111.997 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . . . . . . . . . . . -104.73 -43.35 5.14 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 119.463 -0.895 . . . . 0.0 112.013 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -43.35 -27.76 0.28 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 119.207 -0.997 . . . . 0.0 110.906 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -51.54 -42.96 62.16 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 119.331 -0.948 . . . . 0.0 110.524 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . 0.41 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 9.7 m-80 -102.18 -72.14 0.7 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.68 -0.808 . . . . 0.0 111.494 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . 0.718 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.5 OUTLIER 169.77 18.12 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 119.39 -0.924 . . . . 0.0 112.425 -179.893 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . 1.023 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.1 OUTLIER -92.29 -7.97 46.48 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 118.861 -1.136 . . . . 0.0 110.126 -179.972 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 40.1 p-80 -51.72 -13.21 0.24 Allowed 'General case' 0 C--N 1.293 -1.849 0 C-N-CA 119.385 -0.926 . . . . 0.0 111.981 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.47 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.5 mt -81.41 -65.55 0.25 Allowed Pre-proline 0 N--CA 1.482 1.131 0 C-N-CA 118.141 -1.424 . . . . 0.0 110.1 179.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.47 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 5.7 Cg_exo -49.51 -27.62 14.62 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 N-CA-C 109.968 -0.82 . . . . 0.0 109.968 179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . 0.538 HD21 ' CZ3' ' S' ' 99' ' ' TRP . 8.0 mp -76.41 -41.87 46.21 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 119.76 -0.776 . . . . 0.0 109.796 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.467 HD12 ' HA ' ' R' ' 39' ' ' LEU . 1.3 tp -50.17 -47.68 54.33 Favored 'General case' 0 C--N 1.308 -1.21 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.464 179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . 0.572 ' O ' ' N ' ' R' ' 109' ' ' TRP . 1.1 m120 -70.78 3.13 3.44 Favored 'General case' 0 C--N 1.303 -1.433 0 CA-C-N 115.531 -0.759 . . . . 0.0 112.056 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 mt -110.76 -62.08 1.59 Allowed 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 119.647 -0.821 . . . . 0.0 112.764 -179.867 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . 0.618 ' SD ' HD12 ' R' ' 25' ' ' LEU . 0.1 OUTLIER -82.57 29.79 0.43 Allowed 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 118.399 -1.32 . . . . 0.0 113.08 -179.856 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . 0.465 ' O ' ' O ' ' R' ' 39' ' ' LEU . 0.8 OUTLIER 163.39 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.288 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.537 179.756 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.638 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.6 OUTLIER -176.82 -41.22 0.0 OUTLIER Pre-proline 0 C--N 1.311 -1.097 0 C-N-CA 117.937 -1.505 . . . . 0.0 114.026 -179.962 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.638 ' HD2' ' H ' ' R' ' 44' ' ' THR . 14.6 Cg_endo -78.85 -102.96 0.01 OUTLIER 'Trans proline' 0 C--N 1.315 -1.187 0 C-N-CA 120.826 1.017 . . . . 0.0 112.337 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -56.05 -14.21 2.46 Favored 'General case' 0 C--N 1.308 -1.224 0 C-N-CA 119.215 -0.994 . . . . 0.0 110.172 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.624 ' O ' HD13 ' R' ' 51' ' ' LEU . 0.7 OUTLIER -77.64 -55.65 5.17 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 119.33 -0.948 . . . . 0.0 110.127 179.902 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 9.3 ttp180 -49.06 -37.83 22.32 Favored 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.135 -1.026 . . . . 0.0 109.253 179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . 0.401 ' O ' ' OG1' ' R' ' 53' ' ' THR . 6.5 mt-10 -65.52 -67.74 0.42 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.614 179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' R' ' 53' ' ' THR . . . -49.45 -34.06 15.79 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 115.493 -0.776 . . . . 0.0 112.036 -179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . 0.624 HD13 ' O ' ' R' ' 47' ' ' GLU . 4.2 mp -53.71 -77.65 0.02 OUTLIER 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 119.46 -0.896 . . . . 0.0 111.54 -179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.16 -51.25 11.66 Favored Glycine 0 N--CA 1.494 2.507 0 C-N-CA 119.784 -1.198 . . . . 0.0 111.548 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' R' ' 50' ' ' ALA . 0.1 OUTLIER -42.08 -81.23 0.01 OUTLIER 'General case' 0 C--N 1.299 -1.603 0 CA-C-O 121.754 0.788 . . . . 0.0 111.458 -179.955 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.449 ' C ' ' CD ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -34.36 -52.1 0.47 Allowed 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 114.036 -1.438 . . . . 0.0 112.823 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.7 t -60.62 -32.91 52.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 C-N-CA 119.191 -1.004 . . . . 0.0 112.519 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -81.35 -33.09 32.64 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 118.356 -1.337 . . . . 0.0 111.899 -179.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 0.743 ' O ' HD12 ' R' ' 57' ' ' ILE . 0.0 OUTLIER -78.06 -47.59 24.66 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.262 0 C-N-CA 118.67 -1.212 . . . . 0.0 107.763 179.786 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . . . . . . . . . 42.9 t -53.77 -63.26 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.453 0 C-N-CA 119.077 -1.049 . . . . 0.0 110.325 179.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -52.13 -38.31 57.09 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 119.581 -0.847 . . . . 0.0 111.875 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 13.9 mm-40 -63.24 -30.57 71.68 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 119.481 -0.887 . . . . 0.0 112.979 -179.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . 0.65 ' C ' HD12 ' R' ' 61' ' ' LEU . 0.4 OUTLIER -85.14 -27.55 26.14 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 118.413 -1.315 . . . . 0.0 111.451 -179.841 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.11 -48.67 64.67 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.184 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 6.3 ptt180 -106.84 1.1 24.49 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.856 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . . . . . . . . . . . -93.68 24.92 23.75 Favored Glycine 0 N--CA 1.49 2.295 0 C-N-CA 119.319 -1.42 . . . . 0.0 110.896 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -46.28 -31.69 2.67 Favored 'General case' 0 C--N 1.305 -1.338 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.237 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -108.1 50.75 0.76 Allowed 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.193 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . 0.436 ' O ' ' OG ' ' R' ' 67' ' ' SER . 1.4 t 171.89 84.12 0.0 OUTLIER 'General case' 0 C--N 1.306 -1.32 0 C-N-CA 119.684 -0.806 . . . . 0.0 110.021 -179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . 0.484 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.5 OUTLIER -125.19 -30.57 3.17 Favored 'General case' 0 N--CA 1.489 1.51 0 CA-C-N 115.663 -0.699 . . . . 0.0 111.019 -179.924 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . 0.45 ' O ' ' CG ' ' R' ' 69' ' ' ARG . 0.0 OUTLIER -80.45 25.2 0.42 Allowed 'General case' 0 C--N 1.305 -1.348 0 CA-C-O 122.467 1.127 . . . . 0.0 109.743 -179.993 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . 0.484 ' H ' ' C ' ' R' ' 68' ' ' GLN . 0.0 OUTLIER -126.06 -12.54 6.38 Favored 'General case' 0 C--N 1.299 -1.623 0 CA-C-N 114.172 -1.376 . . . . 0.0 110.293 179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . 0.409 ' O ' ' N ' ' R' ' 73' ' ' ASN . 4.2 mt -74.57 -24.9 58.99 Favored 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.639 -0.824 . . . . 0.0 111.037 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 19.2 tttm -66.88 75.13 0.11 Allowed 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.253 -0.979 . . . . 0.0 111.169 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . 0.615 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.4 OUTLIER -98.43 10.06 41.69 Favored 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 119.466 -0.894 . . . . 0.0 109.386 179.876 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 48.71 -76.16 0.0 OUTLIER 'General case' 0 C--N 1.292 -1.923 0 CA-C-N 112.948 -1.933 . . . . 0.0 111.361 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.615 ' N ' ' O ' ' R' ' 73' ' ' ASN . 1.4 tp -56.51 -11.87 1.48 Allowed 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 114.607 -1.179 . . . . 0.0 110.912 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -102.25 -37.06 3.42 Favored Glycine 0 N--CA 1.493 2.474 0 C-N-CA 119.604 -1.284 . . . . 0.0 110.861 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . 0.436 ' O ' ' C ' ' R' ' 78' ' ' GLY . . . -169.89 92.97 0.23 Allowed 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 119.505 -0.878 . . . . 0.0 110.404 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . 0.497 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . -34.71 129.33 0.59 Allowed Glycine 0 N--CA 1.494 2.563 0 C-N-CA 120.45 -0.881 . . . . 0.0 111.439 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.913 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -35.91 -29.33 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 CA-C-N 115.391 -0.404 . . . . 0.0 111.289 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.497 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -52.83 -1.17 0.02 OUTLIER 'General case' 0 C--N 1.3 -1.547 0 C-N-CA 119.433 -0.907 . . . . 0.0 112.328 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . 0.567 ' CB ' ' HE1' ' R' ' 1' ' ' TRP . 2.2 t -101.11 -36.68 8.88 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.665 -0.814 . . . . 0.0 112.583 -179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . 0.424 HG21 HD13 ' R' ' 82' ' ' ILE . 12.7 pt -79.99 3.77 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 C-N-CA 118.747 -1.181 . . . . 0.0 111.711 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.527 ' O ' ' ND2' ' R' ' 87' ' ' ASN . 0.2 OUTLIER -77.25 -51.5 10.8 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 119.051 -1.06 . . . . 0.0 110.148 179.865 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.401 ' N ' ' OG1' ' R' ' 83' ' ' THR . 3.6 ptm180 -81.33 -12.09 59.13 Favored 'General case' 0 C--N 1.304 -1.377 0 C-N-CA 119.477 -0.889 . . . . 0.0 110.685 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -93.28 -42.66 4.23 Favored Glycine 0 N--CA 1.488 2.158 0 C-N-CA 119.46 -1.352 . . . . 0.0 110.161 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 10.1 t -54.59 -50.81 67.15 Favored 'General case' 0 C--N 1.305 -1.363 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.468 179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . 0.527 ' ND2' ' O ' ' R' ' 83' ' ' THR . 0.1 OUTLIER -93.18 -78.72 0.42 Allowed 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.42 179.975 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . 0.479 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.2 OUTLIER 73.57 -40.57 0.47 Allowed 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.409 -179.958 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . 0.462 ' H ' ' C ' ' R' ' 87' ' ' ASN . 8.4 mt -49.64 -21.23 0.96 Allowed 'General case' 0 C--N 1.302 -1.473 0 C-N-CA 119.474 -0.89 . . . . 0.0 110.141 179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . 0.404 ' N ' ' C ' ' R' ' 88' ' ' SER . 4.5 mmtp -45.09 -62.56 1.19 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.4 -0.92 . . . . 0.0 110.894 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -68.36 -26.99 65.86 Favored 'General case' 0 C--N 1.289 -2.032 0 CA-C-N 114.348 -1.296 . . . . 0.0 110.037 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' R' ' 89' ' ' LEU . . . 41.57 65.54 4.55 Favored Pre-proline 0 C--N 1.302 -1.459 0 CA-C-N 115.101 -0.954 . . . . 0.0 112.324 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . 0.484 ' C ' ' H ' ' R' ' 95' ' ' GLU . 11.9 Cg_endo -78.67 100.24 1.34 Allowed 'Trans proline' 0 C--N 1.314 -1.259 0 C-N-CA 121.591 1.528 . . . . 0.0 110.33 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . 0.537 HG12 ' NE2' ' R' ' 98' ' ' GLN . 2.9 t -67.17 10.69 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 C-N-CA 119.607 -0.837 . . . . 0.0 111.63 -179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . 0.484 ' H ' ' C ' ' R' ' 93' ' ' PRO . 6.6 mt-10 -89.08 -37.64 14.95 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.097 -1.041 . . . . 0.0 111.749 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 17.3 mt -67.12 -56.11 11.37 Favored 'General case' 0 N--CA 1.49 1.574 0 C-N-CA 119.27 -0.972 . . . . 0.0 111.563 -179.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 2.0 mpt_? -50.06 -18.0 0.49 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.425 -0.91 . . . . 0.0 111.086 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . 0.537 ' NE2' HG12 ' R' ' 94' ' ' VAL . 44.0 mt-30 -93.12 -26.61 17.37 Favored 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.574 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.68 ' CE3' HG21 ' R' ' 103' ' ' VAL . 4.9 t90 -110.62 -62.43 1.53 Allowed 'General case' 0 N--CA 1.489 1.516 0 CA-C-N 115.418 -0.81 . . . . 0.0 111.643 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.472 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.98 -30.3 0.26 Allowed 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.46 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.472 ' C ' ' O ' ' R' ' 100' ' ' LEU . 18.9 pt-20 -47.08 -36.65 8.43 Favored 'General case' 0 C--N 1.293 -1.861 0 C-N-CA 117.468 -1.693 . . . . 0.0 106.978 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.472 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 4.5 mt-10 -92.04 -28.7 17.01 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.385 -1.734 . . . . 0.0 112.533 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.68 HG21 ' CE3' ' R' ' 99' ' ' TRP . 2.2 t -89.74 -7.21 10.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 C-N-CA 117.423 -1.711 . . . . 0.0 110.417 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . 0.43 HD12 ' HA ' ' R' ' 104' ' ' LEU . 21.1 tp -99.19 -53.18 3.31 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 115.414 -0.812 . . . . 0.0 109.907 179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . 0.47 ' N ' HD22 ' R' ' 105' ' ' LEU . 4.0 mm? -71.22 -66.16 0.65 Allowed 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 118.874 -1.13 . . . . 0.0 110.207 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 24.6 tttt -47.08 -34.6 6.07 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 119.555 -0.858 . . . . 0.0 110.538 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 67.4 m . . . . . 0 N--CA 1.487 1.403 0 CA-C-O 116.397 -1.763 . . . . 0.0 110.74 179.978 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . 0.509 ' CD ' ' N ' ' S' ' 4' ' ' GLN . 1.2 mm100 . . . . . 0 N--CA 1.501 2.117 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 8.0 t -163.17 69.82 1.89 Allowed Pre-proline 0 C--N 1.297 -1.689 0 N-CA-C 105.379 -2.082 . . . . 0.0 105.379 179.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . 0.425 ' O ' ' N ' ' S' ' 8' ' ' SER . 32.4 Cg_exo -29.81 145.54 0.02 OUTLIER 'Trans proline' 0 C--O 1.214 -0.686 0 C-N-CA 122.924 2.416 . . . . 0.0 116.113 -179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . 0.468 ' O ' ' O ' ' S' ' 8' ' ' SER . 0.1 OUTLIER -31.15 -37.39 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.444 0 CA-C-N 113.228 -1.806 . . . . 0.0 112.767 -179.869 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . 0.468 ' O ' ' O ' ' S' ' 7' ' ' TYR . 24.6 p 33.95 99.7 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.975 0 CA-C-O 121.674 0.749 . . . . 0.0 112.646 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . 0.511 ' O ' ' HB2' ' S' ' 10' ' ' ALA . . . -65.51 101.63 0.62 Allowed 'General case' 0 C--N 1.297 -1.702 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.786 179.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . 0.511 ' HB2' ' O ' ' S' ' 9' ' ' ALA . . . 168.55 1.8 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.693 0 N-CA-C 107.146 -1.427 . . . . 0.0 107.146 179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . 0.509 ' O ' ' C ' ' S' ' 12' ' ' ALA . 0.1 OUTLIER -64.15 100.55 0.34 Allowed 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 114.433 -1.258 . . . . 0.0 112.624 179.961 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . 0.509 ' C ' ' O ' ' S' ' 11' ' ' MET . . . 12.65 88.57 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -83.64 -1.44 53.95 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 118.835 -1.146 . . . . 0.0 111.265 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -145.99 75.51 1.42 Allowed 'General case' 0 N--CA 1.492 1.637 0 C-N-CA 119.541 -0.864 . . . . 0.0 112.283 -179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 16' ' ' HIS . 14.5 ttm-85 -160.54 134.12 6.88 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 119.007 -1.077 . . . . 0.0 111.255 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . 0.419 ' C ' ' O ' ' S' ' 15' ' ' ARG . 20.8 t-160 33.75 66.57 0.24 Allowed 'General case' 0 N--CA 1.49 1.562 0 CA-C-N 115.193 -0.912 . . . . 0.0 112.654 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -117.56 -85.09 0.64 Allowed 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 120.506 -0.478 . . . . 0.0 110.042 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' S' ' 21' ' ' ARG . 47.4 mt-10 -75.13 -21.4 58.87 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 122.852 1.311 . . . . 0.0 107.639 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . 0.281 32.0 t-105 -42.19 -43.94 3.55 Favored 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 112.803 -1.999 . . . . 0.0 108.294 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -59.43 -44.98 92.81 Favored 'General case' 0 C--N 1.291 -1.958 0 CA-C-N 112.213 -2.267 . . . . 0.0 109.6 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.496 ' O ' ' N ' ' S' ' 23' ' ' VAL . 3.1 mmm180 -49.96 -69.11 0.12 Allowed 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 118.393 -1.323 . . . . 0.0 109.925 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.488 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.1 OUTLIER -31.48 -36.2 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 119.706 -0.798 . . . . 0.0 111.82 179.671 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.496 ' N ' ' O ' ' S' ' 21' ' ' ARG . 31.3 t -78.99 -64.99 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.852 -179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.412 ' C ' ' O ' ' S' ' 23' ' ' VAL . 25.2 t0 -34.29 -48.08 0.32 Allowed 'General case' 0 N--CA 1.49 1.532 0 CA-C-N 115.47 -0.787 . . . . 0.0 112.665 -179.829 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.408 ' N ' HD23 ' S' ' 25' ' ' LEU . 3.3 mt -74.69 -49.11 22.48 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.951 -1.1 . . . . 0.0 110.237 -179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.428 HD12 HD11 ' S' ' 39' ' ' LEU . 4.2 tt -44.83 -28.59 0.66 Allowed 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 119.215 -0.994 . . . . 0.0 111.248 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 7.4 tttp -90.11 -68.94 0.75 Allowed 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.503 -0.879 . . . . 0.0 111.913 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . 0.637 HD22 ' N ' ' S' ' 28' ' ' ASN . 1.5 m120 -41.38 -29.03 0.13 Allowed 'General case' 0 N--CA 1.488 1.473 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.75 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . 0.464 ' O ' ' N ' ' S' ' 33' ' ' ASP . . . -86.11 -31.98 21.58 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 119.067 -1.053 . . . . 0.0 111.675 -179.887 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . . . . . . . . . 39.3 t80 -43.73 -44.86 6.84 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 119.085 -1.046 . . . . 0.0 110.566 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -74.17 -32.48 63.11 Favored 'General case' 0 C--N 1.304 -1.409 0 C-N-CA 118.954 -1.098 . . . . 0.0 109.464 179.859 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.571 ' ND2' ' NE1' ' R' ' 99' ' ' TRP . 3.8 t-20 -79.05 -10.33 59.8 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 119.706 -0.798 . . . . 0.0 109.937 179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.464 ' N ' ' O ' ' S' ' 29' ' ' ALA . 1.4 m-20 72.95 9.92 5.39 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.383 179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -90.94 -0.62 57.78 Favored 'General case' 0 C--N 1.302 -1.469 0 C-N-CA 118.933 -1.107 . . . . 0.0 109.977 179.907 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . 0.459 ' O ' HD13 ' S' ' 39' ' ' LEU . 3.8 p-80 -57.23 -23.96 51.48 Favored 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 119.321 -0.952 . . . . 0.0 111.755 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.463 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.6 mt -70.44 -63.51 1.67 Allowed Pre-proline 0 C--N 1.306 -1.297 0 C-N-CA 118.534 -1.266 . . . . 0.0 110.608 -179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.463 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.3 Cg_exo -51.3 -31.29 36.85 Favored 'Trans proline' 0 C--N 1.321 -0.878 0 C-N-CA 120.951 1.101 . . . . 0.0 110.63 179.628 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . 0.435 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.4 mp -78.44 -36.89 44.86 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.712 -0.795 . . . . 0.0 110.432 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.459 HD13 ' O ' ' S' ' 35' ' ' HIS . 0.3 OUTLIER -62.25 -20.92 64.74 Favored 'General case' 0 C--N 1.304 -1.394 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.241 179.842 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -80.92 -2.94 49.68 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 119.224 -0.991 . . . . 0.0 109.591 179.814 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . 0.509 ' C ' ' H ' ' S' ' 43' ' ' LEU . 7.4 mp -106.78 -70.94 0.77 Allowed 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 115.39 -0.823 . . . . 0.0 110.854 179.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . 0.435 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.0 OUTLIER -78.87 43.68 0.51 Allowed 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.832 -1.147 . . . . 0.0 108.843 179.914 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . 0.509 ' H ' ' C ' ' S' ' 41' ' ' LEU . 0.1 OUTLIER 177.38 124.01 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 105.334 -2.098 . . . . 0.0 105.334 -179.801 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.581 ' HB ' ' CD ' ' S' ' 45' ' ' PRO 0.316 13.7 m -121.29 -96.15 0.0 OUTLIER Pre-proline 0 CA--C 1.587 2.368 0 CA-C-O 115.731 -2.08 . . . . 0.0 113.485 -179.426 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.581 ' CD ' ' HB ' ' S' ' 44' ' ' THR . 57.3 Cg_endo -107.3 -64.78 0.0 OUTLIER 'Trans proline' 0 C--N 1.366 1.485 0 CA-C-N 125.235 2.905 . . . . 0.0 111.766 179.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . 0.511 ' H ' ' CG ' ' S' ' 45' ' ' PRO . 0.1 OUTLIER -50.7 -27.66 7.49 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.037 -179.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . 0.662 ' O ' HD13 ' S' ' 51' ' ' LEU . 21.0 mp0 -66.79 -45.83 77.21 Favored 'General case' 0 C--N 1.295 -1.762 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.41 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 8.4 mtm180 -71.19 -37.32 72.13 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 119.518 -0.873 . . . . 0.0 111.202 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -59.12 -68.94 0.22 Allowed 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.573 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -46.6 -38.62 9.83 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.266 -0.973 . . . . 0.0 110.518 179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . 0.662 HD13 ' O ' ' S' ' 47' ' ' GLU . 1.7 mp -53.54 -51.56 62.49 Favored 'General case' 0 N--CA 1.493 1.702 0 CA-C-N 115.53 -0.759 . . . . 0.0 112.433 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.03 -46.27 93.82 Favored Glycine 0 N--CA 1.494 2.521 0 C-N-CA 118.842 -1.647 . . . . 0.0 109.926 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -44.89 -79.82 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.657 0 CA-C-O 121.544 0.688 . . . . 0.0 111.113 179.893 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.678 ' HE ' ' N ' ' S' ' 55' ' ' VAL . 0.1 OUTLIER -44.8 -47.18 10.94 Favored 'General case' 0 C--N 1.292 -1.892 0 CA-C-N 115.133 -0.939 . . . . 0.0 112.182 -179.986 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . 0.678 ' N ' ' HE ' ' S' ' 54' ' ' ARG . 54.7 t -56.5 -28.87 27.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 C-N-CA 117.76 -1.576 . . . . 0.0 109.281 179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.431 ' N ' ' O ' ' S' ' 53' ' ' THR . 36.1 mtp85 -84.51 -36.48 22.18 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 118.928 -1.109 . . . . 0.0 111.805 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 1.018 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -70.57 -32.28 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 C-N-CA 116.032 -2.267 . . . . 0.0 106.695 179.931 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . 1.018 ' N ' HD13 ' S' ' 57' ' ' ILE . 7.1 t -59.95 -63.36 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 C-N-CA 118.982 -1.087 . . . . 0.0 108.521 179.423 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . 0.471 ' OE2' ' CZ ' ' R' ' 21' ' ' ARG . 23.1 mt-10 -49.07 -29.56 5.26 Favored 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.294 -0.963 . . . . 0.0 110.215 179.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.92 -34.68 44.36 Favored 'General case' 0 N--CA 1.488 1.441 0 C-N-CA 119.265 -0.974 . . . . 0.0 110.472 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . 0.516 ' C ' ' H ' ' S' ' 63' ' ' ARG . 17.3 mt -57.4 -33.31 67.72 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 118.726 -1.189 . . . . 0.0 109.221 179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . 0.796 ' O ' ' N ' ' S' ' 64' ' ' GLY . 49.3 tp -60.95 -7.92 2.8 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 119.289 -0.964 . . . . 0.0 108.468 179.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . 0.516 ' H ' ' C ' ' S' ' 61' ' ' LEU . 4.0 ptt180 4.59 32.49 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.413 0 N-CA-C 116.148 1.907 . . . . 0.0 116.148 -179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.796 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -49.0 -19.93 1.68 Allowed Glycine 0 N--CA 1.487 2.038 0 N-CA-C 109.055 -1.618 . . . . 0.0 109.055 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . 0.455 ' N ' ' C ' ' S' ' 63' ' ' ARG . 39.8 mt-10 -108.28 -66.69 1.02 Allowed 'General case' 0 N--CA 1.488 1.444 0 C-N-CA 120.277 -0.569 . . . . 0.0 110.458 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . 0.46 ' O ' ' CB ' ' S' ' 67' ' ' SER . 1.7 tpt -169.96 164.4 9.55 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.602 -0.839 . . . . 0.0 110.734 -179.976 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . 0.559 ' O ' ' N ' ' S' ' 69' ' ' ARG . 0.4 OUTLIER 166.42 -65.49 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 119.451 -0.9 . . . . 0.0 110.522 -179.994 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.548 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.7 OUTLIER -26.46 -36.22 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.533 0 O-C-N 124.222 0.951 . . . . 0.0 112.908 179.896 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . 0.559 ' N ' ' O ' ' S' ' 67' ' ' SER . 2.8 tpt180 -69.98 27.67 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 120.252 -0.579 . . . . 0.0 111.957 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.548 ' H ' ' C ' ' S' ' 68' ' ' GLN . 4.2 tt0 -107.41 -63.94 1.25 Allowed 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.522 -0.763 . . . . 0.0 110.866 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 tp 61.48 155.09 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.5 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . 0.463 ' O ' ' CG ' ' S' ' 72' ' ' LYS . 6.7 ptmm? -58.1 123.51 16.18 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 119.206 -0.997 . . . . 0.0 111.033 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . 0.455 ' OD1' ' N ' ' S' ' 74' ' ' GLU . 38.0 t-20 -125.62 -99.71 0.39 Allowed 'General case' 0 N--CA 1.487 1.375 0 CA-C-O 121.896 0.855 . . . . 0.0 110.885 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . 0.455 ' N ' ' OD1' ' S' ' 73' ' ' ASN . 0.0 OUTLIER -140.04 -23.35 0.84 Allowed 'General case' 0 C--N 1.279 -2.479 0 CA-C-N 114.008 -1.451 . . . . 0.0 110.98 179.871 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . . . . . . . . . 4.1 tp -111.12 -14.51 13.87 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.233 -0.587 . . . . 0.0 110.317 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -53.91 -80.73 0.07 OUTLIER Glycine 0 N--CA 1.49 2.269 0 C-N-CA 119.543 -1.313 . . . . 0.0 110.47 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -178.35 -91.31 0.0 OUTLIER 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.386 -0.925 . . . . 0.0 111.003 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . 0.481 ' O ' ' N ' ' S' ' 80' ' ' ALA . . . -167.94 136.11 3.95 Favored Glycine 0 N--CA 1.491 2.316 0 C-N-CA 119.196 -1.478 . . . . 0.0 111.071 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.903 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.1 OUTLIER -37.43 -28.35 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 CA-C-N 115.434 -0.383 . . . . 0.0 111.289 179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.481 ' N ' ' O ' ' S' ' 78' ' ' GLY . . . -67.46 -65.82 0.64 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.701 -0.8 . . . . 0.0 112.588 -179.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.487 HG22 HG23 ' S' ' 82' ' ' ILE . 0.6 OUTLIER -48.13 -27.56 2.42 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 113.196 0.813 . . . . 0.0 113.196 -179.825 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . 0.487 HG23 HG22 ' S' ' 81' ' ' THR . 15.7 pt -92.48 -21.61 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 C-N-CA 118.701 -1.199 . . . . 0.0 112.706 -179.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.418 ' O ' ' OD1' ' S' ' 87' ' ' ASN . 0.0 OUTLIER -57.75 -48.92 78.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.479 -1.288 . . . . 0.0 110.584 179.934 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . 0.772 ' HE ' ' H ' ' S' ' 84' ' ' ARG . 0.0 OUTLIER -76.34 -28.46 56.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 119.069 -1.052 . . . . 0.0 109.64 179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -60.66 -4.5 4.15 Favored Glycine 0 N--CA 1.485 1.922 0 N-CA-C 109.567 -1.413 . . . . 0.0 109.567 179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . 0.469 ' H ' ' C ' ' S' ' 84' ' ' ARG . 0.4 OUTLIER -138.38 -63.33 0.55 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.759 -179.944 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . 0.521 ' O ' ' N ' ' S' ' 89' ' ' LEU . 32.5 m120 -48.04 -16.66 0.09 Allowed 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.345 -0.942 . . . . 0.0 110.756 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . 0.543 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.4 OUTLIER -41.07 -21.93 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.991 -0.684 . . . . 0.0 111.372 179.956 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . 0.521 ' N ' ' O ' ' S' ' 87' ' ' ASN . 5.4 mt -39.56 -21.47 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.476 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.713 -179.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . 0.543 ' N ' ' O ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -75.36 -61.76 1.79 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 118.812 -1.155 . . . . 0.0 110.51 179.988 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -46.69 -62.1 1.53 Allowed 'General case' 0 C--N 1.293 -1.864 0 CA-C-N 114.689 -1.142 . . . . 0.0 110.752 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 46.03 68.18 3.63 Favored Pre-proline 0 C--N 1.304 -1.388 0 C-N-CA 119.582 -0.847 . . . . 0.0 111.266 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . 0.4 ' HB2' HD12 ' S' ' 96' ' ' LEU . 1.9 Cg_endo -66.01 107.16 1.08 Allowed 'Trans proline' 0 C--N 1.314 -1.277 0 C-N-CA 121.532 1.488 . . . . 0.0 111.267 -179.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . 0.4 ' C ' ' N ' ' S' ' 96' ' ' LEU . 57.4 t -77.45 -35.76 22.5 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.449 0 C-N-CA 119.368 -0.933 . . . . 0.0 110.985 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -54.84 -10.22 0.44 Allowed 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.333 -0.947 . . . . 0.0 110.904 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . 0.498 ' HB3' HD23 ' S' ' 100' ' ' LEU . 79.3 mt -103.46 -21.9 13.72 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.205 -179.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.06 -29.04 27.76 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.254 179.99 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 10.0 mt-30 -94.74 -16.68 22.85 Favored 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.965 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.674 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 10.6 t90 -91.41 -58.87 2.3 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.827 -0.749 . . . . 0.0 111.143 -179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.536 HD12 HD13 ' S' ' 104' ' ' LEU . 1.8 mm? -38.41 -34.07 0.12 Allowed 'General case' 0 C--N 1.3 -1.574 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.467 ' C ' ' O ' ' S' ' 100' ' ' LEU . 31.2 mt-10 -45.43 -38.66 6.26 Favored 'General case' 0 C--N 1.297 -1.713 0 C-N-CA 117.661 -1.616 . . . . 0.0 107.177 179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -86.29 -29.43 23.06 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.506 -1.679 . . . . 0.0 112.579 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.674 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 4.0 t -83.31 -18.65 10.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 C-N-CA 116.787 -1.965 . . . . 0.0 111.862 -179.751 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . 0.536 HD13 HD12 ' S' ' 100' ' ' LEU . 1.4 tp -101.09 -61.67 1.34 Allowed 'General case' 0 C--N 1.306 -1.299 0 C-N-CA 119.975 -0.69 . . . . 0.0 111.314 179.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 34.9 mt -57.58 -74.57 0.05 Allowed 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.921 -1.112 . . . . 0.0 111.111 -179.876 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 40.5 tttt -42.0 -50.66 4.59 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 119.78 -0.768 . . . . 0.0 110.904 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 43.6 t . . . . . 0 N--CA 1.487 1.391 0 CA-C-O 116.375 -1.774 . . . . 0.0 110.704 179.968 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.567 ' HE1' ' CB ' ' R' ' 81' ' ' THR . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.417 0 CA-C-O 116.306 -1.807 . . . . 0.0 110.47 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.572 ' N ' ' O ' ' R' ' 40' ' ' ASN . 0.9 OUTLIER . . . . . 0 N--CA 1.485 1.289 0 CA-C-O 116.362 -1.78 . . . . 0.0 110.25 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.878 0.371 . . . . 0.0 110.141 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . 0.556 ' N ' ' CD ' ' R' ' 6' ' ' PRO . 0.0 OUTLIER -87.44 -43.99 0.51 Allowed Pre-proline 0 C--N 1.305 -1.339 0 C-N-CA 119.288 -0.965 . . . . 0.0 112.021 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . 0.556 ' CD ' ' N ' ' R' ' 5' ' ' SER . 1.9 Cg_endo -72.59 151.4 52.59 Favored 'Trans proline' 0 C--N 1.321 -0.904 0 C-N-CA 121.238 1.292 . . . . 0.0 111.189 -179.95 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -79.3 104.69 10.09 Favored 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 119.251 -0.979 . . . . 0.0 110.711 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 36.3 t -159.05 -45.02 0.06 Allowed 'General case' 0 C--N 1.305 -1.356 0 C-N-CA 119.361 -0.935 . . . . 0.0 111.011 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -163.54 140.05 6.96 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.09 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -158.39 -36.06 0.07 Allowed 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 119.546 -0.862 . . . . 0.0 110.62 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -148.55 -11.92 0.34 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.562 -0.855 . . . . 0.0 110.677 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -170.47 153.42 4.27 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 119.441 -0.904 . . . . 0.0 110.799 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -79.42 115.06 18.83 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 119.36 -0.936 . . . . 0.0 110.737 -179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -75.7 121.79 23.04 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 119.573 -0.851 . . . . 0.0 110.83 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 15.6 mtm180 -85.83 76.1 9.94 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.06 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . 0.411 ' H ' ' H ' ' R' ' 17' ' ' GLN . 0.4 OUTLIER -159.08 -15.89 0.06 Allowed 'General case' 0 C--N 1.302 -1.491 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.565 179.973 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.411 ' H ' ' H ' ' R' ' 16' ' ' HIS . 9.7 tt0 -86.23 -85.7 0.15 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 119.858 -0.737 . . . . 0.0 109.879 179.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . 0.407 ' C ' ' O ' ' R' ' 17' ' ' GLN . 0.4 OUTLIER -45.27 -34.32 2.82 Favored 'General case' 0 N--CA 1.493 1.716 0 CA-C-O 122.628 1.204 . . . . 0.0 108.122 179.762 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . 0.441 ' CH2' ' CD ' ' S' ' 47' ' ' GLU . 22.7 t-105 -55.04 -55.13 34.36 Favored 'General case' 0 C--N 1.301 -1.513 0 CA-C-N 113.151 -1.84 . . . . 0.0 108.59 179.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . 0.733 ' C ' HD13 ' R' ' 20' ' ' LEU . 2.4 tm? -57.25 -38.68 74.21 Favored 'General case' 0 C--N 1.296 -1.759 0 CA-C-N 113.601 -1.636 . . . . 0.0 110.432 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.512 ' O ' ' C ' ' R' ' 22' ' ' PHE . 17.7 mmt180 -50.42 -73.52 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 118.416 -1.314 . . . . 0.0 110.553 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.512 ' C ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t80 -31.02 -41.91 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 C-N-CA 119.087 -1.045 . . . . 0.0 111.842 179.784 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' R' ' 21' ' ' ARG . 10.9 t -69.76 -57.91 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 C-N-CA 119.602 -0.839 . . . . 0.0 111.403 179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.477 ' OD2' HD23 ' R' ' 25' ' ' LEU . 1.4 t70 -39.71 -60.21 1.02 Allowed 'General case' 0 N--CA 1.49 1.541 0 C-N-CA 119.633 -0.827 . . . . 0.0 111.522 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.687 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.1 OUTLIER -52.72 -53.01 53.68 Favored 'General case' 0 C--N 1.305 -1.342 0 C-N-CA 118.234 -1.386 . . . . 0.0 109.585 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . 0.436 ' C ' HD23 ' R' ' 26' ' ' LEU . 1.2 tt -39.83 -64.43 0.49 Allowed 'General case' 0 N--CA 1.49 1.556 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.351 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . 0.575 ' NZ ' ' CD1' ' S' ' 30' ' ' TYR . 0.4 OUTLIER -53.44 -76.11 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 112.807 0.669 . . . . 0.0 112.807 -179.868 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . 0.537 ' H ' HD22 ' R' ' 28' ' ' ASN . 5.5 m-80 -34.85 -49.33 0.43 Allowed 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.436 ' HB2' ' CH2' ' S' ' 99' ' ' TRP . . . -63.48 -55.35 24.78 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.409 -0.916 . . . . 0.0 113.078 -179.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . 0.465 ' CE2' HG11 ' S' ' 23' ' ' VAL . 4.9 t80 -40.7 -37.62 0.77 Allowed 'General case' 0 N--CA 1.493 1.702 0 C-N-CA 119.284 -0.966 . . . . 0.0 111.774 -179.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -47.37 -43.8 23.55 Favored 'General case' 0 C--N 1.302 -1.488 0 C-N-CA 118.792 -1.163 . . . . 0.0 109.951 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -95.62 -78.25 0.46 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.558 -0.857 . . . . 0.0 110.9 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER 169.81 24.71 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 119.746 -0.782 . . . . 0.0 110.965 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . 0.574 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 1.0 OUTLIER -95.85 -9.66 30.92 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 119.814 -0.754 . . . . 0.0 110.074 -179.9 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . 0.491 ' O ' HD22 ' R' ' 39' ' ' LEU . 11.1 p-80 -54.02 -30.85 49.27 Favored 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 114.736 -1.12 . . . . 0.0 113.476 -179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.476 ' N ' ' HD2' ' R' ' 37' ' ' PRO . 9.0 mt -68.28 -58.69 7.08 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 117.878 -1.529 . . . . 0.0 110.318 -179.952 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.476 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.6 Cg_exo -55.18 -43.28 60.54 Favored 'Trans proline' 0 C--N 1.311 -1.428 0 C-N-CA 120.563 0.842 . . . . 0.0 110.685 179.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . 0.408 HD13 ' HA ' ' R' ' 38' ' ' LEU . 0.6 OUTLIER -61.49 -43.45 98.84 Favored 'General case' 0 N--CA 1.496 1.851 0 CA-C-O 121.651 0.739 . . . . 0.0 110.387 179.914 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.527 HD23 ' HZ2' ' S' ' 19' ' ' TRP . 0.1 OUTLIER -52.3 -48.43 65.37 Favored 'General case' 0 C--N 1.295 -1.762 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.141 179.787 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -56.57 -5.85 0.25 Allowed 'General case' 0 C--N 1.297 -1.691 0 CA-C-N 115.586 -0.734 . . . . 0.0 112.656 -179.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 7.9 mp -102.58 -60.18 1.58 Allowed 'General case' 0 N--CA 1.497 1.898 0 C-N-CA 119.353 -0.939 . . . . 0.0 111.726 -179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.14 50.98 1.19 Allowed 'General case' 0 N--CA 1.504 2.269 0 C-N-CA 118.715 -1.194 . . . . 0.0 109.399 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . 0.422 HD23 ' C ' ' R' ' 43' ' ' LEU . 0.2 OUTLIER 173.22 144.89 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 CA-C-N 114.561 -1.199 . . . . 0.0 108.057 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -169.21 -43.42 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 115.396 -2.522 . . . . 0.0 117.051 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -104.2 -98.19 0.0 OUTLIER 'Trans proline' 0 CA--C 1.551 1.329 0 N-CA-C 115.338 1.246 . . . . 0.0 115.338 -179.401 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -48.84 -26.19 2.28 Favored 'General case' 0 N--CA 1.487 1.409 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.833 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.787 ' O ' HD13 ' R' ' 51' ' ' LEU . 6.6 mm-40 -51.8 -66.18 0.43 Allowed 'General case' 0 C--N 1.291 -1.955 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.858 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 8.2 mmm-85 -58.19 -38.45 76.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.79 -0.764 . . . . 0.0 112.009 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 23.4 mt-10 -71.6 -67.18 0.54 Allowed 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.928 -179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.606 ' HB1' ' NH1' ' R' ' 54' ' ' ARG . . . -47.9 -30.28 4.03 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.994 -0.683 . . . . 0.0 112.731 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . 0.787 HD13 ' O ' ' R' ' 47' ' ' GLU . 4.6 mp -63.88 -67.43 0.43 Allowed 'General case' 0 N--CA 1.496 1.825 0 C-N-CA 119.237 -0.985 . . . . 0.0 111.65 -179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -46.74 -29.55 4.3 Favored Glycine 0 N--CA 1.487 2.089 0 C-N-CA 118.982 -1.58 . . . . 0.0 110.233 179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.462 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -65.1 -81.69 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 119.978 -0.689 . . . . 0.0 111.803 -179.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.606 ' NH1' ' HB1' ' R' ' 50' ' ' ALA . 10.7 ptp180 -43.31 -43.9 5.21 Favored 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 120.027 -0.669 . . . . 0.0 111.733 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 45.2 t -62.8 -30.43 49.42 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.838 0 C-N-CA 118.341 -1.344 . . . . 0.0 110.296 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.462 ' N ' ' O ' ' R' ' 53' ' ' THR . 21.1 mtp85 -79.53 -39.62 31.52 Favored 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.08 -1.048 . . . . 0.0 111.357 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 1.03 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.47 -32.77 25.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 C-N-CA 117.008 -1.877 . . . . 0.0 108.289 -179.956 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 1.03 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.7 t -59.23 -61.21 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 118.75 -1.18 . . . . 0.0 108.484 179.496 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.437 ' N ' HG12 ' R' ' 58' ' ' VAL . 28.5 mt-10 -52.12 -30.93 28.61 Favored 'General case' 0 C--N 1.306 -1.301 0 C-N-CA 119.177 -1.009 . . . . 0.0 109.962 179.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 4.2 tt0 -65.18 -33.08 75.15 Favored 'General case' 0 N--CA 1.486 1.334 0 C-N-CA 119.416 -0.913 . . . . 0.0 111.471 -179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . 0.654 ' C ' HD12 ' R' ' 61' ' ' LEU . 0.4 OUTLIER -75.1 -28.93 60.47 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 118.547 -1.261 . . . . 0.0 109.731 -179.936 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mt -61.67 -18.27 58.9 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 119.118 -1.033 . . . . 0.0 109.677 179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . 0.535 ' O ' ' N ' ' R' ' 65' ' ' GLU . 10.0 ttt180 -117.92 25.97 9.99 Favored 'General case' 0 N--CA 1.488 1.426 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.113 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . 0.401 ' O ' ' C ' ' R' ' 65' ' ' GLU . . . -40.6 -20.91 0.03 OUTLIER Glycine 0 N--CA 1.493 2.443 0 C-N-CA 120.067 -1.063 . . . . 0.0 111.115 -180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.535 ' N ' ' O ' ' R' ' 63' ' ' ARG . 4.8 mt-10 -42.09 -30.36 0.28 Allowed 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.508 -0.877 . . . . 0.0 110.715 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 19.6 mtp -142.29 80.9 1.72 Allowed 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 119.696 -0.802 . . . . 0.0 110.582 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER 172.72 82.2 0.0 OUTLIER 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.369 -0.932 . . . . 0.0 110.789 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . 0.511 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.4 OUTLIER -121.82 -38.51 2.73 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 115.718 -0.674 . . . . 0.0 110.509 179.997 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -75.29 26.89 0.1 Allowed 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 120.209 -0.596 . . . . 0.0 110.943 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . 0.511 ' H ' ' C ' ' R' ' 68' ' ' GLN . 7.7 pt-20 -83.55 25.79 0.73 Allowed 'General case' 0 C--N 1.295 -1.769 0 CA-C-N 115.14 -0.936 . . . . 0.0 111.02 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -43.14 161.0 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 119.276 -0.969 . . . . 0.0 110.633 -179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 4.6 pttp -69.18 130.11 41.74 Favored 'General case' 0 C--N 1.304 -1.388 0 C-N-CA 119.399 -0.92 . . . . 0.0 111.699 -179.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . 0.562 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.2 OUTLIER -90.25 17.85 6.67 Favored 'General case' 0 C--N 1.303 -1.427 0 CA-C-O 122.1 0.952 . . . . 0.0 109.337 179.85 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 38.91 17.37 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.997 -1.91 . . . . 0.0 112.256 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.562 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.3 tp -126.98 -14.1 5.61 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 120.207 -0.597 . . . . 0.0 110.595 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -100.41 -65.79 0.81 Allowed Glycine 0 N--CA 1.492 2.392 0 C-N-CA 119.764 -1.208 . . . . 0.0 110.959 -179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -132.53 -103.91 0.26 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.845 -0.742 . . . . 0.0 110.869 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . 0.518 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 172.73 158.54 17.27 Favored Glycine 0 N--CA 1.492 2.407 0 C-N-CA 118.994 -1.574 . . . . 0.0 111.069 -179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.907 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -36.59 -27.19 0.02 OUTLIER 'Isoleucine or valine' 0 C--N 1.308 -1.232 0 CA-C-N 115.345 -0.428 . . . . 0.0 111.753 179.98 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.518 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -65.35 -78.39 0.05 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 119.401 -0.92 . . . . 0.0 112.683 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . 0.444 HG22 HG23 ' R' ' 82' ' ' ILE . 0.5 OUTLIER -37.47 -31.31 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 113.393 0.886 . . . . 0.0 113.393 -179.724 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . 0.489 HD11 ' HA ' ' R' ' 79' ' ' ILE . 22.1 pt -87.06 -28.91 5.69 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 C-N-CA 118.418 -1.313 . . . . 0.0 112.85 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.464 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -54.63 -63.69 1.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 118.343 -1.343 . . . . 0.0 110.605 179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.77 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -62.58 -24.86 67.77 Favored 'General case' 0 C--N 1.305 -1.348 0 C-N-CA 119.323 -0.951 . . . . 0.0 110.312 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -67.05 4.3 3.43 Favored Glycine 0 N--CA 1.489 2.171 0 C-N-CA 119.331 -1.414 . . . . 0.0 109.76 179.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . 0.486 ' H ' ' C ' ' R' ' 84' ' ' ARG . 33.9 t -138.77 -43.54 0.48 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.618 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -92.96 10.33 31.75 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.563 -0.855 . . . . 0.0 110.787 179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -42.21 -40.15 2.29 Favored 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.659 -0.816 . . . . 0.0 111.297 179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 2.7 mt -59.13 -74.85 0.06 Allowed 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 119.182 -1.007 . . . . 0.0 110.664 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' R' ' 91' ' ' ALA . 10.9 tptm -41.1 -50.07 3.43 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-O 121.525 0.678 . . . . 0.0 111.761 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . 0.42 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -34.64 -62.32 0.36 Allowed 'General case' 0 C--N 1.291 -1.936 0 CA-C-N 113.911 -1.495 . . . . 0.0 112.675 -179.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.688 ' HB3' ' HD3' ' R' ' 93' ' ' PRO . . . -174.34 -54.21 0.0 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 118.514 -1.274 . . . . 0.0 113.241 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . 0.688 ' HD3' ' HB3' ' R' ' 92' ' ' ALA . 5.4 Cg_exo -57.25 89.38 0.05 OUTLIER 'Trans proline' 0 C--N 1.322 -0.84 0 C-N-CA 120.196 0.597 . . . . 0.0 111.0 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . 0.595 HG23 ' O ' ' R' ' 92' ' ' ALA . 61.8 t -110.65 -45.59 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 CA-C-N 115.283 -0.871 . . . . 0.0 110.442 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -67.73 -18.1 64.78 Favored 'General case' 0 C--N 1.305 -1.357 0 C-N-CA 119.249 -0.98 . . . . 0.0 110.291 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 2.0 tp -51.15 -43.45 61.24 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.943 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.04 -35.57 59.62 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 119.296 -0.961 . . . . 0.0 110.707 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -52.47 -23.18 5.71 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.232 -0.987 . . . . 0.0 110.503 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.655 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.8 t90 -106.29 -62.19 1.42 Allowed 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 115.621 -0.718 . . . . 0.0 111.179 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.471 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -40.74 -30.85 0.13 Allowed 'General case' 0 C--N 1.306 -1.289 0 C-N-CA 119.104 -1.038 . . . . 0.0 113.704 179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.503 ' O ' HD22 ' R' ' 105' ' ' LEU . 11.0 pt-20 -46.46 -36.32 6.5 Favored 'General case' 0 C--N 1.297 -1.712 0 C-N-CA 117.529 -1.669 . . . . 0.0 107.121 179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.476 ' N ' ' CG ' ' R' ' 101' ' ' GLU . 3.6 mt-10 -91.37 -28.45 17.69 Favored 'General case' 0 C--N 1.301 -1.53 0 CA-C-N 113.235 -1.802 . . . . 0.0 112.282 179.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.655 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.1 t -93.15 -1.34 10.52 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 C-N-CA 117.601 -1.64 . . . . 0.0 110.67 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . 0.467 ' N ' ' O ' ' R' ' 100' ' ' LEU . 26.4 tp -105.6 -51.55 2.98 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.757 179.867 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . 0.85 HD23 ' N ' ' R' ' 106' ' ' LYS . 0.1 OUTLIER -72.79 -10.15 59.47 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 119.285 -0.966 . . . . 0.0 111.18 -179.927 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . 0.85 ' N ' HD23 ' R' ' 105' ' ' LEU . 0.0 OUTLIER -53.27 -19.74 3.51 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 119.404 -0.918 . . . . 0.0 111.015 -179.994 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' R' ' 106' ' ' LYS . 91.8 p . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 116.379 -1.772 . . . . 0.0 111.027 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 17.0 mt-30 . . . . . 0 N--CA 1.486 1.351 0 CA-C-O 120.916 0.389 . . . . 0.0 110.084 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 38.7 t -171.45 67.61 0.45 Allowed Pre-proline 0 N--CA 1.487 1.38 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.146 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -66.23 164.65 27.18 Favored 'Trans proline' 0 C--N 1.314 -1.282 0 C-N-CA 121.612 1.542 . . . . 0.0 111.343 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -166.82 -8.4 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.36 0 C-N-CA 119.457 -0.897 . . . . 0.0 110.689 179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 9.8 t -83.35 84.68 7.42 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 119.419 -0.912 . . . . 0.0 110.711 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.2 173.18 5.9 Favored 'General case' 0 C--N 1.305 -1.368 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.909 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -55.91 121.48 9.39 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 119.478 -0.889 . . . . 0.0 110.834 179.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 8.5 mmt -92.31 -17.66 24.43 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.991 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -92.1 130.88 37.72 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.929 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -88.17 -177.49 5.72 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.49 -0.884 . . . . 0.0 110.759 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -161.17 75.14 0.5 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.298 -0.961 . . . . 0.0 111.112 179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . 0.405 ' H ' ' H ' ' S' ' 16' ' ' HIS . 11.3 ptt180 -164.98 -1.37 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.589 -0.844 . . . . 0.0 110.442 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . 0.405 ' H ' ' H ' ' S' ' 15' ' ' ARG . 0.0 OUTLIER -146.82 -20.21 0.41 Allowed 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.043 179.969 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.453 ' C ' ' N ' ' S' ' 19' ' ' TRP . 0.9 OUTLIER -92.51 -82.99 0.31 Allowed 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 119.694 -0.802 . . . . 0.0 109.389 179.808 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . . . . . . . . . 2.4 mt-10 -45.4 -29.32 1.05 Allowed 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.822 1.296 . . . . 0.0 108.194 179.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . 0.527 ' HZ2' HD23 ' R' ' 39' ' ' LEU . 24.4 t-105 -58.62 -59.87 4.72 Favored 'General case' 0 C--N 1.297 -1.708 0 CA-C-N 112.862 -1.972 . . . . 0.0 109.911 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . 0.848 ' O ' HD12 ' S' ' 20' ' ' LEU . 0.3 OUTLIER -58.99 -19.03 39.7 Favored 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.968 -1.469 . . . . 0.0 111.081 -179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' S' ' 22' ' ' PHE . 12.1 mmt180 -67.82 -65.14 0.73 Allowed 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 118.003 -1.479 . . . . 0.0 108.974 179.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.438 ' C ' ' O ' ' S' ' 21' ' ' ARG . 1.6 t80 -39.5 -41.69 1.03 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 118.874 -1.131 . . . . 0.0 110.303 179.701 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.465 HG11 ' CE2' ' R' ' 30' ' ' TYR . 85.5 t -71.09 -48.36 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.794 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . . . . . . . . . 20.5 t0 -40.28 -64.44 0.51 Allowed 'General case' 0 N--CA 1.489 1.49 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.492 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.52 HD23 ' N ' ' S' ' 25' ' ' LEU . 1.9 mt -53.02 -53.4 50.64 Favored 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 118.73 -1.188 . . . . 0.0 109.184 179.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.68 -1.08 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.297 -179.992 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . 0.468 ' H ' ' C ' ' S' ' 25' ' ' LEU . 25.0 tttm -88.05 -68.48 0.76 Allowed 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 118.997 -1.081 . . . . 0.0 112.389 -179.881 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -80.88 -3.2 50.46 Favored 'General case' 0 N--CA 1.49 1.555 0 C-N-CA 119.363 -0.935 . . . . 0.0 112.139 -179.801 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . 0.466 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -74.32 -53.27 10.01 Favored 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 118.985 -1.086 . . . . 0.0 110.919 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . 0.575 ' CD1' ' NZ ' ' R' ' 27' ' ' LYS . 14.6 t80 -41.65 -42.14 2.42 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.736 -0.786 . . . . 0.0 111.25 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -45.58 -42.3 10.96 Favored 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.18 -1.008 . . . . 0.0 110.57 179.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.414 ' O ' ' OD2' ' S' ' 33' ' ' ASP . 0.0 OUTLIER -97.37 -77.65 0.49 Allowed 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 119.517 -0.873 . . . . 0.0 111.177 -179.979 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.414 ' OD2' ' O ' ' S' ' 32' ' ' ASN . 0.5 OUTLIER 169.66 27.13 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 C-N-CA 119.663 -0.815 . . . . 0.0 110.943 -179.976 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . 0.567 ' CD2' ' N ' ' S' ' 34' ' ' LEU . 0.8 OUTLIER -92.82 -15.35 26.61 Favored 'General case' 0 C--N 1.303 -1.443 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.062 -179.94 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 21.3 p-80 -51.15 -20.75 1.63 Allowed 'General case' 0 C--N 1.298 -1.671 0 CA-C-N 114.923 -1.035 . . . . 0.0 112.186 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.466 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 7.0 mt -80.21 -65.03 0.29 Allowed Pre-proline 0 C--N 1.306 -1.302 0 C-N-CA 118.335 -1.346 . . . . 0.0 110.647 -179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.526 ' O ' ' ND2' ' S' ' 40' ' ' ASN . 2.6 Cg_endo -51.88 -21.32 11.64 Favored 'Trans proline' 0 C--N 1.32 -0.938 0 N-CA-C 109.775 -0.894 . . . . 0.0 109.775 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 49.1 mt -79.87 -38.7 32.13 Favored 'General case' 0 N--CA 1.487 1.414 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.609 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.492 ' O ' ' O ' ' S' ' 43' ' ' LEU . 0.3 OUTLIER -59.7 -24.75 64.23 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.197 -0.911 . . . . 0.0 108.758 179.696 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . 0.526 ' ND2' ' O ' ' S' ' 37' ' ' PRO . 0.0 OUTLIER -97.06 10.37 39.49 Favored 'General case' 0 C--N 1.304 -1.405 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.744 179.747 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tp -108.47 -67.26 0.98 Allowed 'General case' 0 N--CA 1.492 1.664 0 N-CA-C 113.456 0.91 . . . . 0.0 113.456 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -99.33 36.79 1.67 Allowed 'General case' 0 N--CA 1.504 2.227 0 C-N-CA 119.019 -1.073 . . . . 0.0 112.143 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . 0.612 HD21 ' HG3' ' S' ' 47' ' ' GLU . 24.1 tp 172.74 146.04 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.993 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.52 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.7 OUTLIER 177.98 -46.94 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.305 0 C-N-CA 117.169 -1.812 . . . . 0.0 114.921 179.966 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.52 ' HD2' ' H ' ' S' ' 44' ' ' THR . 6.0 Cg_endo -68.42 -83.72 0.01 OUTLIER 'Trans proline' 0 C--N 1.318 -1.045 0 C-N-CA 120.361 0.707 . . . . 0.0 111.584 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . 0.701 ' O ' ' HB3' ' S' ' 50' ' ' ALA . 3.0 p-10 -49.73 -14.42 0.13 Allowed 'General case' 0 C--N 1.301 -1.512 0 C-N-CA 119.005 -1.078 . . . . 0.0 109.715 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . 0.612 ' HG3' HD21 ' S' ' 43' ' ' LEU . 10.5 tt0 -71.77 -74.94 0.14 Allowed 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 119.281 -0.967 . . . . 0.0 111.284 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -43.77 -25.03 0.15 Allowed 'General case' 0 C--N 1.302 -1.477 0 C-N-CA 119.592 -0.843 . . . . 0.0 110.945 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . 0.437 ' N ' ' O ' ' S' ' 47' ' ' GLU . 4.2 mm-40 -100.51 -65.03 0.99 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 118.978 -1.089 . . . . 0.0 112.786 -179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' S' ' 46' ' ' ASP . . . -61.82 -42.19 98.71 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.075 -1.05 . . . . 0.0 112.985 -179.667 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . 0.487 HD12 HH21 ' S' ' 54' ' ' ARG . 1.8 tp -54.45 -49.73 69.36 Favored 'General case' 0 N--CA 1.498 1.957 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.761 179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -58.82 -35.76 83.9 Favored Glycine 0 N--CA 1.492 2.373 0 C-N-CA 118.797 -1.668 . . . . 0.0 109.744 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.467 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.0 OUTLIER -64.83 -80.36 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-N 115.006 -0.597 . . . . 0.0 112.563 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.501 ' O ' HG23 ' S' ' 58' ' ' VAL . 4.5 ptt180 -42.41 -29.4 0.27 Allowed 'General case' 0 C--N 1.296 -1.743 0 C-N-CA 119.834 -0.746 . . . . 0.0 112.393 -179.963 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . 0.407 HG23 ' O ' ' S' ' 51' ' ' LEU . 71.7 t -76.47 -31.78 20.78 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.686 0 C-N-CA 117.817 -1.553 . . . . 0.0 109.407 179.797 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.467 ' N ' ' O ' ' S' ' 53' ' ' THR . 10.8 mtp180 -63.6 -46.7 84.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 118.894 -1.123 . . . . 0.0 109.825 179.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 0.42 HD13 ' N ' ' S' ' 57' ' ' ILE . 0.0 OUTLIER -71.68 -57.33 7.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 C-N-CA 118.024 -1.47 . . . . 0.0 110.219 179.918 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . 0.501 HG23 ' O ' ' S' ' 54' ' ' ARG . 84.8 t -47.26 -64.58 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.3 -1.56 0 C-N-CA 118.288 -1.365 . . . . 0.0 111.459 179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -52.63 -28.72 22.6 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.283 -0.967 . . . . 0.0 112.48 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -80.94 -47.24 13.96 Favored 'General case' 0 N--CA 1.493 1.698 0 C-N-CA 118.474 -1.29 . . . . 0.0 112.789 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . 0.454 HD22 ' O ' ' S' ' 85' ' ' GLY . 2.1 pp -70.09 -5.23 25.42 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 117.859 -1.536 . . . . 0.0 110.613 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . 0.423 ' HA ' HD22 ' S' ' 62' ' ' LEU . 0.2 OUTLIER -71.06 -61.97 1.57 Allowed 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 119.257 -0.977 . . . . 0.0 110.429 179.748 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.6 ttt180 -118.61 -22.62 7.41 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 120.093 -0.643 . . . . 0.0 110.508 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.605 ' O ' ' N ' ' S' ' 66' ' ' MET . . . -91.25 28.42 8.13 Favored Glycine 0 N--CA 1.486 2.007 0 N-CA-C 109.057 -1.617 . . . . 0.0 109.057 179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . 0.446 ' C ' ' O ' ' S' ' 64' ' ' GLY . 2.2 mt-10 -24.58 -35.84 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.878 0 O-C-N 124.62 0.835 . . . . 0.0 112.187 -179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . 0.605 ' N ' ' O ' ' S' ' 64' ' ' GLY . 13.5 mmt -56.72 147.15 23.6 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 118.63 -1.228 . . . . 0.0 108.771 179.778 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -173.31 83.14 0.04 OUTLIER 'General case' 0 C--N 1.301 -1.525 0 C-N-CA 118.263 -1.375 . . . . 0.0 110.949 -179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -125.76 -32.42 2.84 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.027 -0.988 . . . . 0.0 109.649 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -87.61 18.83 3.7 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.663 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.433 ' O ' ' C ' ' S' ' 71' ' ' LEU . 2.8 mm-40 -125.91 -74.0 0.61 Allowed 'General case' 0 C--N 1.296 -1.755 0 CA-C-N 114.776 -1.102 . . . . 0.0 110.15 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . 0.433 ' C ' ' O ' ' S' ' 70' ' ' GLU . 2.9 tp 38.79 -149.73 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.629 -0.828 . . . . 0.0 110.439 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.33 149.87 24.97 Favored 'General case' 0 C--N 1.311 -1.107 0 C-N-CA 119.495 -0.882 . . . . 0.0 109.304 179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . 0.484 ' CG ' ' N ' ' S' ' 74' ' ' GLU . 1.1 t-20 -97.25 -95.7 0.21 Allowed 'General case' 0 C--N 1.297 -1.701 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.551 179.907 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . 0.484 ' N ' ' CG ' ' S' ' 73' ' ' ASN . 18.2 mt-10 -163.31 -43.1 0.03 OUTLIER 'General case' 0 C--N 1.278 -2.538 0 CA-C-N 113.57 -1.65 . . . . 0.0 108.36 179.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . 0.458 ' HA ' HD13 ' S' ' 75' ' ' LEU . 0.1 OUTLIER -114.72 -30.74 6.38 Favored 'General case' 0 C--N 1.298 -1.648 0 CA-C-N 113.56 -1.655 . . . . 0.0 111.181 -179.875 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -36.79 -73.59 0.12 Allowed Glycine 0 N--CA 1.497 2.745 0 C-N-CA 120.533 -0.842 . . . . 0.0 112.208 -179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . 0.542 ' O ' ' O ' ' S' ' 78' ' ' GLY . . . -166.69 64.8 0.09 Allowed 'General case' 0 C--N 1.301 -1.519 0 C-N-CA 119.075 -1.05 . . . . 0.0 111.429 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . 0.542 ' O ' ' O ' ' S' ' 77' ' ' ALA . . . 29.96 -162.89 0.0 OUTLIER Glycine 0 N--CA 1.5 2.928 0 CA-C-N 114.933 -1.031 . . . . 0.0 112.628 -179.939 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.709 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.2 OUTLIER -110.63 -18.92 7.25 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.428 0 CA-C-N 114.679 -0.761 . . . . 0.0 111.96 179.873 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . . . . . . . . . . . -59.69 -47.28 86.27 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.338 -1.345 . . . . 0.0 111.135 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.816 HG23 ' NE1' ' R' ' 109' ' ' TRP . 47.1 m -46.68 -61.94 1.61 Allowed 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 114.395 1.257 . . . . 0.0 114.395 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 8.0 pt -64.75 -2.58 1.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.042 0 N-CA-C 117.525 2.417 . . . . 0.0 117.525 -179.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.27 -41.62 8.57 Favored 'General case' 0 N--CA 1.497 1.882 0 C-N-CA 118.398 -1.321 . . . . 0.0 113.511 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.6 ptm180 -62.95 -12.98 29.2 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . 0.454 ' O ' HD22 ' S' ' 61' ' ' LEU . . . -99.75 25.52 27.94 Favored Glycine 0 N--CA 1.5 2.921 0 C-N-CA 119.148 -1.501 . . . . 0.0 111.023 -179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.3 t -119.44 -31.34 4.64 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 119.61 -0.836 . . . . 0.0 112.432 -179.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . 0.433 ' ND2' ' N ' ' S' ' 87' ' ' ASN . 0.0 OUTLIER -100.08 -21.01 15.75 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.458 -0.897 . . . . 0.0 111.689 -179.81 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -48.35 -23.59 0.97 Allowed 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 119.66 -0.816 . . . . 0.0 111.683 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 34.9 mt -63.65 -39.01 93.26 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.361 -0.935 . . . . 0.0 112.113 -179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.76 -28.32 17.46 Favored 'General case' 0 N--CA 1.498 1.958 0 C-N-CA 118.666 -1.214 . . . . 0.0 111.282 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -43.47 -57.77 2.93 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 114.972 -1.013 . . . . 0.0 112.888 -179.663 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . 0.672 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . -158.8 -58.79 0.02 OUTLIER Pre-proline 0 N--CA 1.494 1.766 0 C-N-CA 118.556 -1.258 . . . . 0.0 114.014 -179.947 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . 0.672 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 6.5 Cg_exo -45.98 89.18 0.02 OUTLIER 'Trans proline' 0 C--N 1.325 -0.684 0 C-N-CA 120.607 0.871 . . . . 0.0 112.224 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . 0.519 ' N ' ' O ' ' S' ' 92' ' ' ALA . 2.4 t -111.2 -28.83 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.479 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -63.19 -25.31 68.28 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.91 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . 0.403 ' O ' ' C ' ' S' ' 97' ' ' ARG . 8.7 mp -45.91 -48.78 16.12 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.746 -179.984 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' S' ' 96' ' ' LEU . 0.3 OUTLIER -42.64 -47.14 5.23 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 119.512 -0.875 . . . . 0.0 110.57 179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -61.28 -46.11 91.71 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 119.335 -0.946 . . . . 0.0 110.915 179.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.654 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 9.6 t90 -74.42 -62.04 1.66 Allowed 'General case' 0 N--CA 1.492 1.64 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.925 -179.938 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.473 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -34.64 -39.67 0.09 Allowed 'General case' 0 C--N 1.301 -1.529 0 N-CA-C 114.196 1.184 . . . . 0.0 114.196 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.473 ' C ' ' O ' ' S' ' 100' ' ' LEU . 2.0 mm-40 -42.27 -42.87 3.23 Favored 'General case' 0 C--N 1.297 -1.709 0 C-N-CA 118.048 -1.461 . . . . 0.0 107.135 179.916 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 3.3 mt-10 -82.86 -27.06 31.03 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 113.387 -1.733 . . . . 0.0 112.894 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.654 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 8.0 t -83.4 -39.14 14.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 C-N-CA 116.66 -2.016 . . . . 0.0 112.962 -179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.55 -50.17 7.03 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 118.743 -1.183 . . . . 0.0 111.35 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . 0.58 HD22 ' H ' ' S' ' 105' ' ' LEU . 1.0 OUTLIER -87.15 11.74 13.25 Favored 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 118.687 -1.205 . . . . 0.0 109.913 179.982 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . 0.448 ' C ' ' O ' ' S' ' 105' ' ' LEU . 21.2 tttm -32.3 -41.87 0.06 Allowed 'General case' 0 N--CA 1.491 1.596 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.598 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 33.2 t . . . . . 0 N--CA 1.486 1.361 0 CA-C-O 116.35 -1.786 . . . . 0.0 110.873 -179.977 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.501 ' N ' ' O ' ' S' ' 40' ' ' ASN . 1.0 OUTLIER . . . . . 0 N--CA 1.485 1.293 0 CA-C-O 116.285 -1.817 . . . . 0.0 110.247 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.816 ' NE1' HG23 ' S' ' 81' ' ' THR . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 116.459 -1.734 . . . . 0.0 109.438 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 24.5 mm-40 . . . . . 0 N--CA 1.489 1.504 0 CA-C-O 120.802 0.334 . . . . 0.0 110.649 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -99.88 165.45 14.58 Favored Pre-proline 0 N--CA 1.489 1.487 0 C-N-CA 119.752 -0.779 . . . . 0.0 110.836 -179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . 0.49 ' O ' ' N ' ' R' ' 8' ' ' SER . 3.0 Cg_exo -54.75 124.56 16.51 Favored 'Trans proline' 0 C--N 1.32 -0.951 0 C-N-CA 121.477 1.452 . . . . 0.0 112.453 179.94 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER 58.27 -76.02 0.02 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 CA-C-N 115.298 -0.865 . . . . 0.0 111.788 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . 0.49 ' N ' ' O ' ' R' ' 6' ' ' PRO . 0.7 OUTLIER -166.7 -59.23 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 118.242 -1.383 . . . . 0.0 112.481 -179.967 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -127.35 111.11 13.51 Favored 'General case' 0 N--CA 1.491 1.613 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.96 -179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -83.15 -172.98 4.44 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 119.489 -0.884 . . . . 0.0 110.301 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 32.3 mmm -59.81 -108.27 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.391 0 C-N-CA 119.117 -1.033 . . . . 0.0 110.582 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -171.11 -102.65 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.508 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -128.13 -81.22 0.59 Allowed 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.296 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -66.32 165.24 14.41 Favored 'General case' 0 C--N 1.306 -1.313 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.319 179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -176.08 -32.73 0.01 OUTLIER 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 119.196 -1.002 . . . . 0.0 110.825 179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 9.75 10.39 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.125 -1.03 . . . . 0.0 110.794 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.425 ' C ' ' N ' ' R' ' 19' ' ' TRP . 6.2 tt0 -85.7 -84.36 0.16 Allowed 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 119.235 -0.986 . . . . 0.0 110.66 179.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . 0.4 ' H ' ' HB3' ' R' ' 17' ' ' GLN . 0.8 OUTLIER -44.63 -30.84 0.99 Allowed 'General case' 0 N--CA 1.494 1.77 0 CA-C-O 122.897 1.332 . . . . 0.0 109.008 179.791 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . 0.425 ' N ' ' C ' ' R' ' 17' ' ' GLN . 54.3 t-105 -55.12 -56.75 16.33 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-N 112.804 -1.998 . . . . 0.0 109.059 179.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 8.3 tp -51.85 -38.16 54.87 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-N 114.304 -1.316 . . . . 0.0 111.898 179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.469 ' O ' ' C ' ' R' ' 22' ' ' PHE . 21.9 mtp180 -56.82 -64.34 0.91 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.781 -1.168 . . . . 0.0 111.195 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.474 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.5 OUTLIER -35.82 -48.12 0.54 Allowed 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 118.813 -1.155 . . . . 0.0 111.435 179.71 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . 0.471 ' O ' ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -76.61 -68.44 0.47 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 119.251 -0.98 . . . . 0.0 110.975 179.887 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.433 ' C ' ' O ' ' R' ' 23' ' ' VAL . 9.0 t70 -39.84 -28.49 0.05 OUTLIER 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.647 -0.821 . . . . 0.0 110.112 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.471 ' N ' ' O ' ' R' ' 23' ' ' VAL . 10.2 tp -77.73 -56.77 4.24 Favored 'General case' 0 C--N 1.299 -1.588 0 CA-C-N 114.941 -1.027 . . . . 0.0 108.347 179.856 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 1.7 tt -41.09 -59.43 1.49 Allowed 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.025 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . 0.426 ' O ' ' N ' ' R' ' 29' ' ' ALA . 0.1 OUTLIER -54.45 -60.9 2.72 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.287 -0.965 . . . . 0.0 111.088 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -43.21 -24.29 0.08 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 119.485 -0.886 . . . . 0.0 111.401 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.426 ' N ' ' O ' ' R' ' 27' ' ' LYS . . . -97.9 -31.89 11.96 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.357 -0.937 . . . . 0.0 111.197 -179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -50.73 -38.08 45.45 Favored 'General case' 0 C--N 1.305 -1.332 0 C-N-CA 118.794 -1.163 . . . . 0.0 110.105 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -63.95 -27.37 69.09 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 119.632 -0.827 . . . . 0.0 110.082 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . 0.437 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 2.4 m120 -101.61 -10.15 20.32 Favored 'General case' 0 N--CA 1.487 1.399 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.087 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . 0.437 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 1.5 m-20 75.71 17.32 2.35 Favored 'General case' 0 N--CA 1.493 1.71 0 CA-C-O 121.413 0.625 . . . . 0.0 110.291 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -85.27 -15.33 43.81 Favored 'General case' 0 C--N 1.302 -1.468 0 CA-C-N 115.163 -0.926 . . . . 0.0 108.621 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . 0.416 ' O ' HD13 ' R' ' 39' ' ' LEU . 9.5 p-80 -52.24 -13.94 0.39 Allowed 'General case' 0 C--N 1.293 -1.872 0 CA-C-N 113.832 -1.531 . . . . 0.0 112.797 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 8.2 mt -79.27 -66.01 0.28 Allowed Pre-proline 0 N--CA 1.488 1.431 0 C-N-CA 117.504 -1.679 . . . . 0.0 110.147 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.455 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.2 Cg_endo -53.98 -26.97 42.92 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 N-CA-C 109.501 -1.0 . . . . 0.0 109.501 179.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 1.5 tp -77.48 -35.53 53.6 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 115.487 -0.778 . . . . 0.0 109.947 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.424 ' HA ' HD12 ' R' ' 39' ' ' LEU . 0.3 OUTLIER -55.68 -33.74 64.4 Favored 'General case' 0 C--N 1.304 -1.402 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 179.602 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -74.64 5.18 5.12 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.47 -0.892 . . . . 0.0 111.256 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mt -113.23 -58.08 2.2 Favored 'General case' 0 N--CA 1.496 1.855 0 C-N-CA 119.817 -0.753 . . . . 0.0 112.812 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.91 36.29 0.72 Allowed 'General case' 0 N--CA 1.505 2.311 0 C-N-CA 118.381 -1.328 . . . . 0.0 112.876 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER 165.24 140.64 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 CA-C-N 114.719 -1.128 . . . . 0.0 108.591 179.814 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.649 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.87 -33.35 0.0 OUTLIER Pre-proline 0 N--CA 1.496 1.838 0 N-CA-C 116.275 1.954 . . . . 0.0 116.275 -179.627 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.649 ' CD ' ' H ' ' R' ' 44' ' ' THR . 34.9 Cg_endo -88.99 -103.16 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.146 0 C-N-CA 121.054 1.169 . . . . 0.0 112.16 -179.64 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . 0.709 ' O ' ' HB3' ' R' ' 50' ' ' ALA . 0.6 OUTLIER -52.21 -13.56 0.34 Allowed 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 119.245 -0.982 . . . . 0.0 109.411 -179.883 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.475 ' N ' ' C ' ' R' ' 45' ' ' PRO . 7.1 mm-40 -69.79 -61.67 1.69 Allowed 'General case' 0 C--N 1.298 -1.667 0 C-N-CA 118.829 -1.148 . . . . 0.0 109.079 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.9 -21.92 13.14 Favored 'General case' 0 C--N 1.299 -1.604 0 C-N-CA 118.94 -1.104 . . . . 0.0 110.39 179.925 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 4.6 mt-10 -108.08 -71.68 0.75 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 119.58 -0.848 . . . . 0.0 112.595 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.709 ' HB3' ' O ' ' R' ' 46' ' ' ASP . . . -48.86 -36.99 18.25 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . 0.443 ' HG ' ' N ' ' R' ' 52' ' ' GLY . 0.2 OUTLIER -69.57 -38.67 77.48 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.177 -1.409 . . . . 0.0 110.932 -179.892 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . 0.443 ' N ' ' HG ' ' R' ' 51' ' ' LEU . . . -65.99 -28.14 73.42 Favored Glycine 0 N--CA 1.485 1.901 0 N-CA-C 108.505 -1.838 . . . . 0.0 108.505 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.552 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -63.61 -79.45 0.04 OUTLIER 'General case' 0 C--N 1.298 -1.652 0 CA-C-N 114.54 -0.83 . . . . 0.0 110.594 179.852 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.45 ' HA ' HG23 ' R' ' 57' ' ' ILE . 1.2 ptp180 -36.02 -50.5 0.69 Allowed 'General case' 0 N--CA 1.496 1.835 0 O-C-N 123.796 0.685 . . . . 0.0 111.286 179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 17.3 t -57.69 -36.35 54.31 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 C-N-CA 118.04 -1.464 . . . . 0.0 110.314 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.552 ' N ' ' O ' ' R' ' 53' ' ' THR . 2.8 mtm180 -75.37 -40.44 58.04 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 119.642 -0.823 . . . . 0.0 112.533 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 1.045 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -70.34 -38.99 76.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.801 0 C-N-CA 116.869 -1.933 . . . . 0.0 109.532 -179.714 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 1.045 ' N ' HD13 ' R' ' 57' ' ' ILE . 54.3 t -59.82 -59.28 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 C-N-CA 117.73 -1.588 . . . . 0.0 109.33 179.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -51.59 -24.73 5.78 Favored 'General case' 0 C--N 1.304 -1.374 0 CA-C-N 115.361 -0.836 . . . . 0.0 111.781 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -74.77 -50.73 16.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 119.392 -0.923 . . . . 0.0 112.942 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 49.5 mt -61.89 -31.6 71.91 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.368 -0.933 . . . . 0.0 112.562 -179.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 2.2 tp -43.26 -53.57 5.08 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 118.995 -1.082 . . . . 0.0 111.327 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -125.21 26.59 6.86 Favored 'General case' 0 N--CA 1.493 1.711 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.51 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . 0.598 ' O ' ' N ' ' R' ' 66' ' ' MET . . . -116.54 29.31 7.01 Favored Glycine 0 N--CA 1.487 2.035 0 N-CA-C 110.179 -1.168 . . . . 0.0 110.179 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.531 ' C ' ' O ' ' R' ' 64' ' ' GLY . 1.7 mt-10 -18.15 -46.24 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 O-C-N 124.244 0.614 . . . . 0.0 111.935 179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . 0.598 ' N ' ' O ' ' R' ' 64' ' ' GLY . 0.6 OUTLIER -67.91 131.96 46.46 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 119.149 -1.02 . . . . 0.0 108.608 179.798 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 8.0 t -154.12 70.02 0.8 Allowed 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 117.672 -1.611 . . . . 0.0 111.654 -179.641 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . 0.436 ' OE1' ' CA ' ' R' ' 68' ' ' GLN . 0.5 OUTLIER -114.64 -44.22 3.09 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 115.276 -0.875 . . . . 0.0 109.787 179.932 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -76.24 27.31 0.12 Allowed 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.798 -0.761 . . . . 0.0 112.641 -179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -61.96 -23.73 66.56 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 118.265 -1.374 . . . . 0.0 109.179 179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER 58.89 109.4 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 115.108 -0.951 . . . . 0.0 111.35 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . 0.537 ' C ' ' H ' ' R' ' 74' ' ' GLU . 15.6 tttm -98.41 66.82 1.76 Allowed 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 119.834 -0.746 . . . . 0.0 110.103 -179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . 0.619 ' O ' ' N ' ' R' ' 75' ' ' LEU . 0.8 OUTLIER -71.81 16.61 0.11 Allowed 'General case' 0 N--CA 1.491 1.592 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.661 179.983 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . 0.537 ' H ' ' C ' ' R' ' 72' ' ' LYS . 22.6 mt-10 49.95 -78.58 0.01 OUTLIER 'General case' 0 C--N 1.286 -2.189 0 CA-C-N 114.418 -1.264 . . . . 0.0 111.098 -179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.619 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.5 mt -56.05 -15.93 4.27 Favored 'General case' 0 C--N 1.286 -2.158 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.417 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . 0.402 ' N ' ' C ' ' R' ' 74' ' ' GLU . . . -60.52 -65.17 3.52 Favored Glycine 0 N--CA 1.49 2.246 0 CA-C-N 115.124 -0.944 . . . . 0.0 110.935 -179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -134.65 -18.63 1.89 Allowed 'General case' 0 N--CA 1.494 1.744 0 C-N-CA 119.128 -1.029 . . . . 0.0 112.226 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . 0.499 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 87.56 97.34 0.9 Allowed Glycine 0 N--CA 1.498 2.796 0 C-N-CA 119.047 -1.549 . . . . 0.0 109.927 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.574 HD12 ' OG1' ' R' ' 83' ' ' THR . 0.1 OUTLIER -20.71 -44.39 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.487 1.384 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -179.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.499 ' N ' ' O ' ' R' ' 78' ' ' GLY . . . -50.01 -12.83 0.09 Allowed 'General case' 0 N--CA 1.497 1.908 0 C-N-CA 119.275 -0.97 . . . . 0.0 112.285 -179.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . 0.524 ' HA ' ' HE1' ' R' ' 1' ' ' TRP . 17.0 m -88.95 -51.13 5.78 Favored 'General case' 0 C--N 1.299 -1.59 0 N-CA-C 113.27 0.841 . . . . 0.0 113.27 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . 0.424 ' H ' HG23 ' R' ' 82' ' ' ILE . 0.8 OUTLIER -80.5 6.83 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -179.719 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.574 ' OG1' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -105.34 -13.55 15.62 Favored 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.649 -1.22 . . . . 0.0 112.737 -179.92 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.619 ' NE ' ' CE3' ' R' ' 1' ' ' TRP . 0.2 OUTLIER -96.73 -33.52 11.68 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 118.556 -1.258 . . . . 0.0 109.408 -179.978 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -45.35 -29.34 2.51 Favored Glycine 0 N--CA 1.484 1.89 0 CA-C-N 114.908 -1.042 . . . . 0.0 111.729 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -96.41 -50.69 4.66 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 118.629 -1.229 . . . . 0.0 112.219 -179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . 0.539 ' N ' ' OD1' ' R' ' 87' ' ' ASN . 0.7 OUTLIER -68.14 5.83 0.87 Allowed 'General case' 0 N--CA 1.493 1.703 0 C-N-CA 119.651 -0.82 . . . . 0.0 112.489 -179.957 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 42.5 m -116.45 -46.9 2.76 Favored 'General case' 0 N--CA 1.489 1.504 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.401 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.2 tt -46.65 -36.4 6.98 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.882 -0.599 . . . . 0.0 111.199 -179.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 53.4 mttt -66.14 -70.92 0.21 Allowed 'General case' 0 C--N 1.307 -1.274 0 CA-C-O 122.062 0.935 . . . . 0.0 112.393 -179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 92' ' ' ALA . . . -58.86 -82.52 0.02 OUTLIER 'General case' 0 C--N 1.292 -1.929 0 CA-C-N 113.813 -1.54 . . . . 0.0 112.781 -179.616 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.435 ' O ' ' O ' ' R' ' 91' ' ' ALA . . . 58.1 150.27 0.07 OUTLIER Pre-proline 0 N--CA 1.492 1.634 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.037 -179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -54.3 152.88 23.99 Favored 'Trans proline' 0 C--O 1.214 -0.701 0 C-N-CA 121.079 1.186 . . . . 0.0 110.565 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 33.5 t -74.51 -61.49 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 C-N-CA 119.36 -0.936 . . . . 0.0 112.992 -179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -60.46 -16.98 41.85 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 119.466 -0.893 . . . . 0.0 112.997 -179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . 0.525 ' C ' HD13 ' R' ' 96' ' ' LEU . 3.1 tm? -79.6 -35.72 39.15 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 118.775 -1.17 . . . . 0.0 111.308 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.85 -24.97 55.8 Favored 'General case' 0 C--N 1.303 -1.444 0 C-N-CA 118.892 -1.123 . . . . 0.0 109.918 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 2.9 mm100 -65.69 -19.3 65.85 Favored 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 119.213 -0.995 . . . . 0.0 110.053 179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.652 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 21.0 t90 -97.16 -55.02 2.98 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.022 -0.99 . . . . 0.0 111.99 -179.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.581 HD13 ' HB ' ' R' ' 103' ' ' VAL . 2.0 mm? -39.59 -28.84 0.05 OUTLIER 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.02 -1.072 . . . . 0.0 113.542 179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.443 ' C ' ' O ' ' R' ' 100' ' ' LEU . 10.2 mm-40 -47.1 -39.02 12.41 Favored 'General case' 0 C--N 1.292 -1.93 0 C-N-CA 117.717 -1.593 . . . . 0.0 107.519 179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -89.47 -28.55 19.61 Favored 'General case' 0 C--N 1.302 -1.48 0 CA-C-N 113.936 -1.483 . . . . 0.0 112.415 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.652 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 10.4 t -78.82 -34.0 16.85 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 C-N-CA 116.606 -2.038 . . . . 0.0 111.16 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -77.0 -48.86 16.78 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 119.292 -0.963 . . . . 0.0 109.315 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . 0.739 ' C ' HD13 ' R' ' 105' ' ' LEU . 2.4 tm? -58.05 -44.04 87.22 Favored 'General case' 0 C--N 1.308 -1.232 0 C-N-CA 119.527 -0.869 . . . . 0.0 109.837 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -41.92 -20.18 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 119.756 -0.778 . . . . 0.0 111.3 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . 0.529 ' N ' ' O ' ' R' ' 105' ' ' LEU . 0.3 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 116.398 -1.763 . . . . 0.0 110.86 179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 37.1 mt-30 . . . . . 0 N--CA 1.486 1.335 0 CA-C-O 120.917 0.389 . . . . 0.0 109.977 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . 0.574 ' N ' ' CD ' ' S' ' 6' ' ' PRO . 0.0 OUTLIER -93.42 -43.09 0.32 Allowed Pre-proline 0 C--N 1.305 -1.327 0 C-N-CA 119.562 -0.855 . . . . 0.0 112.311 179.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' S' ' 5' ' ' SER . 4.6 Cg_endo -73.21 -52.99 0.14 Allowed 'Trans proline' 0 C--N 1.32 -0.956 0 C-N-CA 121.038 1.159 . . . . 0.0 111.544 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 19.8 m-85 -54.57 -6.13 0.1 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.863 -0.735 . . . . 0.0 111.993 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . 0.423 ' H ' ' C ' ' S' ' 6' ' ' PRO . 3.5 m -86.4 105.01 16.43 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 118.989 -1.084 . . . . 0.0 110.895 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . 50.78 93.74 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.78 180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -161.44 110.98 1.6 Allowed 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 119.03 -1.068 . . . . 0.0 111.265 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 1.2 mpt? -125.71 -6.79 6.82 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.405 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.7 -3.64 51.45 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.424 -0.91 . . . . 0.0 110.48 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -66.99 151.57 47.4 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.009 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 7.3 tp60 -63.2 146.21 53.86 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.641 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.9 73.67 0.43 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 119.192 -1.003 . . . . 0.0 110.684 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -117.46 12.6 14.23 Favored 'General case' 0 N--CA 1.49 1.558 0 CA-C-N 114.865 -1.062 . . . . 0.0 109.447 179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.478 ' C ' ' N ' ' S' ' 19' ' ' TRP . 1.2 mt-30 -89.62 -81.41 0.28 Allowed 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.858 -0.737 . . . . 0.0 110.115 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 3.1 mp0 -42.12 -30.61 0.3 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 122.942 1.353 . . . . 0.0 108.158 179.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . 0.478 ' N ' ' C ' ' S' ' 17' ' ' GLN 0.26 72.2 t-105 -56.44 -56.09 25.5 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 112.356 -2.202 . . . . 0.0 109.269 179.703 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' S' ' 17' ' ' GLN . 5.9 tp -58.87 -27.34 65.08 Favored 'General case' 0 C--N 1.298 -1.636 0 CA-C-N 113.645 -1.616 . . . . 0.0 111.845 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.457 ' O ' ' C ' ' S' ' 22' ' ' PHE . 28.9 mtt85 -66.49 -74.42 0.11 Allowed 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 118.48 -1.288 . . . . 0.0 109.65 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.457 ' C ' ' O ' ' S' ' 21' ' ' ARG . 0.0 OUTLIER -36.34 -42.45 0.32 Allowed 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 119.708 -0.797 . . . . 0.0 111.172 179.732 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.416 ' O ' ' C ' ' S' ' 24' ' ' ASP . 3.0 t -69.79 -56.03 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.821 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.7 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.416 ' C ' ' O ' ' S' ' 23' ' ' VAL . 22.6 t0 -35.94 -73.31 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.415 0 CA-C-N 114.927 -1.033 . . . . 0.0 111.725 -179.836 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.527 HD23 ' N ' ' S' ' 25' ' ' LEU . 0.1 OUTLIER -49.97 -46.16 52.15 Favored 'General case' 0 C--N 1.3 -1.58 0 C-N-CA 119.245 -0.982 . . . . 0.0 111.584 -179.992 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.709 HD11 ' CD1' ' S' ' 39' ' ' LEU . 2.1 tp -45.18 -30.5 1.19 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.753 -1.179 . . . . 0.0 112.057 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . . . . . . . . . 18.2 ttpt -75.25 -71.77 0.34 Allowed 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 118.894 -1.122 . . . . 0.0 112.464 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 21.7 m120 -50.62 -27.04 6.11 Favored 'General case' 0 N--CA 1.491 1.608 0 N-CA-C 112.995 0.739 . . . . 0.0 112.995 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . 0.506 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -78.59 -50.1 12.1 Favored 'General case' 0 C--N 1.301 -1.528 0 C-N-CA 118.773 -1.171 . . . . 0.0 111.94 -179.831 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . 0.443 ' CD1' ' C ' ' S' ' 30' ' ' TYR . 11.2 t80 -44.55 -38.24 4.07 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 119.057 -1.057 . . . . 0.0 111.247 -179.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -46.38 -37.23 7.29 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 119.003 -1.079 . . . . 0.0 110.711 -179.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -103.65 -79.34 0.54 Allowed 'General case' 0 N--CA 1.489 1.498 0 C-N-CA 119.728 -0.789 . . . . 0.0 111.788 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 172.73 35.86 0.0 OUTLIER 'General case' 0 N--CA 1.493 1.695 0 CA-C-O 121.953 0.882 . . . . 0.0 109.322 -179.801 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . 0.527 HD23 ' CD2' ' R' ' 99' ' ' TRP . 0.3 OUTLIER -100.95 -19.37 15.9 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.47 -1.241 . . . . 0.0 109.767 -179.942 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . . . . . . . . . 34.5 p-80 -57.08 -17.98 12.58 Favored 'General case' 0 C--N 1.295 -1.779 0 CA-C-N 114.452 -1.249 . . . . 0.0 112.544 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.457 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.2 mt -76.84 -63.33 0.54 Allowed Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 118.263 -1.375 . . . . 0.0 110.304 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.457 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 5.4 Cg_exo -50.98 -32.0 36.66 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 N-CA-C 109.863 -0.861 . . . . 0.0 109.863 179.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 5.4 mt -67.85 -43.54 79.25 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 119.649 -0.82 . . . . 0.0 110.398 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.709 ' CD1' HD11 ' S' ' 26' ' ' LEU . 0.3 OUTLIER -54.78 -34.06 62.17 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 119.732 -0.787 . . . . 0.0 110.101 179.839 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -83.89 10.69 9.1 Favored 'General case' 0 C--N 1.301 -1.516 0 C-N-CA 119.043 -1.063 . . . . 0.0 110.81 -179.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -111.38 -63.58 1.39 Allowed 'General case' 0 N--CA 1.491 1.619 0 C-N-CA 119.882 -0.727 . . . . 0.0 112.929 -179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . . . . . . . . . 1.7 mtt -91.39 33.58 0.99 Allowed 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 118.93 -1.108 . . . . 0.0 113.709 -179.622 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . 0.458 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.6 OUTLIER 164.91 142.23 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.453 0 O-C-N 123.439 0.462 . . . . 0.0 110.021 179.842 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.603 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -177.25 -42.41 0.0 OUTLIER Pre-proline 0 N--CA 1.485 1.313 0 C-N-CA 117.196 -1.802 . . . . 0.0 115.238 -179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.603 ' HD2' ' H ' ' S' ' 44' ' ' THR . 16.0 Cg_endo -76.64 -110.33 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.156 0 C-N-CA 121.12 1.213 . . . . 0.0 113.403 -179.496 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . 0.426 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 1.0 OUTLIER -51.28 -16.95 0.6 Allowed 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 119.533 -0.867 . . . . 0.0 110.49 -179.826 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . 0.401 ' N ' ' C ' ' S' ' 45' ' ' PRO . 5.9 mm-40 -65.76 -66.99 0.48 Allowed 'General case' 0 C--N 1.297 -1.71 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.016 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 33.6 ttp180 -51.82 -42.2 62.35 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 115.426 -0.806 . . . . 0.0 112.113 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 10.9 mt-10 -64.08 -68.9 0.31 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.051 -1.06 . . . . 0.0 112.208 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . 0.51 ' HB1' ' N ' ' R' ' 109' ' ' TRP . . . -55.44 -22.57 21.01 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.191 -1.004 . . . . 0.0 111.257 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . 0.436 HD11 ' CG ' ' R' ' 22' ' ' PHE . 5.7 tt -67.68 -53.27 29.08 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.495 -0.882 . . . . 0.0 110.87 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -56.69 -52.1 52.67 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 108.684 -1.766 . . . . 0.0 108.684 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.551 ' O ' ' N ' ' S' ' 56' ' ' ARG . 0.1 OUTLIER -39.83 -74.46 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.472 0 CA-C-O 121.982 0.896 . . . . 0.0 111.071 179.906 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.57 ' HB2' ' CZ3' ' R' ' 109' ' ' TRP . 0.0 OUTLIER -41.76 -39.03 1.61 Allowed 'General case' 0 C--N 1.284 -2.256 0 CA-C-N 113.868 -1.514 . . . . 0.0 112.638 179.943 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . 0.569 ' CG2' ' HE ' ' S' ' 54' ' ' ARG . 13.4 t -73.6 -27.68 23.63 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.831 0 C-N-CA 117.874 -1.53 . . . . 0.0 108.209 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.551 ' N ' ' O ' ' S' ' 53' ' ' THR . 0.1 OUTLIER -80.97 -35.28 32.33 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 114.91 -1.041 . . . . 0.0 112.306 179.919 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 1.009 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -73.08 -35.98 49.46 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 C-N-CA 116.662 -2.015 . . . . 0.0 106.997 179.987 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . 1.009 ' N ' HD13 ' S' ' 57' ' ' ILE . 9.9 t -62.25 -63.32 0.84 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 C-N-CA 118.68 -1.208 . . . . 0.0 109.536 179.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -50.57 -32.01 17.41 Favored 'General case' 0 C--N 1.306 -1.318 0 CA-C-N 115.661 -0.7 . . . . 0.0 110.926 179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -73.76 -54.17 8.65 Favored 'General case' 0 N--CA 1.487 1.395 0 C-N-CA 119.39 -0.924 . . . . 0.0 110.859 -179.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 15.6 mt -46.68 -26.5 0.93 Allowed 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.934 -1.106 . . . . 0.0 109.903 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -55.16 -35.62 64.95 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 119.643 -0.823 . . . . 0.0 110.841 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . 0.485 ' O ' ' N ' ' S' ' 65' ' ' GLU . 7.8 mtt-85 -117.36 25.81 10.19 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-N 115.694 -0.685 . . . . 0.0 110.167 179.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.414 ' O ' ' C ' ' S' ' 65' ' ' GLU . . . -43.84 -18.89 0.09 OUTLIER Glycine 0 N--CA 1.491 2.305 0 C-N-CA 119.754 -1.212 . . . . 0.0 111.165 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . 0.485 ' N ' ' O ' ' S' ' 63' ' ' ARG . 1.0 OUTLIER -39.79 -42.78 1.33 Allowed 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 119.767 -0.773 . . . . 0.0 111.277 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 82.3 mmm -57.14 -99.48 0.0 OUTLIER 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 115.287 -0.869 . . . . 0.0 111.885 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 4.1 t -178.76 78.97 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 119.586 -0.846 . . . . 0.0 109.37 -179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.623 ' C ' ' H ' ' S' ' 70' ' ' GLU . 1.3 pp0? -112.17 -15.45 13.22 Favored 'General case' 0 C--N 1.3 -1.567 0 CA-C-N 115.225 -0.898 . . . . 0.0 111.922 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.08 25.93 0.02 OUTLIER 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.738 179.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.623 ' H ' ' C ' ' S' ' 68' ' ' GLN . 49.2 mt-10 -126.29 4.23 7.03 Favored 'General case' 0 C--N 1.298 -1.649 0 CA-C-N 115.384 -0.825 . . . . 0.0 110.698 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . . . . . . . . . 6.6 mt -79.77 14.39 1.75 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 118.819 -1.152 . . . . 0.0 110.541 -179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 31.9 tttm -69.45 87.84 0.46 Allowed 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 118.289 -1.365 . . . . 0.0 110.561 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . 0.533 ' O ' ' N ' ' S' ' 75' ' ' LEU . 1.0 OUTLIER -110.16 21.73 16.4 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-O 121.885 0.85 . . . . 0.0 110.088 -179.947 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . . . . . . . . . 24.5 mt-10 58.69 -66.64 0.03 OUTLIER 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 112.901 -1.954 . . . . 0.0 110.894 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . 0.533 ' N ' ' O ' ' S' ' 73' ' ' ASN . 4.0 mt -75.1 -15.5 60.6 Favored 'General case' 0 C--N 1.293 -1.862 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.957 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -74.46 -28.54 63.42 Favored Glycine 0 N--CA 1.491 2.317 0 C-N-CA 119.635 -1.269 . . . . 0.0 110.868 179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -159.85 -77.65 0.06 Allowed 'General case' 0 N--CA 1.49 1.547 0 C-N-CA 118.933 -1.107 . . . . 0.0 111.727 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . 0.471 ' O ' ' N ' ' S' ' 81' ' ' THR . . . 140.85 109.76 0.8 Allowed Glycine 0 N--CA 1.49 2.267 0 N-CA-C 108.618 -1.793 . . . . 0.0 108.618 -179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.727 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.0 OUTLIER -29.46 -45.64 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.167 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -179.777 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.42 ' N ' HG13 ' S' ' 79' ' ' ILE . . . -59.54 -46.84 87.7 Favored 'General case' 0 C--N 1.3 -1.56 0 C-N-CA 118.982 -1.087 . . . . 0.0 111.077 -179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.477 ' HA ' ' HE1' ' R' ' 109' ' ' TRP . 61.0 m -53.57 -45.01 69.78 Favored 'General case' 0 C--N 1.298 -1.656 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 -179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 pt -84.74 10.15 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 C-N-CA 118.71 -1.196 . . . . 0.0 113.986 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.497 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -108.06 -52.71 2.73 Favored 'General case' 0 N--CA 1.499 1.977 0 C-N-CA 119.143 -1.023 . . . . 0.0 111.324 -179.911 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . . . . . . . . . 4.3 ptm180 -63.17 0.38 0.63 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.132 -1.027 . . . . 0.0 110.466 179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . 0.478 ' H ' ' C ' ' S' ' 83' ' ' THR . . . -70.86 -9.82 66.74 Favored Glycine 0 N--CA 1.487 2.038 0 C-N-CA 119.478 -1.344 . . . . 0.0 110.212 -179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . 0.443 ' C ' ' H ' ' S' ' 88' ' ' SER . 9.4 p -126.72 -42.92 1.74 Allowed 'General case' 0 N--CA 1.489 1.503 0 C-N-CA 120.012 -0.675 . . . . 0.0 110.028 -179.978 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . 0.436 ' N ' ' OG ' ' S' ' 86' ' ' SER . 0.9 OUTLIER -57.95 -7.19 0.7 Allowed 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.256 -0.978 . . . . 0.0 110.026 179.976 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . 0.443 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -66.29 -31.16 71.8 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 119.461 -0.896 . . . . 0.0 110.946 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 4.5 mt -45.68 -28.27 0.97 Allowed 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 119.018 -1.073 . . . . 0.0 109.758 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . 0.444 ' O ' ' N ' ' S' ' 92' ' ' ALA . 60.6 mttt -92.25 -75.73 0.48 Allowed 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 122.122 0.963 . . . . 0.0 110.385 179.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -40.21 -27.08 0.04 OUTLIER 'General case' 0 C--N 1.292 -1.91 0 CA-C-N 113.306 -1.77 . . . . 0.0 111.921 -179.76 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . 0.444 ' N ' ' O ' ' S' ' 90' ' ' LYS . . . -91.1 149.71 40.41 Favored Pre-proline 0 N--CA 1.489 1.488 0 C-N-CA 118.972 -1.091 . . . . 0.0 111.707 -179.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -54.8 160.68 7.18 Favored 'Trans proline' 0 C--O 1.215 -0.673 0 C-N-CA 121.403 1.402 . . . . 0.0 111.699 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . . . . . . . . . 83.6 t -88.42 -26.57 5.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.395 0 C-N-CA 118.774 -1.171 . . . . 0.0 109.63 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -58.87 -8.82 1.5 Allowed 'General case' 0 C--N 1.304 -1.397 0 CA-C-N 115.21 -0.904 . . . . 0.0 110.732 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 2.5 mt -66.1 -51.66 55.95 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.817 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.21 -50.38 3.59 Favored 'General case' 0 N--CA 1.494 1.743 0 C-N-CA 120.041 -0.663 . . . . 0.0 111.911 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -55.98 -30.12 61.31 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 119.837 -0.745 . . . . 0.0 112.791 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.4 ' CH2' HG11 ' S' ' 103' ' ' VAL . 7.8 t90 -86.07 -54.13 4.66 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 119.387 -0.925 . . . . 0.0 112.808 -179.733 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.617 HD13 HG23 ' S' ' 103' ' ' VAL . 2.1 mm? -40.14 -41.49 1.28 Allowed 'General case' 0 C--N 1.293 -1.871 0 C-N-CA 118.802 -1.159 . . . . 0.0 113.663 179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.451 ' C ' ' O ' ' S' ' 100' ' ' LEU . 4.5 mt-10 -46.11 -30.33 1.86 Allowed 'General case' 0 C--N 1.289 -2.064 0 C-N-CA 118.26 -1.376 . . . . 0.0 108.229 179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . 0.412 ' N ' ' C ' ' S' ' 100' ' ' LEU . 3.9 mm-40 -87.79 -39.25 15.05 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.319 -1.31 . . . . 0.0 114.026 -179.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.617 HG23 HD13 ' S' ' 100' ' ' LEU . 0.2 OUTLIER -82.77 -18.8 10.51 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.555 0 C-N-CA 114.826 -2.749 . . . . 0.0 111.192 -179.829 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . 0.455 HD23 HD12 ' S' ' 100' ' ' LEU . 0.0 OUTLIER -87.28 -50.92 6.26 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 119.002 -1.079 . . . . 0.0 110.732 179.866 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 50.3 tp -55.77 -53.26 58.81 Favored 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.715 -0.794 . . . . 0.0 112.46 -179.836 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -56.31 -59.94 4.23 Favored 'General case' 0 N--CA 1.491 1.61 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.976 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.488 1.437 0 CA-C-O 116.431 -1.747 . . . . 0.0 110.344 179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.619 ' CE3' ' NE ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 116.343 -1.789 . . . . 0.0 109.898 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.57 ' CZ3' ' HB2' ' S' ' 54' ' ' ARG . 11.6 m95 . . . . . 0 N--CA 1.484 1.266 0 CA-C-O 116.047 -1.93 . . . . 0.0 110.601 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 18.2 mt-30 . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 110.102 -0.333 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 28.9 m -154.42 68.18 5.75 Favored Pre-proline 0 N--CA 1.486 1.359 0 C-N-CA 119.176 -1.01 . . . . 0.0 111.399 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -67.45 145.78 72.25 Favored 'Trans proline' 0 C--N 1.315 -1.233 0 C-N-CA 121.648 1.565 . . . . 0.0 111.2 -179.973 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -73.51 150.0 41.87 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 119.179 -1.008 . . . . 0.0 110.711 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 95.5 p -145.99 73.87 1.35 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.856 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.36 -44.96 93.3 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 119.377 -0.929 . . . . 0.0 110.813 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . -178.3 -74.95 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.743 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 10.7 ttm 45.59 92.89 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.916 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -176.38 60.61 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 C-N-CA 119.417 -0.913 . . . . 0.0 110.862 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 6.6 mt-10 -51.31 -74.99 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.629 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 75.7 mt-30 45.88 91.03 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.574 -0.85 . . . . 0.0 111.225 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -143.2 -40.08 0.32 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 119.539 -0.864 . . . . 0.0 110.479 179.912 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 26.9 t-80 -158.87 27.11 0.22 Allowed 'General case' 0 C--N 1.304 -1.387 0 C-N-CA 118.842 -1.143 . . . . 0.0 111.604 179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . . . . . . . . . 1.3 mt-30 -110.44 -79.15 0.58 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . . . . . . . . . 74.5 mm-40 -61.41 -30.69 70.72 Favored 'General case' 0 N--CA 1.486 1.358 0 N-CA-C 106.949 -1.5 . . . . 0.0 106.949 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . . . . . . . . . 9.6 t-105 -62.02 -55.0 33.73 Favored 'General case' 0 C--N 1.304 -1.395 0 CA-C-N 113.146 -1.843 . . . . 0.0 107.417 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . 0.728 ' C ' HD13 ' R' ' 20' ' ' LEU . 1.9 tm? -56.05 -39.67 72.38 Favored 'General case' 0 C--N 1.291 -1.937 0 CA-C-N 112.681 -2.054 . . . . 0.0 109.544 179.767 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.479 ' O ' ' C ' ' R' ' 22' ' ' PHE . 4.6 mtt-85 -50.47 -69.68 0.11 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 117.858 -1.537 . . . . 0.0 109.044 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.546 ' CD1' ' C ' ' R' ' 22' ' ' PHE . 0.1 OUTLIER -32.77 -47.05 0.16 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 119.811 -0.755 . . . . 0.0 111.009 179.578 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . 0.518 HG21 HD21 ' S' ' 39' ' ' LEU . 77.2 t -66.84 -59.23 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.378 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.534 ' OD2' HD23 ' R' ' 25' ' ' LEU . 1.5 t0 -37.66 -63.47 0.46 Allowed 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 112.899 0.703 . . . . 0.0 112.899 -179.857 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.713 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.0 OUTLIER -65.14 -41.94 94.33 Favored 'General case' 0 N--CA 1.49 1.553 0 C-N-CA 118.253 -1.379 . . . . 0.0 112.205 -179.838 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . 0.709 HD13 ' C ' ' R' ' 26' ' ' LEU . 2.8 tm? -47.41 -54.65 10.75 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.518 -0.873 . . . . 0.0 112.145 -179.832 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . 0.468 ' N ' HD13 ' R' ' 26' ' ' LEU . 0.0 OUTLIER -78.66 -24.35 45.23 Favored 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 119.046 -1.062 . . . . 0.0 112.203 -179.857 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -79.71 -14.09 59.0 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.891 -1.124 . . . . 0.0 110.891 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.543 ' HB1' ' HB2' ' R' ' 34' ' ' LEU . . . -98.49 -45.85 5.97 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 119.492 -0.883 . . . . 0.0 111.462 -179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -42.69 -27.4 0.17 Allowed 'General case' 0 N--CA 1.488 1.435 0 C-N-CA 119.467 -0.893 . . . . 0.0 110.855 -179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 4.3 tt0 -56.4 -43.58 79.44 Favored 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 119.239 -0.984 . . . . 0.0 110.037 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 5.0 m-80 -96.4 -79.66 0.44 Allowed 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.62 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 172.56 27.74 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 119.885 -0.726 . . . . 0.0 110.693 -179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . 0.564 ' CD2' ' N ' ' R' ' 34' ' ' LEU . 0.8 OUTLIER -95.03 -14.27 24.46 Favored 'General case' 0 C--N 1.304 -1.385 0 C-N-CA 119.964 -0.694 . . . . 0.0 109.816 -179.889 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . 0.427 ' O ' HD13 ' R' ' 39' ' ' LEU . 16.7 p-80 -52.14 -24.84 7.63 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 114.8 -1.091 . . . . 0.0 113.12 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.438 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.4 mt -74.33 -62.75 0.95 Allowed Pre-proline 0 C--N 1.301 -1.517 0 C-N-CA 117.965 -1.494 . . . . 0.0 110.538 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.438 ' CD ' ' CB ' ' R' ' 36' ' ' LEU . 2.0 Cg_endo -54.31 -22.12 25.42 Favored 'Trans proline' 0 C--N 1.32 -0.949 0 C-N-CA 120.544 0.829 . . . . 0.0 110.469 179.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 89.9 mt -85.41 -30.13 23.83 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.889 -0.724 . . . . 0.0 110.257 179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.487 ' O ' ' CD1' ' R' ' 43' ' ' LEU . 0.1 OUTLIER -64.41 -29.36 70.42 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.166 -1.013 . . . . 0.0 108.393 179.862 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . 0.438 ' O ' ' OD1' ' R' ' 40' ' ' ASN . 0.0 OUTLIER -82.23 6.49 16.54 Favored 'General case' 0 C--N 1.3 -1.554 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.495 179.799 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . 0.465 HD23 HH12 ' S' ' 84' ' ' ARG . 1.9 mt -106.91 -55.48 2.32 Favored 'General case' 0 N--CA 1.497 1.899 0 C-N-CA 119.975 -0.69 . . . . 0.0 112.509 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -96.65 34.2 1.71 Allowed 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 119.074 -1.051 . . . . 0.0 112.762 -179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . 0.487 ' CD1' ' O ' ' R' ' 39' ' ' LEU . 0.7 OUTLIER 169.21 150.41 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.478 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 179.893 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.425 ' H ' ' CD ' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -166.12 -40.94 0.0 OUTLIER Pre-proline 0 N--CA 1.49 1.575 0 C-N-CA 116.152 -2.219 . . . . 0.0 115.898 -179.81 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.425 ' CD ' ' H ' ' R' ' 44' ' ' THR . 56.9 Cg_endo -105.99 -98.96 0.0 OUTLIER 'Trans proline' 0 C--N 1.316 -1.162 0 C-N-CA 121.121 1.214 . . . . 0.0 113.954 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -50.18 -24.35 2.76 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 119.968 -0.693 . . . . 0.0 111.08 -179.748 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.703 ' O ' HD13 ' R' ' 51' ' ' LEU . 1.0 OUTLIER -61.33 -48.71 80.1 Favored 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 118.78 -1.168 . . . . 0.0 110.087 179.929 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 16.7 ttp180 -66.11 -38.0 87.14 Favored 'General case' 0 C--N 1.307 -1.266 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.977 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -62.59 -70.73 0.19 Allowed 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 119.225 -0.99 . . . . 0.0 110.906 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . . . . . . . . . . . -45.27 -31.73 1.67 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.118 -1.033 . . . . 0.0 110.223 -179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . 0.703 HD13 ' O ' ' R' ' 47' ' ' GLU . 1.1 mp -58.72 -69.68 0.18 Allowed 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 119.565 -0.854 . . . . 0.0 110.591 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -43.34 -52.59 6.08 Favored Glycine 0 N--CA 1.492 2.424 0 C-N-CA 119.697 -1.239 . . . . 0.0 110.104 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.487 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.0 OUTLIER -43.29 -76.92 0.02 OUTLIER 'General case' 0 C--N 1.301 -1.521 0 CA-C-O 122.022 0.915 . . . . 0.0 111.521 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.486 ' HG3' ' N ' ' R' ' 55' ' ' VAL . 0.0 OUTLIER -37.72 -49.0 1.12 Allowed 'General case' 0 C--N 1.292 -1.918 0 CA-C-N 113.518 -1.674 . . . . 0.0 114.176 -179.878 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . 0.486 ' N ' ' HG3' ' R' ' 54' ' ' ARG . 64.0 t -66.28 -23.12 31.22 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.705 0 C-N-CA 117.561 -1.655 . . . . 0.0 109.489 -179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.487 ' N ' ' O ' ' R' ' 53' ' ' THR . 3.0 ptt180 -81.64 -39.57 24.21 Favored 'General case' 0 C--N 1.303 -1.429 0 C-N-CA 119.335 -0.946 . . . . 0.0 109.602 179.797 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 0.674 ' C ' HD12 ' R' ' 57' ' ' ILE . 0.4 OUTLIER -71.46 -37.75 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 C-N-CA 117.545 -1.662 . . . . 0.0 107.185 179.784 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 0.4 HG12 ' N ' ' R' ' 59' ' ' GLU . 25.6 t -63.15 -69.75 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 C-N-CA 119.111 -1.035 . . . . 0.0 109.905 179.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.4 ' N ' HG12 ' R' ' 58' ' ' VAL . 9.2 tt0 -48.43 -21.25 0.51 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.389 -0.924 . . . . 0.0 111.363 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . 0.433 ' O ' ' N ' ' R' ' 64' ' ' GLY . 33.8 mt-10 -76.29 -53.47 8.17 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 119.186 -1.006 . . . . 0.0 112.814 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 1.8 pp -62.43 -24.69 67.56 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 118.228 -1.389 . . . . 0.0 111.204 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 1.5 mt -52.47 -50.42 62.71 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 118.789 -1.164 . . . . 0.0 109.763 179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 10.9 ptp180 -117.27 15.01 14.88 Favored 'General case' 0 N--CA 1.488 1.471 0 CA-C-N 115.238 -0.892 . . . . 0.0 109.814 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . 0.433 ' N ' ' O ' ' R' ' 60' ' ' GLU . . . -100.2 25.89 26.59 Favored Glycine 0 N--CA 1.491 2.314 0 C-N-CA 119.893 -1.146 . . . . 0.0 110.405 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.41 ' C ' ' O ' ' R' ' 64' ' ' GLY . 3.5 mt-10 -38.89 -31.83 0.07 Allowed 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.913 -0.715 . . . . 0.0 111.18 179.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . . . . . . . . . 1.2 mtm -90.87 111.53 22.98 Favored 'General case' 0 C--N 1.304 -1.405 0 C-N-CA 119.421 -0.912 . . . . 0.0 110.402 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . 0.884 ' H ' HE21 ' R' ' 68' ' ' GLN . 3.4 t 177.49 76.53 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.336 0 C-N-CA 119.414 -0.914 . . . . 0.0 109.933 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . 0.884 HE21 ' H ' ' R' ' 67' ' ' SER . 6.1 mm-40 -101.82 -65.12 1.0 Allowed 'General case' 0 C--N 1.304 -1.411 0 CA-C-N 115.514 -0.766 . . . . 0.0 110.067 -179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . 0.48 ' O ' ' CD ' ' R' ' 69' ' ' ARG . 0.0 OUTLIER -83.36 24.04 0.86 Allowed 'General case' 0 C--N 1.303 -1.441 0 CA-C-O 122.49 1.138 . . . . 0.0 109.392 179.885 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . 0.457 ' H ' ' C ' ' R' ' 68' ' ' GLN . 5.4 mt-10 -125.79 25.02 6.98 Favored 'General case' 0 N--CA 1.491 1.618 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.894 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . 0.455 ' CD1' ' O ' ' R' ' 68' ' ' GLN . 1.0 OUTLIER -62.92 -139.04 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.439 0 C-N-CA 119.398 -0.921 . . . . 0.0 110.973 179.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 8.0 ptpp? -46.99 144.1 2.66 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.754 -0.778 . . . . 0.0 111.204 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . 0.574 ' O ' ' N ' ' R' ' 75' ' ' LEU . 1.3 t30 -119.61 14.57 12.7 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-O 122.073 0.94 . . . . 0.0 109.128 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 39.61 15.16 0.0 OUTLIER 'General case' 0 C--N 1.29 -2.015 0 CA-C-N 112.971 -1.922 . . . . 0.0 112.4 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.574 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.8 mt -127.66 -40.43 1.75 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.2 -0.6 . . . . 0.0 110.715 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -75.3 -69.02 1.45 Allowed Glycine 0 N--CA 1.491 2.339 0 C-N-CA 119.622 -1.275 . . . . 0.0 111.315 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -138.53 -104.98 0.18 Allowed 'General case' 0 N--CA 1.489 1.5 0 C-N-CA 119.435 -0.906 . . . . 0.0 111.303 -179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -172.99 146.44 9.03 Favored Glycine 0 N--CA 1.488 2.156 0 C-N-CA 119.525 -1.322 . . . . 0.0 110.751 -179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.87 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -39.84 -36.64 0.35 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 C-N-CA 120.75 -0.38 . . . . 0.0 111.642 -179.99 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.531 ' O ' ' NE ' ' R' ' 84' ' ' ARG . . . -52.75 -37.11 58.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.775 -0.77 . . . . 0.0 112.672 -179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . 0.541 ' CG2' ' N ' ' R' ' 82' ' ' ILE . 3.9 t -68.81 -50.9 46.31 Favored 'General case' 0 C--N 1.303 -1.434 0 C-N-CA 119.388 -0.925 . . . . 0.0 113.129 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . 0.541 ' N ' ' CG2' ' R' ' 81' ' ' THR . 12.2 pt -73.09 10.69 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.334 -1.346 . . . . 0.0 112.447 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.43 ' OG1' ' O ' ' R' ' 80' ' ' ALA . 0.0 OUTLIER -93.52 -68.25 0.81 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 119.139 -1.024 . . . . 0.0 110.801 179.859 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.779 ' HE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.51 -23.57 10.78 Favored 'General case' 0 N--CA 1.488 1.458 0 C-N-CA 119.204 -0.998 . . . . 0.0 110.63 179.984 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -53.72 -50.17 55.02 Favored Glycine 0 N--CA 1.49 2.283 0 C-N-CA 119.422 -1.37 . . . . 0.0 110.331 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 56.1 m -93.65 -26.27 17.13 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 119.381 -0.928 . . . . 0.0 110.693 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -86.07 3.66 41.48 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 119.435 -0.906 . . . . 0.0 110.9 179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -57.08 -26.04 59.73 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.703 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 5.6 mt -55.77 -30.34 61.11 Favored 'General case' 0 N--CA 1.488 1.466 0 C-N-CA 119.524 -0.871 . . . . 0.0 111.146 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.24 -51.69 3.07 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 119.775 -0.77 . . . . 0.0 111.306 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . . . . . . . . . . . -39.69 -70.18 0.11 Allowed 'General case' 0 C--N 1.295 -1.8 0 CA-C-N 114.813 -1.085 . . . . 0.0 111.537 -179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.579 ' HB1' ' HD2' ' R' ' 93' ' ' PRO . . . -96.74 163.99 19.06 Favored Pre-proline 0 N--CA 1.489 1.518 0 C-N-CA 119.444 -0.902 . . . . 0.0 110.583 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . 0.579 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 13.8 Cg_exo -49.37 152.55 5.66 Favored 'Trans proline' 0 C--N 1.318 -1.049 0 C-N-CA 121.438 1.425 . . . . 0.0 111.507 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 2.1 t -98.54 10.52 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.42 0 C-N-CA 119.933 -0.707 . . . . 0.0 111.409 -179.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -67.62 -11.69 58.74 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.188 -1.005 . . . . 0.0 111.619 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 1.9 pp -97.37 -32.9 11.63 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.332 -0.947 . . . . 0.0 111.359 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.39 -29.17 3.74 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 119.08 -1.048 . . . . 0.0 110.212 -179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -82.77 -42.03 18.45 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.268 -0.973 . . . . 0.0 109.788 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.632 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 10.0 t90 -62.23 -60.01 4.2 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.602 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.452 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.9 mm? -41.28 -26.5 0.06 Allowed 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.127 -1.029 . . . . 0.0 113.244 179.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.452 ' C ' ' O ' ' R' ' 100' ' ' LEU . 2.1 mm-40 -48.62 -38.9 22.19 Favored 'General case' 0 C--N 1.295 -1.803 0 C-N-CA 117.412 -1.715 . . . . 0.0 106.563 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -88.65 -28.78 20.4 Favored 'General case' 0 C--N 1.303 -1.413 0 CA-C-N 113.26 -1.791 . . . . 0.0 112.276 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.632 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.2 t -91.22 -3.45 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 117.489 -1.684 . . . . 0.0 110.813 -179.825 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . 0.438 ' N ' ' O ' ' R' ' 100' ' ' LEU . 29.3 tp -101.33 -51.79 3.4 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.692 179.803 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . 0.695 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.5 OUTLIER -66.17 -26.57 67.48 Favored 'General case' 0 N--CA 1.486 1.338 0 C-N-CA 118.905 -1.118 . . . . 0.0 110.525 179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 8.6 tttp -81.07 -2.21 47.29 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 119.454 -0.898 . . . . 0.0 110.553 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.304 -1.38 0 CA-C-O 116.319 -1.8 . . . . 0.0 110.644 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 46.7 mt-30 . . . . . 0 N--CA 1.486 1.344 0 CA-C-O 120.864 0.364 . . . . 0.0 110.113 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 4.8 m 46.8 68.9 3.04 Favored Pre-proline 0 N--CA 1.486 1.366 0 C-N-CA 119.405 -0.918 . . . . 0.0 111.285 179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . 0.491 ' O ' ' N ' ' S' ' 8' ' ' SER . 2.3 Cg_endo -65.55 -24.14 56.48 Favored 'Trans proline' 0 C--N 1.314 -1.263 0 C-N-CA 121.587 1.525 . . . . 0.0 111.366 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 15.6 t80 61.37 -75.22 0.03 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.932 -0.707 . . . . 0.0 111.171 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . 0.491 ' N ' ' O ' ' S' ' 6' ' ' PRO . 10.9 t 51.35 91.48 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.857 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . . . . . . . . . . . -171.65 -70.31 0.02 OUTLIER 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.518 -0.873 . . . . 0.0 110.863 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . -156.33 129.91 8.29 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.404 -0.918 . . . . 0.0 110.636 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . 0.446 ' O ' ' HB3' ' S' ' 12' ' ' ALA . 4.1 mmt -85.95 148.77 25.61 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.374 -0.93 . . . . 0.0 111.04 -179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . 0.446 ' HB3' ' O ' ' S' ' 11' ' ' MET . . . 60.39 179.86 0.1 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.534 -0.866 . . . . 0.0 110.802 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -48.95 151.27 1.28 Allowed 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.344 -0.942 . . . . 0.0 110.833 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . 0.429 ' O ' ' O ' ' S' ' 15' ' ' ARG . 38.4 mt-30 -65.1 -45.06 86.77 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.41 -0.916 . . . . 0.0 110.711 -179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . 0.429 ' O ' ' O ' ' S' ' 14' ' ' GLN . 9.7 mtt180 50.7 102.54 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 119.703 -0.799 . . . . 0.0 111.431 -179.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -133.68 -4.28 2.9 Favored 'General case' 0 N--CA 1.491 1.579 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.076 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.403 ' O ' ' C ' ' S' ' 18' ' ' GLU . 5.6 mt-30 -87.78 -84.19 0.2 Allowed 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 119.518 -0.873 . . . . 0.0 109.977 179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.463 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 3.1 mp0 -45.54 -35.26 3.78 Favored 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 118.893 -1.123 . . . . 0.0 108.063 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . . . . . . . . . 61.4 t-105 -44.44 -53.93 6.43 Favored 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 113.564 -1.653 . . . . 0.0 108.685 179.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . 0.416 HD12 ' HA ' ' S' ' 20' ' ' LEU . 7.5 tp -59.78 -46.32 89.54 Favored 'General case' 0 C--N 1.296 -1.743 0 CA-C-N 113.758 -1.565 . . . . 0.0 111.758 179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.474 ' HD3' ' H ' ' S' ' 21' ' ' ARG . 3.4 mpt_? -44.48 -66.17 0.42 Allowed 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.614 -1.234 . . . . 0.0 109.578 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.577 ' CD2' HD21 ' R' ' 51' ' ' LEU . 0.1 OUTLIER -35.59 -51.03 0.63 Allowed 'General case' 0 C--O 1.214 -0.764 0 C-N-CA 119.833 -0.747 . . . . 0.0 109.862 179.527 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.533 ' O ' ' N ' ' S' ' 26' ' ' LEU . 30.7 t -67.76 -68.51 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.815 179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.464 ' C ' ' O ' ' S' ' 23' ' ' VAL . 13.2 t0 -20.86 -54.95 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.007 0 O-C-N 124.248 0.968 . . . . 0.0 113.107 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.794 HD12 ' CE ' ' S' ' 42' ' ' MET . 1.7 mt -74.26 -47.58 34.2 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 118.778 -1.169 . . . . 0.0 109.695 -179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.677 HD21 HD12 ' S' ' 39' ' ' LEU . 0.2 OUTLIER -47.42 -16.73 0.06 Allowed 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 119.409 -0.916 . . . . 0.0 110.974 179.888 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . 0.529 ' O ' ' N ' ' S' ' 29' ' ' ALA . 5.7 tptm -93.95 -73.53 0.57 Allowed 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 119.522 -0.871 . . . . 0.0 111.591 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 26.0 m120 -46.33 -9.65 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.513 0 CA-C-N 115.565 -0.743 . . . . 0.0 112.607 -179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . 0.529 ' N ' ' O ' ' S' ' 27' ' ' LYS . . . -91.72 -42.22 10.26 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.722 -1.191 . . . . 0.0 112.331 -179.9 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . 0.425 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 28.1 t80 -43.78 -29.82 0.58 Allowed 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 118.916 -1.114 . . . . 0.0 110.802 -179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -73.33 -36.09 66.13 Favored 'General case' 0 C--N 1.305 -1.351 0 C-N-CA 119.253 -0.979 . . . . 0.0 110.196 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.451 ' N ' ' O ' ' S' ' 29' ' ' ALA . 29.9 m120 -92.78 -7.17 47.27 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.656 -179.963 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.418 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.7 OUTLIER 76.43 29.58 0.7 Allowed 'General case' 0 N--CA 1.496 1.869 0 CA-C-O 121.388 0.613 . . . . 0.0 110.249 179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . 0.514 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.3 mm? -95.71 -14.25 23.55 Favored 'General case' 0 C--N 1.3 -1.552 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.999 179.976 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . 0.447 ' O ' HD13 ' S' ' 39' ' ' LEU . 36.8 p-80 -45.56 -33.72 2.93 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 113.813 -1.54 . . . . 0.0 113.334 -179.785 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.46 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.9 mt -68.24 -64.58 1.77 Allowed Pre-proline 0 C--N 1.304 -1.378 0 C-N-CA 117.442 -1.703 . . . . 0.0 110.12 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.46 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 3.6 Cg_exo -47.42 -26.83 6.43 Favored 'Trans proline' 0 C--N 1.313 -1.337 0 C-N-CA 120.524 0.816 . . . . 0.0 110.184 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.93 -37.65 34.12 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-N 115.597 -0.729 . . . . 0.0 110.429 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.677 HD12 HD21 ' S' ' 26' ' ' LEU . 0.4 OUTLIER -57.38 -27.29 62.18 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 119.752 -0.779 . . . . 0.0 109.695 179.865 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -88.4 5.91 39.92 Favored 'General case' 0 C--N 1.301 -1.522 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.183 179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . . . . . . . . . 5.1 mp -111.45 -63.05 1.46 Allowed 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 113.276 0.843 . . . . 0.0 113.276 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . 0.794 ' CE ' HD12 ' S' ' 25' ' ' LEU . 0.0 OUTLIER -89.04 34.13 0.79 Allowed 'General case' 0 N--CA 1.498 1.952 0 C-N-CA 118.578 -1.249 . . . . 0.0 112.397 -179.713 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . 0.482 ' CD1' ' O ' ' S' ' 39' ' ' LEU . 0.9 OUTLIER 170.26 141.54 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.373 0 N-CA-C 108.054 -1.091 . . . . 0.0 108.054 179.776 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.665 ' H ' ' CD ' ' S' ' 45' ' ' PRO . 0.3 OUTLIER -176.22 -32.19 0.0 OUTLIER Pre-proline 0 N--CA 1.494 1.773 0 N-CA-C 115.972 1.842 . . . . 0.0 115.972 -179.699 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.665 ' CD ' ' H ' ' S' ' 44' ' ' THR . 24.6 Cg_endo -87.64 -102.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 121.609 1.539 . . . . 0.0 112.529 -179.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . 0.47 ' O ' ' N ' ' S' ' 50' ' ' ALA . 8.7 m-20 -49.74 -34.93 20.46 Favored 'General case' 0 C--N 1.313 -1.017 0 C-N-CA 118.556 -1.258 . . . . 0.0 108.047 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -49.61 -61.63 2.0 Favored 'General case' 0 C--N 1.3 -1.55 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.507 179.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.63 -47.46 14.79 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 119.773 -0.771 . . . . 0.0 111.891 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -83.79 -65.83 0.96 Allowed 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 118.478 -1.289 . . . . 0.0 113.009 -179.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . 0.822 ' HB1' HH11 ' S' ' 54' ' ' ARG . . . -44.57 -46.5 9.98 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 119.417 -0.913 . . . . 0.0 112.62 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . . . . . . . . . 44.3 mt -45.98 -58.04 3.9 Favored 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 118.844 -1.142 . . . . 0.0 110.832 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.63 -54.15 18.28 Favored Glycine 0 N--CA 1.483 1.806 0 C-N-CA 118.84 -1.648 . . . . 0.0 109.691 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.45 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.1 OUTLIER -43.14 -83.32 0.01 OUTLIER 'General case' 0 C--N 1.298 -1.654 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -179.84 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.822 HH11 ' HB1' ' S' ' 50' ' ' ALA . 0.0 OUTLIER -43.76 -63.7 0.8 Allowed 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 113.172 0.804 . . . . 0.0 113.172 -179.569 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . . . . . . . . . 58.8 t -45.13 -29.42 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.968 0 C-N-CA 118.645 -1.222 . . . . 0.0 111.525 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -92.2 -36.9 13.01 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 118.18 -1.408 . . . . 0.0 112.21 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 0.965 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -62.99 -31.35 52.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 C-N-CA 115.419 -2.513 . . . . 0.0 105.064 179.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . 0.965 ' N ' HD13 ' S' ' 57' ' ' ILE . 31.3 t -62.0 -64.84 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 CA-C-N 114.879 -1.055 . . . . 0.0 108.19 179.392 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.0 tt0 -49.8 -33.1 15.58 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 119.671 -0.812 . . . . 0.0 110.746 179.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . 0.455 ' O ' ' N ' ' S' ' 64' ' ' GLY . 3.5 tt0 -70.43 -54.11 13.7 Favored 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 119.559 -0.857 . . . . 0.0 111.719 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' S' ' 61' ' ' LEU . 31.5 mt -53.13 -24.18 9.87 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 118.952 -1.099 . . . . 0.0 110.681 -179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 tp -57.47 -38.89 75.25 Favored 'General case' 0 C--N 1.305 -1.344 0 C-N-CA 118.995 -1.082 . . . . 0.0 110.045 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 3.4 mtp180 -122.42 5.0 9.64 Favored 'General case' 0 N--CA 1.491 1.58 0 CA-C-N 115.51 -0.768 . . . . 0.0 109.972 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' S' ' 60' ' ' GLU . . . -102.5 11.17 56.58 Favored Glycine 0 N--CA 1.488 2.141 0 N-CA-C 109.857 -1.297 . . . . 0.0 109.857 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -43.87 -51.1 7.72 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 119.547 -0.861 . . . . 0.0 110.44 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -83.02 27.47 0.55 Allowed 'General case' 0 N--CA 1.49 1.55 0 CA-C-N 115.486 -0.779 . . . . 0.0 111.069 179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 7.1 t -167.78 70.49 0.09 Allowed 'General case' 0 C--N 1.299 -1.613 0 C-N-CA 118.895 -1.122 . . . . 0.0 110.702 -179.846 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.08 -11.48 8.05 Favored 'General case' 0 C--N 1.301 -1.516 0 CA-C-O 122.077 0.942 . . . . 0.0 109.278 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 1.4 ttt85 -87.05 12.03 12.35 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 113.094 -1.866 . . . . 0.0 113.23 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -112.62 14.26 20.08 Favored 'General case' 0 N--CA 1.504 2.259 0 C-N-CA 119.529 -0.868 . . . . 0.0 113.012 -179.791 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . 0.45 ' O ' ' CB ' ' S' ' 72' ' ' LYS . 1.0 OUTLIER -127.57 96.27 4.49 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 119.888 -0.725 . . . . 0.0 111.025 -179.884 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . 0.45 ' CB ' ' O ' ' S' ' 71' ' ' LEU . 5.2 tttm 165.92 98.29 0.0 OUTLIER 'General case' 0 C--N 1.304 -1.406 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.673 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . 0.408 ' O ' ' CB ' ' S' ' 74' ' ' GLU . 0.2 OUTLIER -113.99 -31.38 6.4 Favored 'General case' 0 N--CA 1.493 1.691 0 CA-C-O 121.541 0.686 . . . . 0.0 109.638 179.974 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . 0.408 ' CB ' ' O ' ' S' ' 73' ' ' ASN . 2.9 pt-20 153.76 -58.79 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.934 0 CA-C-N 113.022 -1.899 . . . . 0.0 112.042 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . 0.499 ' H ' ' HG ' ' S' ' 75' ' ' LEU . 0.3 OUTLIER -108.93 21.48 17.17 Favored 'General case' 0 N--CA 1.498 1.935 0 C-N-CA 119.837 -0.745 . . . . 0.0 109.237 -179.979 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . 0.426 ' O ' ' HB2' ' S' ' 77' ' ' ALA . . . -97.6 -49.19 1.85 Allowed Glycine 0 N--CA 1.492 2.396 0 CA-C-N 114.641 -1.163 . . . . 0.0 110.436 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . 0.426 ' HB2' ' O ' ' S' ' 76' ' ' GLY . . . 175.94 97.63 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.517 0.675 . . . . 0.0 110.352 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . -56.71 159.97 8.59 Favored Glycine 0 N--CA 1.482 1.713 0 CA-C-N 114.634 -1.166 . . . . 0.0 111.809 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.503 ' O ' ' OG1' ' S' ' 83' ' ' THR . 0.6 OUTLIER -49.33 -38.0 11.45 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 CA-C-N 114.399 -0.901 . . . . 0.0 110.266 179.953 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.442 ' N ' HG13 ' S' ' 79' ' ' ILE . . . -38.44 -44.31 0.92 Allowed 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.226 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.477 ' HA ' ' HE1' ' R' ' 109' ' ' TRP . 24.4 m -71.81 -43.75 65.09 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 122.082 0.944 . . . . 0.0 112.211 179.746 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . 0.408 HG13 ' H ' ' S' ' 82' ' ' ILE . 0.0 OUTLIER -81.33 12.31 0.59 Allowed 'Isoleucine or valine' 0 C--N 1.284 -2.26 0 N-CA-C 116.253 1.946 . . . . 0.0 116.253 -179.534 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.503 ' OG1' ' O ' ' S' ' 79' ' ' ILE . 0.0 OUTLIER -126.25 -18.91 4.83 Favored 'General case' 0 N--CA 1.492 1.659 0 C-N-CA 118.934 -1.106 . . . . 0.0 113.508 179.729 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . 0.622 ' CZ ' ' CZ3' ' R' ' 109' ' ' TRP . 0.0 OUTLIER -87.06 -19.99 27.79 Favored 'General case' 0 C--N 1.306 -1.307 0 C-N-CA 118.254 -1.378 . . . . 0.0 109.05 -179.938 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -90.0 -18.75 49.58 Favored Glycine 0 N--CA 1.487 2.099 0 C-N-CA 119.274 -1.441 . . . . 0.0 110.102 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t -84.35 -60.34 2.11 Favored 'General case' 0 N--CA 1.487 1.424 0 C-N-CA 119.473 -0.891 . . . . 0.0 110.913 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -79.49 2.92 20.25 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.625 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . 0.457 ' O ' ' N ' ' S' ' 90' ' ' LYS . 0.2 OUTLIER -55.79 -48.9 74.55 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.768 -179.956 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . . . . . . . . . 1.7 pp -46.88 -14.48 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 119.573 -0.851 . . . . 0.0 112.386 -179.687 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . 0.457 ' N ' ' O ' ' S' ' 88' ' ' SER . 17.7 tptt -49.09 -52.89 23.09 Favored 'General case' 0 N--CA 1.488 1.461 0 C-N-CA 118.419 -1.312 . . . . 0.0 110.64 179.948 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . . . . . . . . . . . -47.49 -38.25 13.5 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-N 114.345 -1.298 . . . . 0.0 111.258 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . . . . . . . . . . . 54.6 60.32 10.44 Favored Pre-proline 0 C--N 1.303 -1.424 0 C-N-CA 119.833 -0.747 . . . . 0.0 111.842 179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo -63.07 97.49 0.19 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 121.239 1.292 . . . . 0.0 110.667 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . 0.448 ' H ' HG23 ' S' ' 94' ' ' VAL . 2.9 t -56.75 -10.42 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 C-N-CA 119.638 -0.825 . . . . 0.0 110.905 -179.913 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -83.48 -24.09 31.92 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.286 -0.966 . . . . 0.0 111.548 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . 0.421 ' O ' ' N ' ' S' ' 99' ' ' TRP . 3.7 mp -84.29 -51.31 7.1 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 119.211 -0.996 . . . . 0.0 111.181 -179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.52 -32.82 3.6 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.95 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -82.13 -24.26 35.19 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 119.387 -0.925 . . . . 0.0 110.584 179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.669 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 4.7 t90 -95.09 -63.54 1.16 Allowed 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 115.412 -0.813 . . . . 0.0 112.256 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.511 ' O ' ' C ' ' S' ' 101' ' ' GLU . 2.0 mm? -35.58 -39.57 0.14 Allowed 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.511 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.0 mt-10 -40.72 -41.47 1.54 Allowed 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 118.155 -1.418 . . . . 0.0 107.571 179.864 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -86.9 -28.09 23.0 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 113.756 -1.565 . . . . 0.0 112.652 179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.669 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 3.3 t -84.03 -15.36 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 C-N-CA 116.615 -2.034 . . . . 0.0 111.888 -179.856 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . . . . . . . . . 4.9 mt -99.8 -61.94 1.3 Allowed 'General case' 0 C--N 1.308 -1.236 0 C-N-CA 119.826 -0.75 . . . . 0.0 111.913 179.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . 0.477 ' O ' ' N ' ' S' ' 107' ' ' SER . 4.5 mm? -63.86 -75.21 0.08 Allowed 'General case' 0 N--CA 1.495 1.787 0 C-N-CA 118.705 -1.198 . . . . 0.0 111.231 -179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 26.1 tttm -42.17 -23.44 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 119.731 -0.787 . . . . 0.0 110.841 -179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . 0.477 ' N ' ' O ' ' S' ' 105' ' ' LEU . 19.6 p . . . . . 0 C--N 1.304 -1.371 0 CA-C-O 116.253 -1.832 . . . . 0.0 110.83 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.47 ' CZ3' ' HB2' ' R' ' 54' ' ' ARG . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.378 0 CA-C-O 116.426 -1.75 . . . . 0.0 109.918 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.622 ' CZ3' ' CZ ' ' S' ' 84' ' ' ARG . 1.5 p90 . . . . . 0 N--CA 1.484 1.244 0 CA-C-O 117.224 -1.37 . . . . 0.0 108.821 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 . . . . . 0 N--CA 1.486 1.356 0 N-CA-C 109.99 -0.374 . . . . 0.0 109.99 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . 0.43 ' N ' ' HD2' ' R' ' 6' ' ' PRO . 0.5 OUTLIER -85.79 -52.97 0.45 Allowed Pre-proline 0 N--CA 1.486 1.349 0 C-N-CA 119.248 -0.981 . . . . 0.0 112.532 179.918 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . 0.43 ' HD2' ' N ' ' R' ' 5' ' ' SER . 2.5 Cg_endo -61.25 161.2 23.98 Favored 'Trans proline' 0 C--O 1.213 -0.752 0 C-N-CA 120.721 0.947 . . . . 0.0 111.575 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . 0.402 ' CD1' ' N ' ' R' ' 7' ' ' TYR . 0.0 OUTLIER -128.3 143.95 51.07 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 119.855 -0.738 . . . . 0.0 111.033 -179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . . . . . . . . . 5.6 t -167.86 128.71 1.41 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.137 -1.025 . . . . 0.0 111.394 179.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . . . . . . . . . . . -84.06 -43.8 14.73 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.472 -0.891 . . . . 0.0 110.734 179.964 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . . . . . . . . . . . 50.49 57.08 7.0 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.635 -0.826 . . . . 0.0 110.88 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . 0.432 ' O ' ' O ' ' R' ' 12' ' ' ALA . 22.8 mmm -76.64 65.44 2.43 Favored 'General case' 0 C--N 1.305 -1.339 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.453 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . 0.432 ' O ' ' O ' ' R' ' 11' ' ' MET . . . 44.27 -170.01 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.605 -0.838 . . . . 0.0 111.225 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -164.0 -40.95 0.03 OUTLIER 'General case' 0 C--N 1.304 -1.413 0 C-N-CA 119.603 -0.839 . . . . 0.0 110.11 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . 0.405 ' H ' ' HG2' ' R' ' 14' ' ' GLN . 4.4 pt20 -101.45 119.49 38.85 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 115.374 -0.83 . . . . 0.0 110.299 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -166.01 -30.51 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 119.456 -0.897 . . . . 0.0 110.136 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -80.37 7.56 9.41 Favored 'General case' 0 N--CA 1.489 1.475 0 CA-C-N 115.633 -0.712 . . . . 0.0 109.798 179.834 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.421 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.1 mp0 -84.97 -75.6 0.35 Allowed 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 119.808 -0.757 . . . . 0.0 110.285 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . 0.426 ' CD ' ' H ' ' R' ' 18' ' ' GLU . 1.5 mp0 -46.16 -30.7 2.05 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 122.804 1.288 . . . . 0.0 108.466 179.806 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . 0.421 ' N ' ' C ' ' R' ' 17' ' ' GLN . 67.2 t-105 -55.61 -58.51 7.48 Favored 'General case' 0 C--N 1.294 -1.821 0 CA-C-N 112.645 -2.07 . . . . 0.0 110.229 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 5.9 tp -50.06 -23.6 2.18 Favored 'General case' 0 C--N 1.295 -1.765 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.521 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.541 ' O ' ' C ' ' R' ' 22' ' ' PHE . 20.8 mmt85 -71.68 -69.7 0.37 Allowed 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 118.908 -1.117 . . . . 0.0 109.813 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.541 ' C ' ' O ' ' R' ' 21' ' ' ARG . 0.0 OUTLIER -32.41 -37.39 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.605 0 C-N-CA 119.26 -0.976 . . . . 0.0 110.19 179.545 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . 0.509 ' N ' ' O ' ' R' ' 21' ' ' ARG . 2.9 t -74.24 -50.48 27.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 CA-C-N 115.1 -0.955 . . . . 0.0 109.413 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.52 ' N ' ' O ' ' R' ' 21' ' ' ARG . 38.5 t70 -41.17 -72.87 0.05 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-N 115.167 -0.924 . . . . 0.0 110.567 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.445 HD23 ' N ' ' R' ' 25' ' ' LEU . 0.2 OUTLIER -47.5 -44.85 25.81 Favored 'General case' 0 C--N 1.3 -1.586 0 C-N-CA 119.579 -0.848 . . . . 0.0 111.13 -179.995 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -48.88 -56.91 7.4 Favored 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 119.108 -1.037 . . . . 0.0 112.149 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . . . . . . . . . 5.6 ttpt -62.54 -35.9 80.92 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -179.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 28.6 m-20 -81.24 -7.58 59.59 Favored 'General case' 0 N--CA 1.492 1.642 0 C-N-CA 118.886 -1.126 . . . . 0.0 112.537 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.547 ' O ' ' N ' ' R' ' 31' ' ' GLN . . . -99.94 -57.98 2.02 Favored 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 119.105 -1.038 . . . . 0.0 112.83 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . 0.419 ' C ' ' O ' ' R' ' 29' ' ' ALA . 0.2 OUTLIER -34.53 -27.67 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.794 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.859 -179.771 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' R' ' 29' ' ' ALA . 1.2 tt0 -54.84 -44.54 74.03 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.801 179.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -103.43 -76.48 0.59 Allowed 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 119.95 -0.7 . . . . 0.0 111.965 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . 0.738 ' H ' HD22 ' R' ' 34' ' ' LEU . 0.8 OUTLIER 178.8 27.25 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.071 0 C-N-CA 118.966 -1.094 . . . . 0.0 112.06 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . 0.865 ' N ' HD22 ' R' ' 34' ' ' LEU . 1.0 OUTLIER -99.61 -11.59 20.82 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 119.249 -0.981 . . . . 0.0 110.869 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . . . . . . . . . 47.0 p-80 -59.25 -24.34 63.13 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.829 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.442 HD23 ' HA ' ' R' ' 36' ' ' LEU . 8.1 mt -76.13 -59.56 1.09 Allowed Pre-proline 0 C--N 1.303 -1.436 0 C-N-CA 118.018 -1.473 . . . . 0.0 110.81 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.424 ' HD2' ' N ' ' R' ' 36' ' ' LEU . 3.5 Cg_exo -54.88 -36.29 91.2 Favored 'Trans proline' 0 C--N 1.318 -1.068 0 N-CA-C 109.404 -1.037 . . . . 0.0 109.404 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . . . . . . . . . 12.4 mt -63.77 -43.84 95.21 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-N 115.395 -0.82 . . . . 0.0 109.619 179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' R' ' 39' ' ' LEU . 0.5 OUTLIER -52.55 -34.25 49.37 Favored 'General case' 0 C--O 1.203 -1.344 0 N-CA-C 108.598 -0.89 . . . . 0.0 108.598 179.628 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -74.12 5.75 4.09 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 119.316 -0.953 . . . . 0.0 111.542 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.01 -56.64 2.39 Favored 'General case' 0 N--CA 1.498 1.969 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -79.46 12.33 2.53 Favored 'General case' 0 N--CA 1.501 2.098 0 C-N-CA 117.429 -1.709 . . . . 0.0 112.841 -179.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . 0.417 ' HG ' ' O ' ' R' ' 39' ' ' LEU . 2.2 pp 179.95 146.58 0.24 Allowed 'General case' 0 N--CA 1.505 2.281 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.601 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -175.44 -38.07 0.0 OUTLIER Pre-proline 0 N--CA 1.497 1.877 0 C-N-CA 116.075 -2.25 . . . . 0.0 116.14 -179.693 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.601 ' HD2' ' H ' ' R' ' 44' ' ' THR . 41.4 Cg_endo -87.26 -109.43 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.362 0 C-N-CA 121.444 1.429 . . . . 0.0 113.183 -179.527 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . 0.43 ' H ' ' HB2' ' R' ' 45' ' ' PRO . 3.7 p-10 -54.48 -32.75 58.43 Favored 'General case' 0 C--N 1.309 -1.168 0 C-N-CA 119.721 -0.791 . . . . 0.0 110.275 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.486 ' OE2' ' OXT' ' R' ' 109' ' ' TRP . 30.6 mt-10 -54.6 -64.6 0.78 Allowed 'General case' 0 C--N 1.298 -1.64 0 C-N-CA 119.081 -1.047 . . . . 0.0 110.49 179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -47.19 -38.32 11.75 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.171 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -66.52 -68.02 0.4 Allowed 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 118.351 -1.34 . . . . 0.0 111.938 -179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.499 ' O ' ' C ' ' R' ' 51' ' ' LEU . . . -65.84 -52.54 49.61 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.109 -1.036 . . . . 0.0 112.205 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . 0.499 ' C ' ' O ' ' R' ' 50' ' ' ALA . 3.2 tt -33.77 -48.89 0.3 Allowed 'General case' 0 N--CA 1.497 1.901 0 C-N-CA 119.526 -0.87 . . . . 0.0 110.357 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . 0.449 ' O ' ' C ' ' R' ' 53' ' ' THR . . . -64.85 -69.37 1.35 Allowed Glycine 0 N--CA 1.482 1.753 0 C-N-CA 119.564 -1.303 . . . . 0.0 110.104 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.449 ' C ' ' O ' ' R' ' 52' ' ' GLY . 0.1 OUTLIER -34.02 -69.14 0.1 Allowed 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 122.319 1.057 . . . . 0.0 110.748 179.764 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.525 ' H ' ' CD ' ' R' ' 54' ' ' ARG . 0.1 OUTLIER -35.18 -63.82 0.31 Allowed 'General case' 0 C--N 1.286 -2.156 0 CA-C-N 112.721 -2.036 . . . . 0.0 113.908 179.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 12.0 p -60.52 -19.24 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 C-N-CA 116.739 -1.984 . . . . 0.0 111.947 -179.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.608 HH22 ' CZ ' ' R' ' 69' ' ' ARG . 0.0 OUTLIER -83.62 -38.07 22.06 Favored 'General case' 0 C--N 1.302 -1.478 0 C-N-CA 119.38 -0.928 . . . . 0.0 112.422 -179.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 1.029 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -81.83 -34.58 12.83 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.333 0 C-N-CA 117.488 -1.685 . . . . 0.0 109.872 -179.639 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 1.029 ' N ' HD13 ' R' ' 57' ' ' ILE . 4.8 p -69.31 -39.92 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 C-N-CA 118.045 -1.462 . . . . 0.0 111.37 179.76 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.482 ' N ' HG13 ' R' ' 58' ' ' VAL . 3.3 pt-20 -72.2 -30.57 65.07 Favored 'General case' 0 N--CA 1.49 1.55 0 C-N-CA 118.383 -1.327 . . . . 0.0 110.584 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 8.4 tt0 -74.63 -47.47 31.91 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 119.534 -0.866 . . . . 0.0 111.609 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . . . . . . . . . 88.5 mt -66.53 -26.71 67.27 Favored 'General case' 0 N--CA 1.491 1.575 0 C-N-CA 118.887 -1.125 . . . . 0.0 111.015 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . 0.462 HD23 ' O ' ' R' ' 62' ' ' LEU . 0.8 OUTLIER -50.35 -30.4 12.09 Favored 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 118.918 -1.113 . . . . 0.0 109.537 179.822 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -124.69 -2.09 7.89 Favored 'General case' 0 N--CA 1.49 1.527 0 CA-C-N 115.014 -0.993 . . . . 0.0 109.971 179.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . 0.403 ' O ' ' C ' ' R' ' 65' ' ' GLU . . . -113.7 21.15 16.93 Favored Glycine 0 N--CA 1.489 2.233 0 N-CA-C 109.133 -1.587 . . . . 0.0 109.133 -179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.556 ' O ' ' C ' ' R' ' 66' ' ' MET . 76.5 mt-10 -35.95 -50.6 0.68 Allowed 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 120.408 -0.517 . . . . 0.0 111.295 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . 0.556 ' C ' ' O ' ' R' ' 65' ' ' GLU . 34.6 ttm 6.45 -110.21 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 O-C-N 124.854 1.346 . . . . 0.0 112.377 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 38.4 t -175.67 73.22 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.582 0 C-N-CA 119.133 -1.027 . . . . 0.0 110.73 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -126.56 -42.46 1.8 Allowed 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.343 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . 0.608 ' CZ ' HH22 ' R' ' 56' ' ' ARG . 0.7 OUTLIER -92.38 26.93 2.4 Favored 'General case' 0 C--N 1.306 -1.323 0 C-N-CA 120.314 -0.554 . . . . 0.0 111.319 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -92.02 19.0 7.17 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.462 -0.79 . . . . 0.0 111.639 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 11.8 mt -115.3 133.84 55.67 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 119.765 -0.774 . . . . 0.0 111.256 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.07 91.37 4.52 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.866 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . 0.538 ' O ' ' N ' ' R' ' 75' ' ' LEU . 47.7 t-20 -87.41 11.72 13.88 Favored 'General case' 0 C--N 1.305 -1.347 0 C-N-CA 118.541 -1.264 . . . . 0.0 109.945 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 58.89 -67.75 0.03 OUTLIER 'General case' 0 C--N 1.286 -2.176 0 CA-C-N 113.248 -1.796 . . . . 0.0 111.037 -179.898 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.538 ' N ' ' O ' ' R' ' 73' ' ' ASN . 0.4 OUTLIER -63.03 -31.75 72.95 Favored 'General case' 0 C--N 1.297 -1.675 0 C-N-CA 119.456 -0.898 . . . . 0.0 110.202 179.887 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -53.07 -57.57 14.43 Favored Glycine 0 N--CA 1.489 2.209 0 C-N-CA 119.494 -1.336 . . . . 0.0 110.266 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -153.26 -74.13 0.13 Allowed 'General case' 0 C--N 1.305 -1.362 0 C-N-CA 119.496 -0.882 . . . . 0.0 110.725 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . 0.409 ' O ' ' N ' ' R' ' 80' ' ' ALA . . . 156.29 122.99 0.77 Allowed Glycine 0 N--CA 1.491 2.357 0 C-N-CA 119.355 -1.402 . . . . 0.0 110.647 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.919 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.1 OUTLIER -37.14 -32.45 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.31 -1.126 0 C-N-CA 120.743 -0.383 . . . . 0.0 111.622 -179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.446 ' O ' ' OG1' ' R' ' 83' ' ' THR . . . -65.66 -56.02 14.39 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 118.61 -1.236 . . . . 0.0 109.962 179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . . . . . . . . . 19.7 m -42.89 -50.2 5.79 Favored 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 113.391 0.886 . . . . 0.0 113.391 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . 0.439 HD13 HG21 ' R' ' 82' ' ' ILE . 12.1 pt -71.0 -28.72 34.26 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 C-N-CA 119.0 -1.08 . . . . 0.0 113.02 -179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' R' ' 79' ' ' ILE . 0.0 OUTLIER -61.02 -73.15 0.1 Allowed 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 118.648 -1.221 . . . . 0.0 110.922 -179.937 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -11.37 1.4 Allowed 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.151 -1.019 . . . . 0.0 110.102 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . 0.405 ' N ' ' C ' ' R' ' 83' ' ' THR . . . -69.73 -28.76 71.7 Favored Glycine 0 N--CA 1.486 1.999 0 C-N-CA 119.775 -1.203 . . . . 0.0 110.99 -179.936 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 40.2 t -150.32 57.24 0.95 Allowed 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 118.603 -1.239 . . . . 0.0 112.197 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . 0.464 ' O ' ' CB ' ' R' ' 88' ' ' SER . 32.1 t-20 -94.36 -13.22 26.58 Favored 'General case' 0 N--CA 1.487 1.375 0 C-N-CA 119.144 -1.022 . . . . 0.0 110.584 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . 0.464 ' CB ' ' O ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER 75.1 -45.36 0.56 Allowed 'General case' 0 N--CA 1.492 1.663 0 C-N-CA 120.092 -0.643 . . . . 0.0 111.088 179.994 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . . . . . . . . . 8.5 mp -67.73 -25.93 65.89 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 119.55 -0.86 . . . . 0.0 111.302 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . 0.574 ' C ' ' H ' ' R' ' 92' ' ' ALA . 0.0 OUTLIER -48.9 -37.65 20.37 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 118.526 -1.27 . . . . 0.0 110.797 179.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . 0.443 ' O ' ' C ' ' R' ' 92' ' ' ALA . . . -61.03 11.54 0.02 OUTLIER 'General case' 0 C--N 1.291 -1.962 0 CA-C-N 114.742 -1.117 . . . . 0.0 112.032 -179.787 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.704 ' HB3' ' HD3' ' R' ' 93' ' ' PRO . . . -31.34 -59.65 0.32 Allowed Pre-proline 0 N--CA 1.493 1.698 0 N-CA-C 112.625 0.602 . . . . 0.0 112.625 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . 0.704 ' HD3' ' HB3' ' R' ' 92' ' ' ALA . 5.2 Cg_exo -51.31 95.28 0.03 OUTLIER 'Trans proline' 0 C--N 1.324 -0.763 0 C-N-CA 120.506 0.804 . . . . 0.0 110.725 179.848 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . . . . . . . . . 84.8 t -58.13 -16.95 7.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 C-N-CA 119.575 -0.85 . . . . 0.0 111.588 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -67.82 -28.62 67.73 Favored 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 119.362 -0.935 . . . . 0.0 111.274 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . . . . . . . . . 4.3 mt -61.88 -41.05 97.4 Favored 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 119.569 -0.852 . . . . 0.0 111.481 -179.92 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -55.86 -37.81 69.28 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 119.566 -0.853 . . . . 0.0 111.645 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 12.7 mm-40 -63.55 -29.37 70.64 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 119.76 -0.776 . . . . 0.0 112.6 -179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.436 ' CE3' HG21 ' R' ' 103' ' ' VAL . 3.0 t90 -99.2 -67.49 0.85 Allowed 'General case' 0 C--N 1.303 -1.445 0 C-N-CA 119.621 -0.832 . . . . 0.0 112.362 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.704 ' CD1' HD13 ' R' ' 104' ' ' LEU . 1.3 mm? -38.6 -55.46 1.43 Allowed 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 116.12 1.896 . . . . 0.0 116.12 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.545 ' C ' ' O ' ' R' ' 100' ' ' LEU . 12.7 pt-20 -33.24 -33.11 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.835 0 C-N-CA 118.85 -1.14 . . . . 0.0 109.51 179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.578 ' N ' ' O ' ' R' ' 100' ' ' LEU . 1.8 tm-20 -92.54 -32.41 14.85 Favored 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 114.451 -1.25 . . . . 0.0 111.802 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.577 ' N ' ' O ' ' R' ' 100' ' ' LEU . 9.8 t -80.81 -15.1 12.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.2 0 C-N-CA 116.959 -1.896 . . . . 0.0 110.883 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . 0.704 HD13 ' CD1' ' R' ' 100' ' ' LEU . 1.8 tp -102.14 -55.25 2.52 Favored 'General case' 0 C--N 1.305 -1.329 0 CA-C-N 115.674 -0.693 . . . . 0.0 111.937 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . . . . . . . . . 1.6 tp -52.16 -66.65 0.35 Allowed 'General case' 0 C--N 1.307 -1.247 0 C-N-CA 119.786 -0.766 . . . . 0.0 111.983 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 26.2 tttt -58.55 -73.03 0.08 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 118.988 -1.085 . . . . 0.0 111.503 -179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.305 -1.349 0 CA-C-O 116.282 -1.818 . . . . 0.0 111.035 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 46.5 t -156.75 77.87 4.06 Favored Pre-proline 0 N--CA 1.487 1.383 0 C-N-CA 119.836 -0.746 . . . . 0.0 110.847 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -62.11 163.87 18.61 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 121.587 1.525 . . . . 0.0 112.185 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -101.38 158.62 15.93 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 119.926 -0.71 . . . . 0.0 110.773 179.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 54.5 m -92.03 -165.35 1.33 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 119.334 -0.946 . . . . 0.0 110.461 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' S' ' 10' ' ' ALA . . . -81.4 90.78 6.2 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 119.123 -1.031 . . . . 0.0 110.344 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . 0.404 ' O ' ' O ' ' S' ' 9' ' ' ALA . . . 57.46 161.09 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.933 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . . . . . . . . . 4.7 ttp -136.81 -30.07 0.9 Allowed 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 120.049 -0.66 . . . . 0.0 109.786 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -171.12 127.99 0.71 Allowed 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.143 -0.935 . . . . 0.0 109.972 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . 0.667 ' H ' ' CD ' ' S' ' 13' ' ' GLU . 0.0 OUTLIER -90.11 143.1 27.07 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 119.177 -1.009 . . . . 0.0 110.892 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -63.97 119.26 9.75 Favored 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.233 -0.987 . . . . 0.0 110.103 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' S' ' 15' ' ' ARG . 0.1 OUTLIER -78.67 63.06 3.36 Favored 'General case' 0 C--N 1.302 -1.486 0 C-N-CA 118.813 -1.155 . . . . 0.0 111.221 -179.913 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . . . . . . . . . 2.2 m170 -84.92 10.86 10.58 Favored 'General case' 0 C--N 1.305 -1.33 0 CA-C-N 115.405 -0.816 . . . . 0.0 109.588 179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.417 ' C ' ' N ' ' S' ' 19' ' ' TRP . 20.8 mt-30 -76.99 -92.11 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 119.842 -0.743 . . . . 0.0 111.047 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.581 ' CD ' ' H ' ' S' ' 18' ' ' GLU . 0.4 OUTLIER -44.25 -27.45 0.42 Allowed 'General case' 0 N--CA 1.488 1.449 0 CA-C-O 122.164 0.983 . . . . 0.0 109.54 179.886 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . 0.417 ' N ' ' C ' ' S' ' 17' ' ' GLN . 32.8 t-105 -53.6 -48.64 69.07 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 114.451 -1.25 . . . . 0.0 108.627 179.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . 0.416 ' N ' ' O ' ' S' ' 17' ' ' GLN . 1.2 tt -59.84 -36.1 76.14 Favored 'General case' 0 C--N 1.299 -1.602 0 CA-C-N 113.253 -1.794 . . . . 0.0 111.016 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.547 ' O ' ' C ' ' S' ' 22' ' ' PHE . 1.4 mpt_? -58.17 -73.02 0.08 Allowed 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 118.718 -1.193 . . . . 0.0 109.28 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.556 ' C ' ' CD1' ' S' ' 22' ' ' PHE . 0.0 OUTLIER -25.6 -50.67 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 120.215 -0.594 . . . . 0.0 110.78 179.619 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.402 ' N ' ' O ' ' S' ' 21' ' ' ARG . 30.6 t -68.89 -63.05 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.735 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.745 -179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.401 ' OD1' ' C ' ' S' ' 24' ' ' ASP . 21.7 t0 -35.55 -60.65 0.5 Allowed 'General case' 0 N--CA 1.488 1.469 0 CA-C-N 115.46 -0.791 . . . . 0.0 112.838 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.49 HD23 ' N ' ' S' ' 25' ' ' LEU . 2.7 mt -57.24 -57.09 14.16 Favored 'General case' 0 C--N 1.302 -1.498 0 C-N-CA 118.963 -1.095 . . . . 0.0 111.161 179.988 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.456 HD11 HD11 ' S' ' 39' ' ' LEU . 0.6 OUTLIER -42.37 -25.05 0.07 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.243 -0.983 . . . . 0.0 112.243 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . 0.406 ' N ' ' O ' ' S' ' 25' ' ' LEU . 3.3 mtpm? -82.45 -39.28 22.77 Favored 'General case' 0 N--CA 1.493 1.696 0 C-N-CA 118.716 -1.194 . . . . 0.0 113.005 -179.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -83.23 -20.7 34.08 Favored 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 119.074 -1.05 . . . . 0.0 112.42 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . 0.606 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -82.95 -32.78 26.95 Favored 'General case' 0 C--N 1.302 -1.493 0 C-N-CA 119.177 -1.009 . . . . 0.0 111.703 -179.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . 0.498 ' O ' ' CD1' ' S' ' 30' ' ' TYR . 0.0 OUTLIER -56.59 -32.53 65.33 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 119.093 -1.043 . . . . 0.0 111.004 -179.959 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -47.67 77.58 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.716 -0.794 . . . . 0.0 110.878 -179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.57 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 1.8 m120 -84.09 -41.96 16.6 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 119.947 -0.701 . . . . 0.0 111.781 -179.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.57 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 22.1 t70 116.56 49.35 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.713 0 O-C-N 125.059 1.474 . . . . 0.0 109.393 -179.956 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . 0.606 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.4 mm? -112.55 -14.0 13.26 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.926 -1.034 . . . . 0.0 109.996 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . 0.454 ' O ' HD13 ' S' ' 39' ' ' LEU . 15.6 p-80 -52.22 -13.39 0.33 Allowed 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.528 -1.215 . . . . 0.0 112.89 -179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.481 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.5 mt -80.87 -66.19 0.25 Allowed Pre-proline 0 N--CA 1.486 1.34 0 C-N-CA 118.217 -1.393 . . . . 0.0 110.093 179.932 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.481 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 4.0 Cg_exo -49.55 -29.04 17.82 Favored 'Trans proline' 0 C--N 1.322 -0.862 0 N-CA-C 109.961 -0.823 . . . . 0.0 109.961 179.649 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . 0.558 ' O ' ' SD ' ' S' ' 42' ' ' MET . 5.2 mp -71.25 -51.49 24.28 Favored 'General case' 0 N--CA 1.49 1.543 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.469 179.857 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.456 HD11 HD11 ' S' ' 26' ' ' LEU . 0.4 OUTLIER -44.57 -41.6 6.65 Favored 'General case' 0 N--CA 1.49 1.549 0 CA-C-N 115.52 -0.764 . . . . 0.0 110.678 179.869 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -59.2 -18.08 33.44 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 119.275 -0.97 . . . . 0.0 111.921 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . 0.475 ' O ' ' O ' ' R' ' 1' ' ' TRP . 16.5 mt -94.25 -62.03 1.41 Allowed 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 119.527 -0.869 . . . . 0.0 112.918 179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . 0.558 ' SD ' ' O ' ' S' ' 38' ' ' LEU . 0.2 OUTLIER -81.46 10.55 5.6 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 117.927 -1.509 . . . . 0.0 111.781 -179.881 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -154.53 126.7 7.8 Favored 'General case' 0 N--CA 1.509 2.505 0 CA-C-O 118.947 -0.549 . . . . 0.0 109.536 -179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.465 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.6 OUTLIER -166.53 -42.53 0.0 OUTLIER Pre-proline 0 N--CA 1.499 2.018 0 C-N-CA 116.456 -2.098 . . . . 0.0 116.506 -179.928 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' S' ' 44' ' ' THR . 43.7 Cg_endo -89.97 -105.77 0.0 OUTLIER 'Trans proline' 0 C--N 1.312 -1.346 0 C-N-CA 120.771 0.98 . . . . 0.0 114.577 -179.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . 0.408 ' H ' ' HB2' ' S' ' 45' ' ' PRO . 0.2 OUTLIER -57.33 -22.79 44.56 Favored 'General case' 0 C--N 1.309 -1.158 0 C-N-CA 119.686 -0.806 . . . . 0.0 109.94 -179.732 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . 0.475 ' OE2' HD12 ' R' ' 51' ' ' LEU . 5.0 mm-40 -56.97 -61.3 2.54 Favored 'General case' 0 C--N 1.296 -1.741 0 C-N-CA 118.534 -1.266 . . . . 0.0 109.315 179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 4.8 mmt85 -55.2 -33.07 62.73 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 119.957 -0.697 . . . . 0.0 111.936 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -82.67 -66.67 0.86 Allowed 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 118.405 -1.318 . . . . 0.0 114.365 -179.72 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' S' ' 53' ' ' THR . . . -50.49 -41.15 52.97 Favored 'General case' 0 N--CA 1.502 2.149 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -179.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . 0.768 HD12 ' N ' ' S' ' 52' ' ' GLY . 3.7 pp -64.52 -42.25 95.9 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 117.456 -1.697 . . . . 0.0 111.333 -179.815 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . 0.768 ' N ' HD12 ' S' ' 51' ' ' LEU . . . -55.45 -44.53 85.3 Favored Glycine 0 N--CA 1.492 2.4 0 N-CA-C 107.632 -2.187 . . . . 0.0 107.632 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' S' ' 50' ' ' ALA . 0.2 OUTLIER -46.71 -75.46 0.03 OUTLIER 'General case' 0 C--N 1.298 -1.645 0 CA-C-N 113.921 -1.139 . . . . 0.0 113.096 179.852 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.681 ' HA ' HG23 ' S' ' 57' ' ' ILE . 3.9 ppt_? -48.39 -37.48 17.03 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 119.17 -1.012 . . . . 0.0 113.442 -179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . 0.428 HG22 ' NH2' ' S' ' 54' ' ' ARG . 35.2 t -57.6 -28.69 32.46 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.864 0 C-N-CA 117.841 -1.544 . . . . 0.0 109.192 179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . . . . . . . . . 30.5 mtp85 -83.15 -33.23 26.3 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.942 -1.103 . . . . 0.0 111.916 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 1.017 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -82.57 -29.58 8.89 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.105 0 C-N-CA 117.489 -1.684 . . . . 0.0 108.041 -179.956 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . 1.017 ' N ' HD13 ' S' ' 57' ' ' ILE . 10.2 t -63.28 -48.99 84.86 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.375 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 179.611 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 20.6 mm-40 -60.81 -43.04 98.72 Favored 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 119.412 -0.915 . . . . 0.0 109.91 179.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -60.35 -45.76 92.32 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-N 115.438 -0.801 . . . . 0.0 113.021 -179.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . . . . . . . . . 97.7 mt -74.72 -31.83 61.96 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 119.15 -1.02 . . . . 0.0 113.131 -179.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . . . . . . . . . 12.8 tp -77.05 -43.08 35.84 Favored 'General case' 0 N--CA 1.491 1.58 0 C-N-CA 118.419 -1.313 . . . . 0.0 112.272 -179.832 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -72.35 -39.84 67.8 Favored 'General case' 0 N--CA 1.492 1.633 0 C-N-CA 119.21 -0.996 . . . . 0.0 111.297 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.606 ' C ' ' H ' ' S' ' 66' ' ' MET . . . -69.44 -23.03 76.64 Favored Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.483 -1.341 . . . . 0.0 111.106 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 59.35 -23.95 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 112.654 0.613 . . . . 0.0 112.654 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . 0.606 ' H ' ' C ' ' S' ' 64' ' ' GLY . 8.6 mtp -79.89 168.45 19.23 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 120.061 -0.656 . . . . 0.0 110.752 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . . . . . . . . . 1.7 t -162.26 69.21 0.27 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.216 -0.994 . . . . 0.0 110.759 -179.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.426 ' C ' ' H ' ' S' ' 70' ' ' GLU . 0.0 OUTLIER -116.88 -24.8 7.5 Favored 'General case' 0 N--CA 1.486 1.344 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.919 -179.86 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . 0.528 ' C ' ' H ' ' S' ' 71' ' ' LEU . 0.2 OUTLIER -78.81 28.45 0.21 Allowed 'General case' 0 C--N 1.303 -1.44 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.307 179.981 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.447 ' C ' HD12 ' S' ' 71' ' ' LEU . 88.2 mt-10 -67.49 24.93 0.02 OUTLIER 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 115.432 -0.803 . . . . 0.0 112.233 -179.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . 0.528 ' H ' ' C ' ' S' ' 69' ' ' ARG . 6.7 mp -120.07 133.62 55.48 Favored 'General case' 0 N--CA 1.493 1.704 0 C-N-CA 119.865 -0.734 . . . . 0.0 110.42 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . 0.627 ' H ' ' CD ' ' S' ' 72' ' ' LYS . 0.0 OUTLIER -51.11 96.3 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 112.743 0.646 . . . . 0.0 112.743 -179.822 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . 0.661 ' O ' ' N ' ' S' ' 75' ' ' LEU . 0.7 OUTLIER -90.5 26.2 2.05 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-O 122.097 0.951 . . . . 0.0 108.671 179.832 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . 0.56 ' O ' ' N ' ' S' ' 76' ' ' GLY . 1.0 OUTLIER 39.6 -71.22 0.0 OUTLIER 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 112.586 -2.097 . . . . 0.0 112.722 -179.945 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . 0.661 ' N ' ' O ' ' S' ' 73' ' ' ASN . 0.8 OUTLIER -40.78 -21.3 0.01 OUTLIER 'General case' 0 C--N 1.297 -1.7 0 C-N-CA 119.961 -0.696 . . . . 0.0 110.789 -179.981 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . 0.56 ' N ' ' O ' ' S' ' 74' ' ' GLU . . . -84.01 -65.44 1.54 Allowed Glycine 0 N--CA 1.487 2.081 0 C-N-CA 119.678 -1.249 . . . . 0.0 110.348 179.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -160.03 -103.11 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.342 0 C-N-CA 119.327 -0.949 . . . . 0.0 110.897 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . 0.405 ' O ' ' C ' ' S' ' 79' ' ' ILE . . . -164.49 146.49 11.43 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.062 -1.215 . . . . 0.0 110.062 179.938 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.844 ' O ' HD12 ' S' ' 79' ' ' ILE . 0.0 OUTLIER -37.43 -39.09 0.19 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.226 0 C-N-CA 120.682 -0.407 . . . . 0.0 111.886 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.426 ' O ' ' OG1' ' S' ' 83' ' ' THR . . . -53.9 -84.33 0.01 OUTLIER 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 113.44 0.904 . . . . 0.0 113.44 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.447 ' HA ' ' HE1' ' R' ' 109' ' ' TRP . 1.0 OUTLIER -45.11 -19.77 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 115.446 1.647 . . . . 0.0 115.446 -179.625 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . 0.432 HD13 HG21 ' S' ' 82' ' ' ILE . 4.1 pt -102.12 6.34 10.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 C-N-CA 118.38 -1.328 . . . . 0.0 113.523 -179.791 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . 0.426 ' OG1' ' O ' ' S' ' 80' ' ' ALA . 0.0 OUTLIER -99.68 -13.41 19.35 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.778 -1.169 . . . . 0.0 112.302 -179.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . 0.439 ' NE ' ' CH2' ' R' ' 109' ' ' TRP . 0.0 OUTLIER -101.56 -36.09 8.9 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 119.108 -1.037 . . . . 0.0 109.704 -179.986 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . . . . . . . . . . . -74.44 -5.11 71.69 Favored Glycine 0 N--CA 1.49 2.273 0 C-N-CA 119.66 -1.257 . . . . 0.0 110.83 179.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . . . . . . . . . 2.1 p -88.79 -50.03 6.47 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.221 -0.992 . . . . 0.0 111.076 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . 0.501 ' OD1' ' N ' ' S' ' 87' ' ' ASN . 1.4 p30 -87.63 -80.46 0.26 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 119.452 -0.899 . . . . 0.0 111.414 -179.844 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . 0.452 ' CB ' ' O ' ' S' ' 87' ' ' ASN . 0.2 OUTLIER 73.09 -37.65 0.39 Allowed 'General case' 0 N--CA 1.492 1.661 0 C-N-CA 119.946 -0.701 . . . . 0.0 110.338 -179.893 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . 0.484 ' H ' ' C ' ' S' ' 87' ' ' ASN . 4.7 mt -64.32 -10.41 23.97 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 119.574 -0.85 . . . . 0.0 110.149 179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . 0.402 ' O ' ' C ' ' S' ' 91' ' ' ALA . 16.3 mmtm -75.0 -58.64 3.16 Favored 'General case' 0 C--N 1.302 -1.457 0 CA-C-N 115.3 -0.864 . . . . 0.0 113.241 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . 0.729 ' O ' ' HB2' ' S' ' 92' ' ' ALA . . . -36.14 -78.42 0.02 OUTLIER 'General case' 0 C--N 1.286 -2.181 0 CA-C-N 114.002 -1.454 . . . . 0.0 112.762 -179.427 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . 0.729 ' HB2' ' O ' ' S' ' 91' ' ' ALA . . . 161.15 -33.68 0.0 OUTLIER Pre-proline 0 N--CA 1.493 1.71 0 N-CA-C 114.472 1.286 . . . . 0.0 114.472 -179.867 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . 0.617 ' HD2' ' H ' ' S' ' 92' ' ' ALA . 6.2 Cg_exo -58.89 95.8 0.08 OUTLIER 'Trans proline' 0 C--N 1.325 -0.695 0 C-N-CA 120.524 0.816 . . . . 0.0 112.607 -179.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . 0.6 HG23 ' O ' ' S' ' 92' ' ' ALA . 58.4 t -95.13 -18.24 6.79 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.383 0 CA-C-N 115.064 -0.971 . . . . 0.0 109.423 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -67.15 -2.99 6.43 Favored 'General case' 0 C--N 1.305 -1.347 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.751 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . . . . . . . . . 3.6 tp -82.53 -36.54 26.24 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 119.435 -0.906 . . . . 0.0 111.62 -179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.0 -1.39 7.34 Favored 'General case' 0 N--CA 1.494 1.766 0 C-N-CA 119.93 -0.708 . . . . 0.0 112.771 -179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -106.06 -0.41 24.85 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 108.755 -0.832 . . . . 0.0 108.755 179.844 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.629 ' CE2' HG21 ' S' ' 103' ' ' VAL . 5.7 t90 -112.53 -64.28 1.32 Allowed 'General case' 0 C--N 1.3 -1.545 0 CA-C-N 114.17 -1.377 . . . . 0.0 113.467 -179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 1.114 HD22 ' H ' ' S' ' 101' ' ' GLU . 0.0 OUTLIER -20.75 -82.57 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 N-CA-C 119.058 2.984 . . . . 0.0 119.058 -179.806 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 1.114 ' H ' HD22 ' S' ' 100' ' ' LEU . 0.0 OUTLIER -58.58 -43.66 89.53 Favored 'General case' 0 C--N 1.286 -2.189 0 C-N-CA 119.15 -1.02 . . . . 0.0 109.071 -179.425 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . 0.416 ' H ' ' HG3' ' S' ' 101' ' ' GLU . 1.6 tm-20 -63.15 -18.39 63.41 Favored 'General case' 0 C--N 1.286 -2.158 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 179.632 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.629 HG21 ' CE2' ' S' ' 99' ' ' TRP . 0.5 OUTLIER -91.22 -54.13 7.88 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 C-N-CA 117.154 -1.819 . . . . 0.0 111.036 -179.934 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . 0.503 ' N ' HG12 ' S' ' 103' ' ' VAL . 17.5 mt -51.98 -69.01 0.12 Allowed 'General case' 0 C--N 1.298 -1.647 0 C-N-CA 119.501 -0.88 . . . . 0.0 111.442 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 8.1 mt -45.84 -74.46 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 119.131 -1.028 . . . . 0.0 110.888 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.9 tttm -43.49 -57.82 2.91 Favored 'General case' 0 C--N 1.301 -1.531 0 C-N-CA 119.613 -0.835 . . . . 0.0 110.725 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.49 1.544 0 CA-C-O 116.257 -1.83 . . . . 0.0 111.252 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.475 ' O ' ' O ' ' S' ' 41' ' ' LEU . 70.5 m95 . . . . . 0 N--CA 1.484 1.247 0 CA-C-O 116.506 -1.711 . . . . 0.0 109.976 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.512 ' CZ3' ' CB ' ' S' ' 54' ' ' ARG . 93.7 m95 . . . . . 0 N--CA 1.484 1.242 0 CA-C-O 115.943 -1.979 . . . . 0.0 109.049 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 4' ' ' GLN . . . . . 0.552 HE21 ' HB1' ' R' ' 10' ' ' ALA . 29.3 tt0 . . . . . 0 N--CA 1.486 1.365 0 CA-C-O 120.883 0.373 . . . . 0.0 110.038 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 5' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.03 164.63 57.31 Favored Pre-proline 0 N--CA 1.486 1.373 0 C-N-CA 119.515 -0.874 . . . . 0.0 110.542 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 6' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -56.81 -34.11 95.89 Favored 'Trans proline' 0 C--N 1.319 -1.01 0 C-N-CA 121.323 1.348 . . . . 0.0 111.298 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 7' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -64.43 177.58 0.85 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 119.347 -0.941 . . . . 0.0 110.727 179.971 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 8' ' ' SER . . . . . 0.524 ' O ' ' HB3' ' R' ' 9' ' ' ALA . 8.6 t 46.53 36.06 3.33 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 119.294 -0.962 . . . . 0.0 110.938 -179.968 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 9' ' ' ALA . . . . . 0.524 ' HB3' ' O ' ' R' ' 8' ' ' SER . . . 63.81 179.88 0.16 Allowed 'General case' 0 N--CA 1.487 1.376 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.85 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 10' ' ' ALA . . . . . 0.552 ' HB1' HE21 ' R' ' 4' ' ' GLN . . . -171.73 -34.64 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.4 0 C-N-CA 119.41 -0.916 . . . . 0.0 110.92 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 11' ' ' MET . . . . . . . . . . . . . 2.0 mmm -160.63 -50.87 0.05 OUTLIER 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 119.37 -0.932 . . . . 0.0 110.862 179.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 12' ' ' ALA . . . . . . . . . . . . . . . -148.07 20.87 1.11 Allowed 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 119.46 -0.896 . . . . 0.0 110.844 179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 13' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 57.13 92.75 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.358 0 C-N-CA 119.338 -0.945 . . . . 0.0 110.774 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 14' ' ' GLN . . . . . . . . . . . . . 1.6 pt20 -76.44 141.11 41.48 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 119.304 -0.959 . . . . 0.0 110.47 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 15' ' ' ARG . . . . . . . . . . . . . 9.0 mtt180 -94.38 163.7 13.31 Favored 'General case' 0 C--N 1.303 -1.425 0 C-N-CA 119.407 -0.917 . . . . 0.0 111.231 -179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 16' ' ' HIS . . . . . . . . . . . . . 2.8 t-80 -150.37 -3.26 0.36 Allowed 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 119.576 -0.85 . . . . 0.0 110.421 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 17' ' ' GLN . . . . . 0.44 ' C ' ' N ' ' R' ' 19' ' ' TRP . 1.4 mt-30 -92.42 -79.52 0.39 Allowed 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 119.403 -0.919 . . . . 0.0 109.855 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 18' ' ' GLU . . . . . 0.674 ' H ' ' CD ' ' R' ' 18' ' ' GLU . 0.0 OUTLIER -48.57 -27.71 2.95 Favored 'General case' 0 N--CA 1.492 1.651 0 CA-C-O 122.888 1.327 . . . . 0.0 107.779 179.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 19' ' ' TRP . . . . . 0.44 ' N ' ' C ' ' R' ' 17' ' ' GLN . 71.8 t-105 -51.62 -60.42 3.18 Favored 'General case' 0 C--N 1.294 -1.813 0 CA-C-N 112.912 -1.949 . . . . 0.0 109.127 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 20' ' ' LEU . . . . . . . . . . . . . 3.5 tt -49.5 -31.61 10.47 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.532 -1.213 . . . . 0.0 111.404 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 21' ' ' ARG . . . . . 0.465 ' O ' ' C ' ' R' ' 22' ' ' PHE . 24.3 mmt180 -61.91 -75.68 0.07 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 118.387 -1.325 . . . . 0.0 109.865 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 22' ' ' PHE . . . . . 0.503 ' CD2' HD11 ' S' ' 51' ' ' LEU . 8.7 t80 -36.32 -39.91 0.21 Allowed 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 118.677 -1.209 . . . . 0.0 111.404 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 23' ' ' VAL . . . . . 0.499 ' O ' ' N ' ' R' ' 25' ' ' LEU . 46.6 t -73.05 -74.39 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 C-N-CA 119.69 -0.804 . . . . 0.0 110.598 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 24' ' ' ASP . . . . . 0.437 ' C ' ' O ' ' R' ' 23' ' ' VAL . 29.8 t70 -37.85 -29.67 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.965 -0.694 . . . . 0.0 109.757 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 25' ' ' LEU . . . . . 0.499 ' N ' ' O ' ' R' ' 23' ' ' VAL . 13.5 tp -70.54 -66.26 0.63 Allowed 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.142 179.776 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 26' ' ' LEU . . . . . 0.841 HD21 HG13 ' S' ' 23' ' ' VAL . 5.5 tp -48.11 -56.25 8.27 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 114.83 -1.077 . . . . 0.0 111.372 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 27' ' ' LYS . . . . . 0.414 ' NZ ' ' CE1' ' S' ' 30' ' ' TYR . 0.1 OUTLIER -41.37 -57.13 2.26 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.256 -179.882 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 28' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -78.35 -5.55 52.52 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 119.554 -0.858 . . . . 0.0 112.353 -179.82 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 29' ' ' ALA . . . . . 0.417 ' O ' ' N ' ' R' ' 33' ' ' ASP . . . -83.24 -51.26 7.61 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 118.854 -1.138 . . . . 0.0 111.829 -179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 30' ' ' TYR . . . . . 0.418 ' O ' ' N ' ' R' ' 33' ' ' ASP . 24.0 t80 -41.23 -67.3 0.26 Allowed 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 119.52 -0.872 . . . . 0.0 111.155 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 31' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -45.95 -25.82 0.61 Allowed 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.309 -0.956 . . . . 0.0 110.653 179.919 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 32' ' ' ASN . . . . . 0.518 ' O ' ' CB ' ' R' ' 33' ' ' ASP . 0.3 OUTLIER -93.19 -23.48 18.55 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 119.489 -0.884 . . . . 0.0 111.296 -179.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 33' ' ' ASP . . . . . 0.518 ' CB ' ' O ' ' R' ' 32' ' ' ASN . 3.3 t0 85.69 23.09 0.08 Allowed 'General case' 0 N--CA 1.5 2.03 0 O-C-N 123.695 0.622 . . . . 0.0 111.346 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 34' ' ' LEU . . . . . 0.508 HD23 HD22 ' R' ' 32' ' ' ASN . 0.6 OUTLIER -104.27 -13.37 16.18 Favored 'General case' 0 N--CA 1.491 1.592 0 CA-C-O 121.679 0.752 . . . . 0.0 109.003 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 35' ' ' HIS . . . . . 0.413 ' N ' ' HB1' ' R' ' 29' ' ' ALA . 27.1 p-80 -49.38 -24.88 2.13 Favored 'General case' 0 C--N 1.297 -1.69 0 CA-C-N 114.301 -1.318 . . . . 0.0 113.007 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 36' ' ' LEU . . . . . 0.455 ' CB ' ' CD ' ' R' ' 37' ' ' PRO . 6.2 mt -77.83 -64.33 0.42 Allowed Pre-proline 0 N--CA 1.484 1.235 0 C-N-CA 118.081 -1.447 . . . . 0.0 110.893 -179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 37' ' ' PRO . . . . . 0.525 ' O ' HD13 ' R' ' 41' ' ' LEU . 2.2 Cg_endo -53.83 -23.9 28.95 Favored 'Trans proline' 0 C--N 1.32 -0.926 0 N-CA-C 109.978 -0.816 . . . . 0.0 109.978 179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 38' ' ' LEU . . . . . 0.468 HD22 HD21 ' R' ' 25' ' ' LEU . 78.0 mt -83.9 -33.09 24.84 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 119.679 -0.808 . . . . 0.0 110.155 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 39' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 43' ' ' LEU . 1.0 OUTLIER -56.43 -32.53 64.97 Favored 'General case' 0 C--N 1.309 -1.175 0 C-N-CA 119.332 -0.947 . . . . 0.0 108.814 179.752 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 40' ' ' ASN . . . . . 0.532 ' O ' ' N ' ' R' ' 109' ' ' TRP . 1.0 OUTLIER -81.77 3.52 25.49 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.669 -0.812 . . . . 0.0 111.792 -179.954 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 41' ' ' LEU . . . . . 0.525 HD13 ' O ' ' R' ' 37' ' ' PRO . 4.9 mp -105.6 -65.17 1.08 Allowed 'General case' 0 N--CA 1.495 1.776 0 C-N-CA 119.379 -0.928 . . . . 0.0 111.255 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 42' ' ' MET . . . . . 0.512 ' N ' ' SD ' ' R' ' 42' ' ' MET . 0.0 OUTLIER -94.65 37.59 1.13 Allowed 'General case' 0 N--CA 1.498 1.948 0 C-N-CA 119.216 -0.994 . . . . 0.0 111.23 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 43' ' ' LEU . . . . . 0.474 ' O ' ' O ' ' R' ' 39' ' ' LEU . 1.1 tp 179.31 127.06 0.07 Allowed 'General case' 0 N--CA 1.505 2.294 0 N-CA-C 109.176 -0.676 . . . . 0.0 109.176 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 44' ' ' THR . . . . . 0.684 ' H ' ' HD2' ' R' ' 45' ' ' PRO . 0.3 OUTLIER -173.93 -39.22 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.669 0 C-N-CA 117.639 -1.624 . . . . 0.0 115.251 -179.877 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 45' ' ' PRO . . . . . 0.684 ' HD2' ' H ' ' R' ' 44' ' ' THR . 9.7 Cg_endo -76.14 -95.39 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.288 0 C-N-CA 120.814 1.009 . . . . 0.0 112.165 -179.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 46' ' ' ASP . . . . . 0.542 ' O ' ' HB3' ' R' ' 50' ' ' ALA . 0.8 OUTLIER -55.86 -6.89 0.25 Allowed 'General case' 0 C--N 1.307 -1.276 0 C-N-CA 118.804 -1.158 . . . . 0.0 109.454 -179.857 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 47' ' ' GLU . . . . . 0.605 ' OE2' ' CH2' ' S' ' 19' ' ' TRP . 25.2 tt0 -72.11 -79.92 0.07 Allowed 'General case' 0 C--N 1.302 -1.495 0 C-N-CA 119.365 -0.934 . . . . 0.0 110.044 179.867 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 48' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' R' ' 47' ' ' GLU . 9.7 mmm-85 -43.04 -24.59 0.07 Allowed 'General case' 0 C--N 1.307 -1.24 0 C-N-CA 119.549 -0.86 . . . . 0.0 110.104 -179.983 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 49' ' ' GLU . . . . . 0.486 ' N ' ' O ' ' R' ' 47' ' ' GLU . 5.4 mt-10 -88.57 -68.23 0.78 Allowed 'General case' 0 C--N 1.304 -1.383 0 C-N-CA 118.648 -1.221 . . . . 0.0 111.822 179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 50' ' ' ALA . . . . . 0.542 ' HB3' ' O ' ' R' ' 46' ' ' ASP . . . -57.98 -60.55 3.56 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.746 1.017 . . . . 0.0 113.746 -179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 51' ' ' LEU . . . . . 0.498 HD21 ' CD2' ' S' ' 22' ' ' PHE . 2.4 mp -33.48 -62.9 0.27 Allowed 'General case' 0 N--CA 1.503 2.186 0 C-N-CA 119.693 -0.803 . . . . 0.0 111.439 -179.809 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 52' ' ' GLY . . . . . . . . . . . . . . . -49.36 -47.38 35.3 Favored Glycine 0 N--CA 1.485 1.929 0 C-N-CA 118.74 -1.695 . . . . 0.0 109.416 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 53' ' ' THR . . . . . 0.523 ' O ' ' N ' ' R' ' 56' ' ' ARG . 0.1 OUTLIER -58.99 -81.22 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 -179.989 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 54' ' ' ARG . . . . . 0.451 ' HG2' ' H ' ' R' ' 54' ' ' ARG . 0.0 OUTLIER -34.04 -60.53 0.39 Allowed 'General case' 0 N--CA 1.502 2.171 0 CA-C-N 115.664 -0.698 . . . . 0.0 112.578 -179.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 55' ' ' VAL . . . . . . . . . . . . . 87.5 t -57.04 -31.08 35.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.791 0 C-N-CA 118.136 -1.426 . . . . 0.0 110.925 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 56' ' ' ARG . . . . . 0.523 ' N ' ' O ' ' R' ' 53' ' ' THR . 22.2 mtp85 -80.73 -37.25 30.89 Favored 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 118.655 -1.218 . . . . 0.0 112.396 -179.947 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 57' ' ' ILE . . . . . 0.955 HD13 ' N ' ' R' ' 58' ' ' VAL . 0.0 OUTLIER -75.45 -31.9 24.45 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 C-N-CA 116.801 -1.96 . . . . 0.0 108.297 -179.862 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 58' ' ' VAL . . . . . 0.955 ' N ' HD13 ' R' ' 57' ' ' ILE . 2.7 t -61.96 -60.17 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 C-N-CA 118.679 -1.208 . . . . 0.0 109.176 179.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 59' ' ' GLU . . . . . 0.443 ' N ' HG12 ' R' ' 58' ' ' VAL . 48.1 mt-10 -52.96 -34.88 57.8 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.808 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 60' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -70.73 -45.89 64.04 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 119.242 -0.983 . . . . 0.0 111.845 -179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 61' ' ' LEU . . . . . 0.414 ' HA ' HD23 ' R' ' 61' ' ' LEU . 65.5 mt -84.82 0.24 51.54 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 118.905 -1.118 . . . . 0.0 111.563 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 62' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -62.32 -63.72 1.15 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 118.82 -1.152 . . . . 0.0 109.699 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 63' ' ' ARG . . . . . . . . . . . . . 46.0 mtp180 -104.49 7.41 35.32 Favored 'General case' 0 N--CA 1.487 1.398 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.642 179.842 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 64' ' ' GLY . . . . . 0.549 ' O ' ' N ' ' R' ' 66' ' ' MET . . . -93.87 27.61 12.36 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 110.5 -1.04 . . . . 0.0 110.5 -179.95 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 65' ' ' GLU . . . . . 0.44 ' C ' ' O ' ' R' ' 64' ' ' GLY . 2.0 mt-10 -32.51 -30.63 0.01 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 120.494 -0.482 . . . . 0.0 111.572 179.966 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 66' ' ' MET . . . . . 0.549 ' N ' ' O ' ' R' ' 64' ' ' GLY . 7.2 mmt -85.3 98.77 10.71 Favored 'General case' 0 C--N 1.304 -1.384 0 C-N-CA 119.462 -0.895 . . . . 0.0 110.299 179.874 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 67' ' ' SER . . . . . . . . . . . . . 2.1 t 174.17 80.77 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 119.598 -0.841 . . . . 0.0 109.997 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 68' ' ' GLN . . . . . 0.532 ' C ' ' H ' ' R' ' 70' ' ' GLU . 0.2 OUTLIER -114.11 -23.36 9.55 Favored 'General case' 0 C--N 1.304 -1.373 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.651 -179.874 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 69' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -73.69 27.22 0.07 Allowed 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.405 -179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 70' ' ' GLU . . . . . 0.532 ' H ' ' C ' ' R' ' 68' ' ' GLN . 1.3 pt-20 -122.92 25.97 8.36 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.176 -0.92 . . . . 0.0 110.584 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -39.55 159.18 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.572 0 C-N-CA 119.817 -0.753 . . . . 0.0 111.477 -179.934 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 72' ' ' LYS . . . . . 0.444 ' O ' ' CG ' ' R' ' 72' ' ' LYS . 0.1 OUTLIER -44.45 127.4 5.88 Favored 'General case' 0 N--CA 1.487 1.407 0 CA-C-N 115.559 -0.746 . . . . 0.0 111.706 -179.931 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 73' ' ' ASN . . . . . 0.575 ' O ' ' N ' ' R' ' 75' ' ' LEU . 1.1 t30 -118.33 16.0 13.92 Favored 'General case' 0 N--CA 1.487 1.376 0 CA-C-O 122.084 0.945 . . . . 0.0 109.356 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 74' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 37.91 19.06 0.0 OUTLIER 'General case' 0 C--N 1.291 -1.974 0 CA-C-N 113.037 -1.892 . . . . 0.0 112.127 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 75' ' ' LEU . . . . . 0.575 ' N ' ' O ' ' R' ' 73' ' ' ASN . 2.9 tp -126.84 -25.47 3.34 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 120.165 -0.614 . . . . 0.0 110.678 179.807 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 76' ' ' GLY . . . . . . . . . . . . . . . -89.83 -54.73 2.13 Favored Glycine 0 N--CA 1.489 2.187 0 C-N-CA 119.515 -1.326 . . . . 0.0 110.68 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 77' ' ' ALA . . . . . . . . . . . . . . . -144.73 -102.29 0.11 Allowed 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 119.189 -1.004 . . . . 0.0 110.965 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 78' ' ' GLY . . . . . . . . . . . . . . . -176.76 145.23 7.27 Favored Glycine 0 N--CA 1.489 2.222 0 C-N-CA 119.468 -1.348 . . . . 0.0 110.476 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 79' ' ' ILE . . . . . 0.901 ' O ' HD12 ' R' ' 79' ' ' ILE . 0.0 OUTLIER -44.75 -36.38 1.39 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.352 0 C-N-CA 120.146 -0.622 . . . . 0.0 110.855 179.995 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 80' ' ' ALA . . . . . 0.539 ' O ' ' NH1' ' R' ' 84' ' ' ARG . . . -62.26 -31.44 72.01 Favored 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 119.611 -0.836 . . . . 0.0 112.511 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 81' ' ' THR . . . . . 0.508 ' C ' ' H ' ' R' ' 83' ' ' THR . 0.9 OUTLIER -86.6 -50.94 6.46 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 119.367 -0.933 . . . . 0.0 112.113 -179.871 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 82' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -63.51 7.53 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 C-N-CA 118.874 -1.13 . . . . 0.0 111.899 -179.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 83' ' ' THR . . . . . 0.508 ' H ' ' C ' ' R' ' 81' ' ' THR . 0.0 OUTLIER -91.54 -79.31 0.38 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 119.129 -1.029 . . . . 0.0 110.077 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 84' ' ' ARG . . . . . 0.814 ' NE ' ' H ' ' R' ' 84' ' ' ARG . 0.0 OUTLIER -53.58 -26.8 23.13 Favored 'General case' 0 C--N 1.305 -1.336 0 C-N-CA 119.329 -0.948 . . . . 0.0 110.348 179.86 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 85' ' ' GLY . . . . . . . . . . . . . . . -54.85 -44.69 81.53 Favored Glycine 0 N--CA 1.488 2.143 0 C-N-CA 119.343 -1.408 . . . . 0.0 109.924 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 86' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -94.23 -49.29 5.8 Favored 'General case' 0 C--N 1.306 -1.325 0 C-N-CA 119.528 -0.869 . . . . 0.0 110.527 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 87' ' ' ASN . . . . . 0.552 ' ND2' ' N ' ' R' ' 87' ' ' ASN . 0.3 OUTLIER -75.81 10.6 1.73 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 119.567 -0.853 . . . . 0.0 110.655 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 88' ' ' SER . . . . . 0.58 ' O ' ' HB3' ' R' ' 92' ' ' ALA . 0.5 OUTLIER -41.51 -27.29 0.09 Allowed 'General case' 0 N--CA 1.488 1.429 0 C-N-CA 119.816 -0.754 . . . . 0.0 111.423 179.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 89' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' R' ' 87' ' ' ASN . 5.6 mt -61.02 -68.6 0.29 Allowed 'General case' 0 C--N 1.303 -1.449 0 C-N-CA 119.097 -1.041 . . . . 0.0 110.722 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 90' ' ' LYS . . . . . 0.434 ' O ' ' C ' ' R' ' 91' ' ' ALA . 9.4 mmtp -69.5 -75.37 0.11 Allowed 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.665 0.745 . . . . 0.0 112.622 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 91' ' ' ALA . . . . . 0.434 ' C ' ' O ' ' R' ' 90' ' ' LYS . . . -30.69 -64.83 0.13 Allowed 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.664 -1.607 . . . . 0.0 112.89 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 92' ' ' ALA . . . . . 0.58 ' HB3' ' O ' ' R' ' 88' ' ' SER . . . -68.23 163.08 55.34 Favored Pre-proline 0 N--CA 1.49 1.527 0 C-N-CA 119.025 -1.07 . . . . 0.0 110.774 -179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 93' ' ' PRO . . . . . 0.555 ' HD2' ' HB1' ' R' ' 92' ' ' ALA . 2.5 Cg_endo -59.23 131.58 41.91 Favored 'Trans proline' 0 C--N 1.32 -0.936 0 C-N-CA 121.656 1.571 . . . . 0.0 111.868 179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 94' ' ' VAL . . . . . 0.448 ' C ' ' H ' ' R' ' 96' ' ' LEU . 96.7 t -78.78 -18.74 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.347 0 C-N-CA 119.42 -0.912 . . . . 0.0 110.379 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 95' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -69.73 6.36 1.18 Allowed 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 119.504 -0.878 . . . . 0.0 110.484 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 96' ' ' LEU . . . . . 0.448 ' H ' ' C ' ' R' ' 94' ' ' VAL . 2.2 tp -80.12 -33.55 38.57 Favored 'General case' 0 C--N 1.305 -1.367 0 C-N-CA 119.701 -0.8 . . . . 0.0 110.717 -179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 97' ' ' ARG . . . . . . . . . . . . . 6.1 mpt_? -63.63 -25.56 68.28 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.382 -0.927 . . . . 0.0 110.97 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 98' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -62.17 -26.42 68.32 Favored 'General case' 0 N--CA 1.488 1.432 0 C-N-CA 119.307 -0.957 . . . . 0.0 110.863 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 99' ' ' TRP . . . . . 0.617 ' CZ3' HG21 ' R' ' 103' ' ' VAL . 5.7 t90 -110.48 -62.36 1.53 Allowed 'General case' 0 N--CA 1.487 1.395 0 CA-C-N 115.683 -0.69 . . . . 0.0 111.372 -179.907 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 100' ' ' LEU . . . . . 0.49 ' O ' ' C ' ' R' ' 101' ' ' GLU . 1.7 mm? -40.96 -33.03 0.27 Allowed 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 118.999 -1.08 . . . . 0.0 113.334 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 101' ' ' GLU . . . . . 0.49 ' C ' ' O ' ' R' ' 100' ' ' LEU . 6.7 mm-40 -43.76 -37.92 2.95 Favored 'General case' 0 C--N 1.294 -1.828 0 C-N-CA 117.668 -1.613 . . . . 0.0 107.366 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 102' ' ' GLU . . . . . 0.405 ' N ' ' C ' ' R' ' 100' ' ' LEU . 2.2 mt-10 -90.81 -27.28 18.97 Favored 'General case' 0 C--N 1.302 -1.496 0 CA-C-N 113.567 -1.651 . . . . 0.0 112.05 179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 103' ' ' VAL . . . . . 0.617 HG21 ' CZ3' ' R' ' 99' ' ' TRP . 2.1 t -93.52 -1.25 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 C-N-CA 117.651 -1.62 . . . . 0.0 110.79 -179.824 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 104' ' ' LEU . . . . . 0.436 ' N ' ' O ' ' R' ' 100' ' ' LEU . 20.1 tp -108.22 -51.47 2.89 Favored 'General case' 0 C--N 1.31 -1.144 0 CA-C-N 115.773 -0.649 . . . . 0.0 111.629 179.844 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 105' ' ' LEU . . . . . 0.68 ' C ' HD12 ' R' ' 105' ' ' LEU . 0.4 OUTLIER -78.19 -28.52 48.16 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 118.845 -1.142 . . . . 0.0 111.73 -179.894 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' R' R ' 106' ' ' LYS . . . . . . . . . . . . . 29.6 tttm -68.33 -21.47 64.74 Favored 'General case' 0 N--CA 1.489 1.522 0 C-N-CA 118.937 -1.105 . . . . 0.0 110.583 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' R' R ' 107' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.304 -1.38 0 CA-C-O 116.276 -1.821 . . . . 0.0 110.732 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 4' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 . . . . . 0 N--CA 1.485 1.29 0 CA-C-O 120.956 0.408 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' S' S ' 5' ' ' SER . . . . . . . . . . . . . 26.6 t -150.16 68.49 8.73 Favored Pre-proline 0 C--N 1.305 -1.362 0 C-N-CA 119.447 -0.901 . . . . 0.0 111.136 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 6' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.18 -37.47 31.88 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 121.581 1.52 . . . . 0.0 111.439 -179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 7' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -71.53 151.28 44.01 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 119.408 -0.917 . . . . 0.0 110.905 -179.982 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 8' ' ' SER . . . . . . . . . . . . . 1.5 p -63.37 -165.36 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.401 0 C-N-CA 119.452 -0.899 . . . . 0.0 110.93 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 9' ' ' ALA . . . . . 0.436 ' C ' ' H ' ' S' ' 11' ' ' MET . . . -168.22 40.96 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 119.399 -0.92 . . . . 0.0 110.937 -179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 10' ' ' ALA . . . . . . . . . . . . . . . 51.16 11.45 0.1 Allowed 'General case' 0 C--N 1.305 -1.359 0 C-N-CA 119.401 -0.92 . . . . 0.0 110.924 -179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 11' ' ' MET . . . . . 0.436 ' H ' ' C ' ' S' ' 9' ' ' ALA . 11.8 ptm -69.7 160.46 31.6 Favored 'General case' 0 C--N 1.305 -1.365 0 C-N-CA 119.479 -0.888 . . . . 0.0 110.956 -179.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.43 -60.21 4.06 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 119.521 -0.871 . . . . 0.0 110.927 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 13' ' ' GLU . . . . . . . . . . . . . 3.1 tt0 -170.85 145.58 2.41 Favored 'General case' 0 C--N 1.305 -1.334 0 C-N-CA 119.446 -0.902 . . . . 0.0 110.756 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 14' ' ' GLN . . . . . 0.527 ' CD ' ' H ' ' S' ' 14' ' ' GLN . 0.0 OUTLIER -74.79 121.64 22.09 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 119.317 -0.953 . . . . 0.0 111.036 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 15' ' ' ARG . . . . . . . . . . . . . 3.4 ptm180 -140.46 45.71 1.83 Allowed 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 119.829 -0.748 . . . . 0.0 110.105 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 16' ' ' HIS . . . . . 0.409 ' H ' ' H ' ' S' ' 17' ' ' GLN . 26.3 t-80 -161.78 -12.54 0.04 OUTLIER 'General case' 0 C--N 1.305 -1.37 0 C-N-CA 119.606 -0.837 . . . . 0.0 110.637 179.899 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 17' ' ' GLN . . . . . 0.409 ' H ' ' H ' ' S' ' 16' ' ' HIS . 4.3 mt-30 -86.26 -85.69 0.15 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 119.5 -0.88 . . . . 0.0 110.499 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 18' ' ' GLU . . . . . 0.503 ' N ' ' CD ' ' S' ' 18' ' ' GLU . 0.0 OUTLIER -47.28 -33.6 5.77 Favored 'General case' 0 N--CA 1.492 1.665 0 C-N-CA 118.901 -1.12 . . . . 0.0 108.116 179.791 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 19' ' ' TRP . . . . . 0.605 ' CH2' ' OE2' ' R' ' 47' ' ' GLU . 27.7 t-105 -51.34 -61.52 2.19 Favored 'General case' 0 C--N 1.298 -1.646 0 CA-C-N 113.716 -1.584 . . . . 0.0 109.437 179.798 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 20' ' ' LEU . . . . . 0.439 ' O ' ' N ' ' S' ' 24' ' ' ASP . 1.3 mt -56.34 -41.72 76.55 Favored 'General case' 0 C--N 1.3 -1.577 0 CA-C-N 114.357 -1.292 . . . . 0.0 111.511 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 21' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' S' ' 22' ' ' PHE . 20.4 mmt180 -44.15 -64.3 0.7 Allowed 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 118.523 -1.271 . . . . 0.0 109.64 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 22' ' ' PHE . . . . . 0.549 ' O ' HD13 ' S' ' 26' ' ' LEU . 4.3 t80 -40.27 -40.39 1.13 Allowed 'General case' 0 C--N 1.314 -0.965 0 C-N-CA 119.062 -1.055 . . . . 0.0 109.765 179.558 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 23' ' ' VAL . . . . . 0.841 HG13 HD21 ' R' ' 26' ' ' LEU . 45.1 t -80.56 -74.09 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 C-N-CA 119.953 -0.699 . . . . 0.0 111.065 -179.965 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 24' ' ' ASP . . . . . 0.511 ' O ' ' ND2' ' S' ' 28' ' ' ASN . 0.7 OUTLIER -36.63 -32.17 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.707 0 CA-C-N 115.684 -0.689 . . . . 0.0 111.097 179.988 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 25' ' ' LEU . . . . . 0.449 ' N ' ' O ' ' S' ' 23' ' ' VAL . 63.0 tp -73.54 -49.78 24.72 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-N 115.375 -0.83 . . . . 0.0 109.676 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 26' ' ' LEU . . . . . 0.562 HD11 ' CD1' ' S' ' 39' ' ' LEU . 1.4 mp -49.75 -59.78 3.5 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-N 115.144 -0.934 . . . . 0.0 112.931 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 27' ' ' LYS . . . . . 0.408 ' O ' ' NE2' ' S' ' 31' ' ' GLN . 0.4 OUTLIER -54.74 -21.39 10.8 Favored 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 119.603 -0.839 . . . . 0.0 113.244 -179.711 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 28' ' ' ASN . . . . . 0.511 ' ND2' ' O ' ' S' ' 24' ' ' ASP . 74.6 m-20 -89.89 -21.15 22.65 Favored 'General case' 0 N--CA 1.492 1.641 0 C-N-CA 118.754 -1.179 . . . . 0.0 111.421 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 29' ' ' ALA . . . . . 0.602 ' HB1' ' HB2' ' S' ' 34' ' ' LEU . . . -95.42 -29.8 14.23 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 119.256 -0.978 . . . . 0.0 111.842 -179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 30' ' ' TYR . . . . . 0.414 ' CE1' ' NZ ' ' R' ' 27' ' ' LYS . 6.9 t80 -46.83 -58.26 4.09 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 118.906 -1.118 . . . . 0.0 110.887 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 31' ' ' GLN . . . . . 0.595 ' CD ' ' H ' ' S' ' 31' ' ' GLN . 0.0 OUTLIER -56.6 -18.26 11.36 Favored 'General case' 0 C--N 1.304 -1.39 0 C-N-CA 119.197 -1.001 . . . . 0.0 110.211 179.937 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 32' ' ' ASN . . . . . 0.442 ' O ' ' CB ' ' S' ' 33' ' ' ASP . 0.1 OUTLIER -98.69 -17.38 18.59 Favored 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 119.767 -0.773 . . . . 0.0 110.926 179.983 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 33' ' ' ASP . . . . . 0.442 ' CB ' ' O ' ' S' ' 32' ' ' ASN . 0.8 OUTLIER 78.73 27.42 0.46 Allowed 'General case' 0 N--CA 1.498 1.931 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.608 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 34' ' ' LEU . . . . . 0.602 ' HB2' ' HB1' ' S' ' 29' ' ' ALA . 1.5 mm? -103.9 -13.76 16.25 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.017 179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 35' ' ' HIS . . . . . 0.446 ' O ' HD13 ' S' ' 39' ' ' LEU . 24.8 p-80 -51.53 -24.63 5.46 Favored 'General case' 0 C--N 1.293 -1.874 0 CA-C-N 114.355 -1.293 . . . . 0.0 112.387 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 36' ' ' LEU . . . . . 0.485 ' CB ' ' CD ' ' S' ' 37' ' ' PRO . 6.0 mt -70.64 -63.92 1.47 Allowed Pre-proline 0 C--N 1.304 -1.383 0 C-N-CA 117.94 -1.504 . . . . 0.0 110.359 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 37' ' ' PRO . . . . . 0.485 ' CD ' ' CB ' ' S' ' 36' ' ' LEU . 2.6 Cg_endo -52.43 -33.67 57.93 Favored 'Trans proline' 0 C--N 1.317 -1.111 0 C-N-CA 120.719 0.946 . . . . 0.0 110.8 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 38' ' ' LEU . . . . . . . . . . . . . 97.3 mt -73.31 -41.28 63.73 Favored 'General case' 0 N--CA 1.493 1.684 0 C-N-CA 119.993 -0.683 . . . . 0.0 111.02 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 39' ' ' LEU . . . . . 0.562 ' CD1' HD11 ' S' ' 26' ' ' LEU . 0.3 OUTLIER -51.55 -44.62 62.75 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.617 -0.833 . . . . 0.0 109.443 179.881 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 40' ' ' ASN . . . . . 0.546 ' O ' ' N ' ' R' ' 1' ' ' TRP . 1.0 OUTLIER -71.86 10.92 0.6 Allowed 'General case' 0 C--N 1.302 -1.472 0 C-N-CA 119.651 -0.82 . . . . 0.0 110.608 -179.996 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 41' ' ' LEU . . . . . 0.472 ' H ' ' C ' ' S' ' 39' ' ' LEU . 2.2 tp -106.87 -61.68 1.5 Allowed 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 119.915 -0.714 . . . . 0.0 111.983 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 42' ' ' MET . . . . . 0.453 ' O ' ' CB ' ' S' ' 43' ' ' LEU . 0.1 OUTLIER -100.16 39.34 1.35 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 119.139 -1.024 . . . . 0.0 112.196 -179.792 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 43' ' ' LEU . . . . . 0.479 ' O ' ' O ' ' S' ' 39' ' ' LEU . 0.3 OUTLIER 163.08 129.88 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.328 0 N-CA-C 109.275 -0.639 . . . . 0.0 109.275 179.967 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 44' ' ' THR . . . . . 0.653 ' H ' ' HD2' ' S' ' 45' ' ' PRO . 0.3 OUTLIER 178.7 -35.72 0.0 OUTLIER Pre-proline 0 N--CA 1.492 1.665 0 C-N-CA 117.469 -1.693 . . . . 0.0 115.298 -179.932 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 45' ' ' PRO . . . . . 0.653 ' HD2' ' H ' ' S' ' 44' ' ' THR . 18.8 Cg_endo -78.89 -109.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.547 1.165 0 C-N-CA 120.81 1.006 . . . . 0.0 112.793 -179.497 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 46' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.57 -15.97 43.7 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 119.247 -0.981 . . . . 0.0 110.016 -179.844 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 47' ' ' GLU . . . . . 0.408 ' O ' ' CB ' ' S' ' 51' ' ' LEU . 45.5 mt-10 -70.48 -57.4 4.82 Favored 'General case' 0 C--N 1.298 -1.66 0 C-N-CA 119.334 -0.947 . . . . 0.0 110.298 179.896 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 48' ' ' ARG . . . . . . . . . . . . . 30.5 ttp180 -55.09 -40.38 70.36 Favored 'General case' 0 C--N 1.305 -1.33 0 C-N-CA 119.747 -0.781 . . . . 0.0 110.724 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 49' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.23 -66.14 0.58 Allowed 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 119.553 -0.859 . . . . 0.0 112.147 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 50' ' ' ALA . . . . . 0.815 ' HA ' HG22 ' S' ' 53' ' ' THR . . . -63.13 -33.13 74.81 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.778 -1.169 . . . . 0.0 111.044 -179.758 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 51' ' ' LEU . . . . . 0.525 ' O ' HG23 ' S' ' 55' ' ' VAL . 1.7 tt -50.42 -28.71 8.69 Favored 'General case' 0 C--N 1.295 -1.764 0 N-CA-C 106.406 -1.702 . . . . 0.0 106.406 179.689 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 52' ' ' GLY . . . . . 0.442 ' N ' ' C ' ' S' ' 50' ' ' ALA . . . -83.05 -39.14 10.35 Favored Glycine 0 CA--C 1.538 1.485 0 CA-C-N 112.695 -2.048 . . . . 0.0 114.002 -179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 53' ' ' THR . . . . . 0.815 HG22 ' HA ' ' S' ' 50' ' ' ALA . 0.5 OUTLIER -55.04 -60.46 3.34 Favored 'General case' 0 N--CA 1.504 2.271 0 C-N-CA 116.039 -2.264 . . . . 0.0 108.309 -179.547 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 54' ' ' ARG . . . . . 0.678 ' O ' HG23 ' S' ' 58' ' ' VAL . 3.0 ptp180 -48.56 -45.12 37.25 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 118.416 -1.314 . . . . 0.0 109.665 -179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 55' ' ' VAL . . . . . 0.525 HG23 ' O ' ' S' ' 51' ' ' LEU . 97.7 t -67.71 -21.91 27.8 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.348 0 C-N-CA 116.949 -1.9 . . . . 0.0 109.125 179.578 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 56' ' ' ARG . . . . . 0.512 ' N ' ' O ' ' S' ' 53' ' ' THR . 2.4 ptt180 -83.29 -42.64 16.92 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 118.672 -1.211 . . . . 0.0 110.894 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 57' ' ' ILE . . . . . 0.904 HD13 ' N ' ' S' ' 58' ' ' VAL . 0.0 OUTLIER -70.81 -31.93 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 C-N-CA 115.99 -2.284 . . . . 0.0 105.745 -179.803 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 58' ' ' VAL . . . . . 0.904 ' N ' HD13 ' S' ' 57' ' ' ILE . 24.4 t -57.64 -63.83 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.305 0 C-N-CA 118.541 -1.263 . . . . 0.0 108.307 179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 59' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -43.79 -26.86 0.28 Allowed 'General case' 0 C--N 1.308 -1.201 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.205 179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 60' ' ' GLU . . . . . 0.497 ' N ' ' OE1' ' S' ' 60' ' ' GLU . 0.0 OUTLIER -88.36 -32.92 18.14 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 119.14 -1.024 . . . . 0.0 111.585 179.825 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 61' ' ' LEU . . . . . 0.771 ' O ' HD12 ' S' ' 61' ' ' LEU . 0.5 OUTLIER -55.09 -20.79 10.66 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 117.254 -1.779 . . . . 0.0 106.623 179.947 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 62' ' ' LEU . . . . . 0.705 ' O ' ' N ' ' S' ' 64' ' ' GLY . 0.6 OUTLIER -78.28 30.14 0.18 Allowed 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.874 -1.512 . . . . 0.0 107.736 179.636 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 63' ' ' ARG . . . . . 0.578 ' H ' ' C ' ' S' ' 61' ' ' LEU . 0.4 OUTLIER -30.29 -14.03 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 114.818 1.414 . . . . 0.0 114.818 -179.855 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 64' ' ' GLY . . . . . 0.705 ' N ' ' O ' ' S' ' 62' ' ' LEU . . . -37.91 -27.96 0.04 OUTLIER Glycine 0 N--CA 1.496 2.696 0 N-CA-C 109.098 -1.601 . . . . 0.0 109.098 179.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 65' ' ' GLU . . . . . 0.539 ' N ' ' O ' ' S' ' 63' ' ' ARG . 31.7 mt-10 -102.66 -63.94 1.12 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 120.337 -0.545 . . . . 0.0 110.222 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 66' ' ' MET . . . . . . . . . . . . . 2.5 ttt -162.88 153.39 16.58 Favored 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 118.767 -1.173 . . . . 0.0 112.257 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 67' ' ' SER . . . . . 0.402 ' OG ' ' CB ' ' S' ' 63' ' ' ARG . 1.1 p 171.91 82.53 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 107.927 -1.138 . . . . 0.0 107.927 179.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 68' ' ' GLN . . . . . 0.486 ' C ' ' H ' ' S' ' 70' ' ' GLU . 6.7 pt20 -115.1 -40.83 3.41 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-N 114.932 -1.031 . . . . 0.0 113.402 -179.655 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 69' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -71.74 28.03 0.05 OUTLIER 'General case' 0 C--N 1.3 -1.572 0 C-N-CA 119.622 -0.831 . . . . 0.0 112.493 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 70' ' ' GLU . . . . . 0.533 ' O ' ' C ' ' S' ' 71' ' ' LEU . 9.2 mm-40 -83.93 -66.46 0.89 Allowed 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.497 -0.881 . . . . 0.0 111.043 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 71' ' ' LEU . . . . . 0.533 ' C ' ' O ' ' S' ' 70' ' ' GLU . 2.0 mp -8.14 116.24 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.21 0 O-C-N 124.743 1.277 . . . . 0.0 112.707 -179.927 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -42.68 147.37 0.3 Allowed 'General case' 0 N--CA 1.494 1.726 0 N-CA-C 114.786 1.402 . . . . 0.0 114.786 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 73' ' ' ASN . . . . . 0.406 ' HB3' ' H ' ' S' ' 74' ' ' GLU . 0.5 OUTLIER -125.92 -92.13 0.51 Allowed 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 114.22 -1.355 . . . . 0.0 109.318 179.524 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 74' ' ' GLU . . . . . 0.441 ' HG3' ' H ' ' S' ' 75' ' ' LEU . 0.0 OUTLIER -171.75 -42.32 0.02 OUTLIER 'General case' 0 C--N 1.283 -2.301 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.87 179.749 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 75' ' ' LEU . . . . . 0.441 ' H ' ' HG3' ' S' ' 74' ' ' GLU . 1.7 tm? -112.99 -15.98 12.75 Favored 'General case' 0 N--CA 1.491 1.601 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 76' ' ' GLY . . . . . . . . . . . . . . . -46.8 -59.86 5.24 Favored Glycine 0 N--CA 1.479 1.526 0 C-N-CA 119.307 -1.425 . . . . 0.0 109.834 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 77' ' ' ALA . . . . . . . . . . . . . . . -167.0 -32.92 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 117.443 -1.703 . . . . 0.0 114.714 179.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.62 134.74 6.75 Favored Glycine 0 N--CA 1.501 2.968 0 N-CA-C 106.717 -2.553 . . . . 0.0 106.717 -179.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 79' ' ' ILE . . . . . 0.564 ' O ' ' N ' ' S' ' 81' ' ' THR . 0.0 OUTLIER -56.97 -34.96 45.81 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 C-N-CA 118.397 -1.321 . . . . 0.0 112.95 -179.417 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 80' ' ' ALA . . . . . 0.495 ' C ' ' O ' ' S' ' 79' ' ' ILE . . . -35.3 -31.08 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.395 0 C-N-CA 119.366 -0.934 . . . . 0.0 109.378 -179.865 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 81' ' ' THR . . . . . 0.564 ' N ' ' O ' ' S' ' 79' ' ' ILE . 0.2 OUTLIER -78.16 -60.39 2.39 Favored 'General case' 0 C--N 1.299 -1.601 0 CA-C-N 114.299 -1.318 . . . . 0.0 111.344 179.683 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 82' ' ' ILE . . . . . 0.405 ' H ' HG23 ' S' ' 82' ' ' ILE . 1.5 pt -63.62 -10.91 7.71 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.239 0 N-CA-C 114.084 1.142 . . . . 0.0 114.084 -179.783 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 83' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -74.66 -51.02 15.52 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 117.2 -1.8 . . . . 0.0 109.549 179.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 84' ' ' ARG . . . . . 0.419 ' O ' ' C ' ' S' ' 85' ' ' GLY . 1.8 mpt_? -48.93 -70.88 0.08 Allowed 'General case' 0 C--N 1.303 -1.43 0 CA-C-O 122.027 0.918 . . . . 0.0 110.669 179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 85' ' ' GLY . . . . . 0.419 ' C ' ' O ' ' S' ' 84' ' ' ARG . . . -20.11 -55.84 0.01 OUTLIER Glycine 0 N--CA 1.487 2.073 0 CA-C-N 113.017 -1.901 . . . . 0.0 114.346 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 86' ' ' SER . . . . . 0.572 ' C ' ' H ' ' S' ' 88' ' ' SER . 0.0 OUTLIER -86.39 -61.83 1.65 Allowed 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 118.215 -1.394 . . . . 0.0 112.905 -179.776 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 87' ' ' ASN . . . . . . . . . . . . . 24.5 m120 -56.73 5.6 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 120.012 -0.675 . . . . 0.0 112.235 -179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 88' ' ' SER . . . . . 0.572 ' H ' ' C ' ' S' ' 86' ' ' SER . 0.3 OUTLIER -52.61 -36.33 56.1 Favored 'General case' 0 N--CA 1.49 1.532 0 C-N-CA 119.466 -0.894 . . . . 0.0 111.849 -179.992 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 89' ' ' LEU . . . . . 0.914 ' H ' HD12 ' S' ' 89' ' ' LEU . 2.4 mp -75.46 -54.21 7.41 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 118.957 -1.097 . . . . 0.0 110.872 -179.852 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 90' ' ' LYS . . . . . 0.464 ' O ' ' C ' ' S' ' 91' ' ' ALA . 23.8 mttt -45.28 -64.05 0.8 Allowed 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.462 -0.79 . . . . 0.0 112.67 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 91' ' ' ALA . . . . . 0.5 ' O ' ' HB2' ' S' ' 92' ' ' ALA . . . -23.76 -66.76 0.04 OUTLIER 'General case' 0 C--N 1.3 -1.578 0 CA-C-N 113.676 -1.602 . . . . 0.0 112.914 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 92' ' ' ALA . . . . . 0.675 ' HB3' ' HD3' ' S' ' 93' ' ' PRO . . . 178.39 -51.81 0.0 OUTLIER Pre-proline 0 N--CA 1.489 1.52 0 C-N-CA 118.792 -1.163 . . . . 0.0 113.181 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 93' ' ' PRO . . . . . 0.675 ' HD3' ' HB3' ' S' ' 92' ' ' ALA . 5.6 Cg_exo -58.36 97.51 0.09 OUTLIER 'Trans proline' 0 C--N 1.322 -0.829 0 C-N-CA 120.66 0.906 . . . . 0.0 111.807 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 94' ' ' VAL . . . . . 0.457 ' O ' HG12 ' S' ' 94' ' ' VAL . 28.8 t -110.86 -12.4 11.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.478 0 CA-C-N 115.483 -0.781 . . . . 0.0 110.546 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 95' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -78.14 -28.81 48.52 Favored 'General case' 0 N--CA 1.488 1.451 0 C-N-CA 119.634 -0.827 . . . . 0.0 111.209 -179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 96' ' ' LEU . . . . . 0.434 HD22 HD21 ' R' ' 38' ' ' LEU . 71.3 mt -46.55 -33.3 4.0 Favored 'General case' 0 C--N 1.304 -1.41 0 C-N-CA 119.175 -1.01 . . . . 0.0 110.719 -179.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.76 -36.95 85.57 Favored 'General case' 0 N--CA 1.487 1.415 0 C-N-CA 119.316 -0.954 . . . . 0.0 110.771 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 98' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -65.31 -31.34 72.42 Favored 'General case' 0 N--CA 1.487 1.414 0 C-N-CA 119.44 -0.904 . . . . 0.0 110.659 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 99' ' ' TRP . . . . . 0.541 ' CZ3' HG21 ' S' ' 103' ' ' VAL . 14.2 t90 -86.8 -58.73 2.49 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.988 -179.962 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 100' ' ' LEU . . . . . 0.519 ' O ' ' C ' ' S' ' 101' ' ' GLU . 1.8 mm? -36.72 -38.29 0.17 Allowed 'General case' 0 C--N 1.302 -1.479 0 C-N-CA 119.352 -0.939 . . . . 0.0 112.929 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 101' ' ' GLU . . . . . 0.519 ' C ' ' O ' ' S' ' 100' ' ' LEU . 3.8 mt-10 -41.43 -44.82 2.97 Favored 'General case' 0 C--N 1.298 -1.646 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 102' ' ' GLU . . . . . 0.423 ' N ' ' O ' ' S' ' 99' ' ' TRP . 1.8 tt0 -75.8 -33.77 60.15 Favored 'General case' 0 C--N 1.301 -1.531 0 CA-C-N 113.493 -1.685 . . . . 0.0 111.49 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 103' ' ' VAL . . . . . 0.541 HG21 ' CZ3' ' S' ' 99' ' ' TRP . 3.6 t -85.16 -52.63 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.138 0 C-N-CA 116.881 -1.928 . . . . 0.0 111.707 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' S' S ' 104' ' ' LEU . . . . . 0.43 ' N ' ' O ' ' S' ' 100' ' ' LEU . 0.9 OUTLIER -56.54 -57.3 12.94 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 119.306 -0.958 . . . . 0.0 111.935 179.923 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' S' S ' 105' ' ' LEU . . . . . . . . . . . . . 95.1 mt -51.13 -68.11 0.2 Allowed 'General case' 0 N--CA 1.492 1.674 0 C-N-CA 118.445 -1.302 . . . . 0.0 110.473 -179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 106' ' ' LYS . . . . . . . . . . . . . 18.3 mttp -44.85 -56.86 4.16 Favored 'General case' 0 C--N 1.302 -1.458 0 C-N-CA 119.371 -0.932 . . . . 0.0 110.651 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' S' S ' 107' ' ' SER . . . . . . . . . . . . . 48.1 t . . . . . 0 N--CA 1.486 1.341 0 CA-C-O 116.399 -1.762 . . . . 0.0 110.848 179.99 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' R' R ' 1' ' ' TRP . . . . . 0.546 ' N ' ' O ' ' S' ' 40' ' ' ASN . 0.6 OUTLIER . . . . . 0 N--CA 1.485 1.286 0 CA-C-O 116.37 -1.776 . . . . 0.0 110.175 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' R' R ' 109' ' ' TRP . . . . . 0.532 ' N ' ' O ' ' R' ' 40' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.484 1.226 0 CA-C-O 116.319 -1.8 . . . . 0.0 110.615 . . . . . . . . . 2 2 . 1 stop_ save_