data_2mjm_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 2mjm _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 42.8 tpp . . . . . 0 C--O 1.222 -0.368 0 CA-C-O 122.065 0.936 . . . . 73.2 108.98 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -74.8 24.85 0.09 Allowed 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 114.338 1.236 . . . . 75.41 114.338 -174.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.417 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.2 -15.1 59.63 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 122.411 1.1 . . . . 63.41 109.588 178.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.437 ' CB ' ' HB2' ' A' ' 96' ' ' SER . 1.1 pt-20 -65.35 -41.71 93.57 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 113.808 -1.542 . . . . 75.03 111.52 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.2 m -74.89 -17.23 60.61 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.448 -0.797 . . . . 70.43 109.857 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.9 mm -87.48 -50.67 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-O 122.138 0.971 . . . . 72.35 108.887 -176.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.3 mmt180 -84.72 6.7 23.2 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.911 -1.495 . . . . 72.13 113.148 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -44.14 122.53 2.96 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 124.902 1.281 . . . . 71.55 112.798 -177.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -162.86 150.73 13.73 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 104.559 -2.385 . . . . 71.32 104.559 176.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . 0.28 21.8 p30 -145.72 -44.5 0.21 Allowed 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 115.562 1.69 . . . . 73.24 115.562 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.52 -46.32 90.47 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 119.201 0.91 . . . . 71.32 111.833 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -67.29 -44.23 79.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.985 -0.552 . . . . 74.03 109.832 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.5 mt -66.07 -39.54 90.16 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.375 -0.829 . . . . 74.35 111.58 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 73.0 t-105 -65.42 -43.84 89.29 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 110.274 -0.269 . . . . 75.35 110.274 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.98 -44.36 96.25 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 120.863 0.363 . . . . 72.34 110.666 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 17.9 t-105 -60.45 -48.59 81.1 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.587 -0.733 . . . . 75.31 110.583 175.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.416 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 33.9 tp -58.4 -53.04 62.81 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.675 -0.693 . . . . 73.4 109.862 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -53.85 -46.09 63.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 123.528 0.731 . . . . 71.41 112.441 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.481 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 3.9 mmp_? -72.4 -43.39 63.97 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 120.18 -0.608 . . . . 72.53 112.396 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -68.21 -42.34 80.0 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.047 0.451 . . . . 74.43 109.81 -176.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.468 HD13 HD22 ' A' ' 33' ' ' LEU . 1.2 mt -68.56 -25.75 65.06 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 122.854 0.461 . . . . 72.42 110.936 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.4 t -71.56 -18.53 62.24 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 108.99 -0.744 . . . . 75.32 108.99 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.32 -2.29 52.44 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 121.725 0.774 . . . . 74.44 109.489 178.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.438 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.4 m-80 -137.92 50.21 3.11 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.165 -0.925 . . . . 73.11 111.78 -177.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.438 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.2 Cg_exo -65.62 -23.98 56.13 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 121.604 1.536 . . . . 65.2 109.197 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -66.1 -39.58 90.09 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 112.997 -1.911 . . . . 71.33 111.095 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.499 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 84.4 t90 -76.06 -44.73 37.64 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.492 -1.299 . . . . 75.24 107.492 -175.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.641 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 3.5 mm? -53.4 -56.96 12.51 Favored 'General case' 0 N--CA 1.407 -2.601 0 CA-C-N 113.015 -1.902 . . . . 74.33 113.61 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.461 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 3.4 p -53.74 -44.64 70.11 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.927 0.767 . . . . 63.31 111.133 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.92 72.23 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.673 1.589 . . . . 70.13 111.22 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.499 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.1 mmmt -69.28 -35.79 76.41 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-N 115.956 -0.565 . . . . 74.31 111.691 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 97.2 mt -60.61 -30.97 70.18 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 123.09 0.244 . . . . 71.34 110.817 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 34' ' ' SER . 10.3 mtp180 -66.85 -26.75 67.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.328 0.585 . . . . 73.55 111.906 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -78.4 -38.01 42.65 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.716 -0.674 . . . . 74.52 109.434 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.493 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 86.5 m-85 -80.31 -59.47 2.69 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.676 -0.693 . . . . 75.1 111.404 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.491 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.1 mm? -89.33 110.89 42.04 Favored Pre-proline 0 N--CA 1.432 -1.35 0 N-CA-C 109.269 -0.641 . . . . 75.24 109.269 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -70.85 -19.65 30.64 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.218 1.945 . . . . 73.23 111.851 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 p -114.13 28.58 8.65 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.086 -0.961 . . . . 72.21 109.935 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.851 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -43.33 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.941 1.4 . . . . 75.23 112.351 -175.432 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.09 60.06 4.71 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-O 123.088 1.423 . . . . 71.24 108.368 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.851 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.4 pp -81.03 -9.78 59.79 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.23 -1.805 . . . . 71.44 110.799 -176.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.25 -14.16 60.14 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.743 -1.117 . . . . 74.23 110.218 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.4 t -85.87 103.79 14.94 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 115.348 -0.842 . . . . 74.5 108.861 178.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.1 t -142.13 81.56 1.76 Allowed 'General case' 0 N--CA 1.428 -1.563 0 N-CA-C 107.878 -1.156 . . . . 74.25 107.878 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -39.58 94.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.84 -1.073 . . . . 73.22 111.743 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.25 155.85 53.26 Favored Pre-proline 0 N--CA 1.383 -3.819 0 CA-C-N 113.346 -1.752 . . . . 74.31 106.918 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.418 ' HB2' ' H ' ' A' ' 53' ' ' SER . 32.4 Cg_endo -64.16 -145.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.558 1.677 0 C-N-CA 124.013 3.142 . . . . 53.21 112.164 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.418 ' H ' ' HB2' ' A' ' 52' ' ' PRO . 25.0 m -74.73 38.37 0.12 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 123.864 0.866 . . . . 63.13 113.28 -175.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -62.08 149.52 86.18 Favored Pre-proline 0 N--CA 1.435 -1.196 0 C-N-CA 124.417 1.087 . . . . 74.23 110.544 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.45 -46.83 24.85 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 123.613 2.876 . . . . 73.21 113.703 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -74.34 -23.77 59.08 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.866 0.691 . . . . 74.22 112.866 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.436 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 87.0 t -72.7 -39.51 60.39 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 N-CA-C 108.289 -1.004 . . . . 75.23 108.289 177.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.11 -48.01 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 108.136 -1.061 . . . . 72.14 108.136 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 23.5 t-160 -52.03 -43.12 63.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.93 0.892 . . . . 74.33 110.708 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 65.2 ttt-85 -54.73 -41.37 70.29 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.084 0.953 . . . . 74.23 111.897 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.8 mt-30 -73.31 -39.45 65.3 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 115.225 -0.898 . . . . 71.24 110.509 -175.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -75.29 -31.09 60.59 Favored 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 114.603 -1.18 . . . . 74.12 110.883 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -53.89 -47.03 71.52 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.691 1.196 . . . . 73.22 110.602 175.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.491 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 32.2 mmt-85 -53.84 -36.62 62.76 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 113.659 -1.61 . . . . 74.21 111.888 178.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.3 mt -72.05 -36.68 69.67 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.95 0.405 . . . . 63.43 111.051 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.43 -25.21 66.64 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.392 -0.822 . . . . 75.3 109.086 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -31.27 59.91 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.431 -0.804 . . . . 72.15 110.832 176.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.28 -57.17 5.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-O 121.436 0.636 . . . . 74.33 109.869 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -172.55 141.66 6.37 Favored Glycine 0 CA--C 1.466 -2.987 0 CA-C-N 115.122 -0.944 . . . . 73.22 111.387 -174.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 1.9 mpt? -70.45 -30.67 67.57 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.318 -1.734 . . . . 74.4 106.318 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.93 -29.01 58.19 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 113.437 -1.71 . . . . 74.41 108.11 176.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.3 m -70.47 -34.03 71.94 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.241 -0.89 . . . . 74.51 109.421 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.547 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 69.7 t-105 -63.67 -46.89 83.51 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.198 -0.668 . . . . 73.11 109.198 175.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 70' ' ' MET . 82.8 mttt -58.56 -36.0 73.24 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 115.968 -0.56 . . . . 75.32 111.521 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.418 ' O ' ' HB3' ' A' ' 78' ' ' ASN . 49.0 m -72.7 -47.22 48.97 Favored 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 123.147 0.579 . . . . 73.33 110.953 177.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.493 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 81.4 t80 -55.79 -50.44 70.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 123.328 0.651 . . . . 74.05 111.73 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.474 HG22 ' HB2' ' A' ' 94' ' ' LEU . 41.0 mm -62.87 -30.75 50.26 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.944 -0.571 . . . . 72.15 111.19 -176.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.418 ' HB3' ' O ' ' A' ' 75' ' ' SER . 3.6 t-20 -58.86 -46.51 87.58 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 109.422 -0.584 . . . . 72.13 109.422 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -73.16 -39.65 65.48 Favored 'General case' 0 C--O 1.198 -1.646 0 CA-C-N 115.487 -0.778 . . . . 70.32 110.445 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.434 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.3 tm? -50.33 -53.87 25.72 Favored 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 124.776 1.23 . . . . 74.51 109.249 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.98 -36.53 84.69 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.893 -0.594 . . . . 72.23 111.266 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -73.36 -54.2 8.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.98 0.419 . . . . 64.33 111.658 -176.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -74.98 -24.02 58.37 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.641 -0.709 . . . . 73.54 112.298 -172.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 85.4 mt -91.22 4.51 52.1 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.31 -0.556 . . . . 74.2 112.014 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 72.12 -46.84 0.65 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 114.221 1.193 . . . . 50.05 114.221 174.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 47.3 t -56.88 126.68 73.04 Favored Pre-proline 0 C--N 1.315 -0.909 0 C-N-CA 124.488 1.115 . . . . 73.42 112.864 -175.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -86.75 102.09 0.58 Allowed 'Trans proline' 0 N--CA 1.44 -1.64 0 C-N-CA 122.466 2.111 . . . . 63.25 110.426 173.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 mp -69.81 -53.15 19.55 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.211 -0.449 . . . . 72.21 109.84 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.1 t70 173.96 -50.77 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.557 1.143 . . . . 63.4 107.968 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.9 ttt -177.47 153.12 0.88 Allowed 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 104.89 -2.263 . . . . 65.13 104.89 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.538 ' O ' HG11 ' A' ' 95' ' ' VAL . 1.1 pm0 -71.46 -42.37 68.23 Favored 'General case' 0 C--O 1.206 -1.216 0 CA-C-N 118.696 0.68 . . . . 73.32 112.342 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.625 ' O ' HG22 ' A' ' 95' ' ' VAL . 35.1 mm -54.23 -39.39 74.22 Favored Pre-proline 0 CA--C 1.594 2.66 0 C-N-CA 125.486 1.514 . . . . 74.3 114.118 -175.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -52.3 -41.8 64.12 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 122.126 1.884 . . . . 72.14 111.035 170.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.474 ' HB2' HG22 ' A' ' 77' ' ' ILE . 3.7 mm? -76.29 -25.03 54.45 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.756 -1.111 . . . . 75.22 110.128 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.625 HG22 ' O ' ' A' ' 92' ' ' ILE . 4.6 m -74.62 -29.02 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-O 122.43 1.11 . . . . 74.42 110.789 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.437 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . 6.0 t -81.76 1.18 35.73 Favored 'General case' 0 C--N 1.275 -2.631 0 CA-C-N 113.846 -1.524 . . . . 64.52 111.476 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 18.2 tt -57.38 -30.84 36.77 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 N-CA-C 112.981 0.734 . . . . 73.43 112.981 -173.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 24.5 p-90 . . . . . 0 C--N 1.318 -0.77 0 N-CA-C 112.362 0.504 . . . . 74.31 112.362 -177.697 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 C--O 1.213 -0.826 0 N-CA-C 112.227 0.455 . . . . 74.34 112.227 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -104.24 23.5 12.99 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 120.919 0.39 . . . . 72.43 110.08 174.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.433 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.95 -17.58 57.04 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.812 1.292 . . . . 73.22 108.857 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.419 ' HB2' ' HB2' ' A' ' 96' ' ' SER . 0.8 OUTLIER -59.17 -45.65 90.44 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 113.178 -1.828 . . . . 74.51 114.088 -177.745 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 65.0 m -76.22 -16.49 59.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.311 0.577 . . . . 73.31 110.663 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.0 mm -82.47 -44.26 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 121.937 0.875 . . . . 65.14 108.938 -176.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -102.19 7.27 40.92 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.678 -1.146 . . . . 75.54 111.984 -175.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -35.21 122.31 0.58 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 126.279 1.831 . . . . 61.42 115.028 -172.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -145.2 151.6 38.67 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.479 -2.786 . . . . 74.22 103.479 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -128.7 -72.58 0.6 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 118.636 0.653 . . . . 72.43 112.244 -174.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.2 -38.21 90.26 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.32 0.859 . . . . 73.41 113.32 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -66.29 -37.84 86.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-O 121.886 0.85 . . . . 74.53 110.542 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.4 mt -75.32 -40.79 58.09 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.639 -1.164 . . . . 73.51 110.238 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 44.5 t-105 -64.39 -42.07 96.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 75.4 110.49 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.88 93.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.355 -0.384 . . . . 74.42 110.689 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -60.89 -50.55 72.95 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.685 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.82 -53.04 62.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.505 -0.77 . . . . 74.23 109.287 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.32 -42.4 95.29 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 115.583 -0.735 . . . . 72.12 112.774 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 20.4 tpt180 -72.62 -41.68 65.28 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 121.93 -0.482 . . . . 74.21 111.411 -177.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.451 HD12 HD13 ' A' ' 84' ' ' LEU . 2.0 tm? -69.78 -40.89 75.78 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.601 -0.518 . . . . 74.42 109.601 -176.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.9 mt -69.36 -25.13 64.03 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 112.398 0.518 . . . . 74.32 112.398 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -67.58 -19.67 65.28 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.677 -0.86 . . . . 74.1 108.677 175.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 35.3 mtmt -99.03 -2.1 38.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.635 -0.712 . . . . 65.24 109.491 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.42 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.2 m-80 -145.49 52.85 1.7 Allowed Pre-proline 0 C--O 1.243 0.74 0 N-CA-C 112.717 0.636 . . . . 75.44 112.717 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.42 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 15.8 Cg_exo -68.16 -22.83 40.2 Favored 'Trans proline' 0 C--N 1.356 0.926 0 N-CA-C 108.864 -1.245 . . . . 74.23 108.864 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.64 -43.63 88.85 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 113.477 -1.692 . . . . 65.14 110.583 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.579 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.4 t90 -71.6 -43.18 66.71 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 108.832 -0.803 . . . . 75.44 108.832 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.618 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.6 tm? -58.28 -44.81 88.64 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 114.395 -1.275 . . . . 75.12 109.053 -176.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.0 m -60.17 -48.54 81.31 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.358 -0.383 . . . . 75.33 111.249 176.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -39.6 70.65 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.742 0.817 . . . . 74.21 111.785 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.579 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.0 mmmt -75.57 -35.95 60.51 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 121.048 -0.261 . . . . 75.53 111.217 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 66.3 mt -58.76 -30.34 67.44 Favored 'General case' 0 C--O 1.203 -1.392 0 N-CA-C 110.466 -0.198 . . . . 74.14 110.466 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.462 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 88.5 mtt180 -58.55 -26.56 63.69 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 123.259 0.35 . . . . 60.54 111.624 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.3 t -88.42 -50.15 6.49 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 109.641 -0.503 . . . . 74.14 109.641 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.453 ' CD1' HG23 ' A' ' 72' ' ' THR . 75.5 m-85 -70.05 -46.06 65.77 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.476 0.917 . . . . 74.52 113.476 -175.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.3 mp -87.7 113.47 54.57 Favored Pre-proline 0 C--N 1.312 -1.062 0 C-N-CA 123.993 0.917 . . . . 73.03 110.056 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -61.81 -29.9 83.61 Favored 'Trans proline' 0 N--CA 1.482 0.813 0 C-N-CA 123.712 2.941 . . . . 71.14 114.155 -174.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.1 p -112.55 7.04 18.76 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.39 0.614 . . . . 61.22 110.308 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.462 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 26.5 mtt 41.7 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 127.312 2.245 . . . . 73.35 112.188 -172.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -98.11 59.54 1.39 Allowed 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.406 -1.331 . . . . 73.42 107.406 176.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -96.34 -11.47 25.79 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.657 -1.611 . . . . 73.33 111.78 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -80.45 37.61 0.4 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 124.436 1.094 . . . . 73.1 111.87 -175.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.6 m -91.85 -0.34 57.51 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.804 -0.635 . . . . 72.44 111.495 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 72.7 m -91.44 64.65 5.11 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.454 0.645 . . . . 73.02 112.23 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.41 -32.47 29.08 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 122.67 1.224 . . . . 73.44 109.557 173.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.447 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 44.6 mt-10 -93.76 172.8 5.4 Favored Pre-proline 0 C--N 1.264 -3.126 0 CA-C-N 112.487 -2.142 . . . . 55.53 106.574 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 39.8 Cg_endo -66.45 -169.87 0.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 121.27 1.314 . . . . 63.45 111.85 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.0 m -78.18 38.55 0.29 Allowed 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 123.488 0.715 . . . . 64.05 112.248 -175.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.466 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 96.1 m-20 -57.65 149.72 50.37 Favored Pre-proline 0 N--CA 1.438 -1.067 0 C-N-CA 123.984 0.914 . . . . 73.44 111.931 -177.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -44.79 -51.86 6.85 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 124.144 3.23 . . . . 72.33 113.011 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -73.22 -26.27 61.07 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 113.416 0.895 . . . . 64.34 113.416 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.505 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 72.2 t -65.65 -38.64 82.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 108.575 -0.898 . . . . 74.02 108.575 175.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.9 mm -70.53 -50.21 46.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 115.478 -0.783 . . . . 74.5 109.812 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -52.73 -39.99 62.64 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.241 1.017 . . . . 74.35 110.953 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -57.57 -40.62 79.35 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 125.079 1.352 . . . . 73.02 111.856 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 58.9 mt-30 -76.12 -39.46 55.1 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.657 -0.702 . . . . 75.01 110.602 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.46 -30.66 71.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 114.933 -1.031 . . . . 72.42 111.26 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.413 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 47.4 t30 -55.58 -34.37 64.74 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.834 1.254 . . . . 73.31 111.165 177.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -63.32 -30.16 71.34 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.644 -0.707 . . . . 75.11 111.969 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.0 mt -73.09 -31.89 64.64 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.086 0.469 . . . . 73.43 110.212 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.468 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 70.9 t80 -61.92 -29.83 70.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.294 -0.866 . . . . 73.55 109.117 177.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.21 -21.52 36.37 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 114.868 -1.06 . . . . 75.42 111.781 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -82.37 -47.18 12.62 Favored 'General case' 0 N--CA 1.419 -2.021 0 O-C-N 122.148 -0.345 . . . . 75.33 111.389 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.66 142.86 4.2 Favored Glycine 0 CA--C 1.473 -2.586 0 C-N-CA 120.275 -0.964 . . . . 62.45 112.56 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.522 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.64 -31.18 68.03 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 106.95 -1.5 . . . . 72.35 106.95 170.492 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.5 64.05 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.595 -1.184 . . . . 64.4 108.264 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.453 HG23 ' CD1' ' A' ' 40' ' ' PHE . 96.1 m -58.1 -40.61 81.6 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.084 -0.962 . . . . 64.03 110.217 176.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.411 ' HE1' HG22 ' A' ' 97' ' ' ILE . 65.4 t-105 -61.65 -46.89 87.85 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.97 -0.559 . . . . 73.04 109.906 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 70' ' ' MET . 34.7 mtmt -60.79 -42.79 98.25 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.549 -0.296 . . . . 75.34 111.359 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.4 m -66.06 -42.24 89.74 Favored 'General case' 0 N--CA 1.412 -2.36 0 C-N-CA 123.04 0.536 . . . . 74.24 111.128 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.428 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 79.0 t80 -61.49 -51.25 69.42 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.518 -0.765 . . . . 74.01 111.574 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.491 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 41.9 mm -61.7 -33.28 56.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.303 -0.408 . . . . 74.13 111.878 -175.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.57 -45.2 94.0 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.127 -0.694 . . . . 74.02 109.127 176.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.446 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 85.2 m-20 -68.1 -40.15 82.66 Favored 'General case' 0 C--O 1.195 -1.808 0 CA-C-N 115.475 -0.784 . . . . 75.54 110.704 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.491 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 1.5 tm? -50.04 -51.4 42.61 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.039 1.336 . . . . 74.41 108.894 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 72.8 m -67.39 -36.9 82.24 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.95 -1.023 . . . . 65.4 112.187 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -76.59 -40.1 50.54 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 123.398 0.679 . . . . 75.51 112.209 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 38.8 mt-10 -85.75 -29.25 24.01 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.773 1.027 . . . . 74.14 113.773 -172.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.451 HD13 HD12 ' A' ' 25' ' ' LEU . 95.8 mt -90.81 -28.26 18.33 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 113.706 1.002 . . . . 75.22 113.706 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -148.34 -169.58 3.38 Favored 'General case' 0 C--N 1.283 -2.284 0 N-CA-C 104.602 -2.37 . . . . 75.1 104.602 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.0 m -82.17 134.17 49.58 Favored Pre-proline 0 C--N 1.283 -2.284 0 N-CA-C 107.421 -1.326 . . . . 74.42 107.421 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -22.93 100.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 1 C-N-CA 126.096 4.53 . . . . 74.32 114.171 -174.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.8 mt -64.16 -34.26 77.66 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 115.257 -0.883 . . . . 74.33 110.48 -176.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.3 t70 58.19 37.13 26.22 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 123.126 1.441 . . . . 74.25 110.889 173.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -143.46 32.35 1.32 Allowed 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.712 -1.588 . . . . 73.21 106.712 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.579 ' O ' HG11 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -70.69 -39.76 73.3 Favored 'General case' 0 C--O 1.192 -1.938 0 CA-C-N 114.38 -1.282 . . . . 73.44 112.971 -174.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.493 ' O ' HG23 ' A' ' 95' ' ' VAL . 44.5 mm -55.74 -45.73 99.84 Favored Pre-proline 0 CA--C 1.574 1.886 0 C-N-CA 123.783 0.833 . . . . 72.15 112.107 -175.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -50.95 -37.53 56.53 Favored 'Trans proline' 0 CA--C 1.555 1.573 0 C-N-CA 121.921 1.747 . . . . 74.44 111.566 171.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.417 ' HB2' HG21 ' A' ' 77' ' ' ILE . 4.3 mm? -76.68 -31.69 57.43 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.838 -0.619 . . . . 73.41 110.911 176.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.579 HG11 ' O ' ' A' ' 91' ' ' GLU . 6.5 m -66.54 -29.47 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.301 0 CA-C-O 122.566 1.174 . . . . 73.1 110.815 -177.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.419 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 31.3 t -75.47 -16.23 60.34 Favored 'General case' 0 C--N 1.27 -2.88 0 CA-C-N 113.379 -1.737 . . . . 72.44 113.077 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.411 HG22 ' HE1' ' A' ' 73' ' ' TRP . 10.7 tt -72.38 -5.28 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 CA-C-O 121.362 0.601 . . . . 72.14 111.617 -172.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.468 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 47.2 t90 . . . . . 0 C--N 1.319 -0.759 0 C-N-CA 125.166 1.386 . . . . 71.03 110.4 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.1 ttt . . . . . 0 CA--C 1.505 -0.783 0 CA-C-O 123.511 1.624 . . . . 73.11 111.067 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.513 ' O ' HD12 ' A' ' 11' ' ' ILE . 10.2 m-20 -141.82 24.25 2.04 Favored 'General case' 0 C--N 1.273 -2.75 0 CA-C-N 111.596 -2.547 . . . . 63.14 106.099 173.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.466 ' O ' ' HG2' ' A' ' 12' ' ' ARG . . . -74.41 -34.75 63.34 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-N 113.852 -1.522 . . . . 74.1 107.641 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HB3' HG22 ' A' ' 92' ' ' ILE . 1.7 pm0 -51.47 -45.35 62.72 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 113.68 -1.6 . . . . 74.14 112.093 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.4 m -56.62 -40.6 75.66 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.362 1.065 . . . . 71.34 111.051 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.513 HD12 ' O ' ' A' ' 7' ' ' ASP . 1.2 mp -83.92 -43.21 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.024 0 CA-C-N 113.958 -1.474 . . . . 73.22 111.022 -175.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 35.9 mmt180 -69.1 -65.52 0.7 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 116.032 1.864 . . . . 74.43 116.032 -170.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.521 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 2.5 tm? -176.45 141.1 0.39 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.114 0.87 . . . . 61.54 110.991 -172.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.453 ' N ' HD11 ' A' ' 13' ' ' LEU . 6.7 p30 -153.65 138.0 16.67 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 106.593 -1.632 . . . . 64.11 106.593 168.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -152.63 153.13 32.72 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.379 -0.528 . . . . 73.34 110.581 -175.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.4 -30.56 71.29 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.112 0.965 . . . . 72.32 112.073 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -65.7 -26.03 67.58 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.142 0.496 . . . . 74.14 111.692 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.81 -35.61 64.9 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.782 -0.821 . . . . 75.33 108.782 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.463 ' HB2' ' CD1' ' A' ' 97' ' ' ILE . 77.0 t-105 -65.38 -45.38 84.28 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.423 -0.808 . . . . 73.24 109.086 177.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.68 87.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 74.41 110.992 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -59.93 -50.83 72.22 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.848 0.717 . . . . 73.01 110.715 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.14 -51.43 70.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.514 -0.767 . . . . 75.41 110.075 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.2 t -60.14 -42.8 91.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.514 -0.767 . . . . 74.11 112.018 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.43 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -69.45 -45.89 67.99 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.322 -0.622 . . . . 74.11 109.322 -176.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -65.93 -42.32 90.24 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.534 -0.543 . . . . 74.04 109.534 -177.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.6 mt -72.5 -25.49 61.42 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 112.942 0.719 . . . . 74.01 112.942 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 42.6 t -68.03 -20.14 64.96 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.336 -0.987 . . . . 75.55 108.336 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.43 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.2 mtmt -92.78 -7.22 47.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.666 -0.697 . . . . 75.31 109.955 177.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.432 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 43.7 m-80 -136.74 54.13 8.43 Favored Pre-proline 0 C--O 1.243 0.724 0 CA-C-N 115.986 -0.552 . . . . 72.44 112.162 -174.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.432 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.4 Cg_exo -68.84 -23.71 34.95 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.309 1.339 . . . . 72.55 109.081 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.7 -44.61 95.78 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 113.93 -1.486 . . . . 75.23 109.637 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.599 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.4 t90 -74.57 -45.13 47.38 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 121.453 0.644 . . . . 74.35 109.967 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -60.21 -45.31 93.61 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.738 -1.119 . . . . 74.21 110.687 -174.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.7 m -57.39 -46.53 83.34 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 123.236 0.335 . . . . 64.25 111.19 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.94 -40.54 80.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.287 1.035 . . . . 74.35 111.573 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.599 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.6 mmmt -73.94 -29.96 62.3 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 120.822 -0.351 . . . . 75.55 111.876 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.2 mt -62.66 -30.27 71.25 Favored 'General case' 0 C--O 1.2 -1.552 0 N-CA-C 109.71 -0.478 . . . . 74.33 109.71 173.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.489 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 70.8 mtt180 -62.87 -31.13 72.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.947 0.403 . . . . 74.14 111.395 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 t -85.28 -39.04 18.17 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.34 0.591 . . . . 75.22 110.826 -179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.569 ' CD1' HG21 ' A' ' 72' ' ' THR . 65.0 m-85 -84.65 -46.45 11.49 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.175 0.806 . . . . 74.41 113.175 -176.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 mp -89.74 119.43 69.46 Favored Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 123.328 0.651 . . . . 74.3 110.489 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.51 -41.49 19.81 Favored 'Trans proline' 0 C--N 1.324 -0.714 0 C-N-CA 122.218 1.945 . . . . 74.14 110.872 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.0 t -86.5 -8.92 57.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.494 -0.775 . . . . 75.01 112.594 -176.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.489 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 12.4 mtt 28.75 91.5 0.01 OUTLIER 'General case' 0 C--O 1.236 0.395 0 C-N-CA 126.632 1.973 . . . . 74.02 112.89 -173.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -99.65 61.62 1.16 Allowed 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 123.263 1.506 . . . . 51.13 110.309 177.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 pp -89.19 -19.64 25.19 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 113.157 -1.838 . . . . 72.45 110.494 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.55 5.39 50.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.305 1.05 . . . . 74.35 108.809 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 41.9 t -85.7 21.8 1.77 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.965 -1.016 . . . . 72.41 109.354 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.6 m -73.14 94.04 1.89 Allowed 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 122.03 0.919 . . . . 73.23 108.899 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -20.45 62.2 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.405 -1.271 . . . . 72.34 113.149 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.513 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 37.9 mt-10 -137.04 170.39 10.89 Favored Pre-proline 0 N--CA 1.38 -3.942 0 N-CA-C 107.307 -1.368 . . . . 75.31 107.307 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.04 -151.43 0.01 OUTLIER 'Trans proline' 0 CA--C 1.562 1.894 0 C-N-CA 123.605 2.87 . . . . 72.02 112.962 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.6 p -75.33 37.18 0.13 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.004 0.922 . . . . 65.22 112.663 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.418 ' O ' ' HB ' ' A' ' 57' ' ' VAL . 78.5 m-20 -71.65 148.69 92.9 Favored Pre-proline 0 N--CA 1.431 -1.399 0 C-N-CA 123.987 0.915 . . . . 74.23 112.591 -176.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -59.88 -34.26 95.53 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.296 2.664 . . . . 73.34 113.132 -177.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -75.19 -23.82 57.73 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.35 0.595 . . . . 73.13 110.996 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.513 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 95.7 t -74.01 -45.26 49.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 108.047 -1.094 . . . . 54.23 108.047 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.41 ' O ' HD23 ' A' ' 62' ' ' LEU . 47.5 mm -58.67 -37.64 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 114.227 -1.351 . . . . 74.1 109.787 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -54.38 -43.74 71.66 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.712 -0.676 . . . . 74.34 111.6 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.503 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 2.0 tpp180 -54.9 -54.46 42.28 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.968 0.907 . . . . 74.41 110.791 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -59.46 -42.59 92.35 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.296 -1.32 . . . . 73.24 111.79 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.446 HD12 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -79.64 -30.85 41.45 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.418 -0.81 . . . . 71.43 111.535 -177.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.503 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 22.7 t-20 -53.42 -48.25 68.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 124.896 1.278 . . . . 71.12 110.177 174.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -55.07 -30.91 60.63 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 113.549 -1.66 . . . . 73.35 112.978 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.1 mt -72.16 -42.47 65.89 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 120.526 0.203 . . . . 71.44 111.283 -178.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.57 ' CD1' ' HB3' ' A' ' 98' ' ' TRP . 55.5 t80 -71.32 -24.95 62.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.638 0.732 . . . . 73.32 109.028 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -28.38 64.58 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.159 -0.928 . . . . 71.14 109.875 175.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.3 mm-40 -74.79 -56.77 4.43 Favored 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 108.217 -1.031 . . . . 71.34 108.217 173.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -168.97 145.84 9.79 Favored Glycine 0 CA--C 1.479 -2.187 0 CA-C-N 115.495 -0.775 . . . . 53.51 112.147 -175.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.499 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 56.7 ttp -68.8 -32.27 71.88 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 105.606 -1.998 . . . . 75.41 105.606 170.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.7 68.32 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.623 -1.626 . . . . 72.22 108.3 176.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.569 HG21 ' CD1' ' A' ' 40' ' ' PHE . 96.8 m -57.36 -40.76 78.78 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.577 -0.738 . . . . 63.23 110.167 175.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.456 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.5 t-105 -61.51 -50.62 71.97 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 110.35 -0.241 . . . . 72.31 110.35 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 70' ' ' MET . 80.6 mttt -55.38 -45.14 76.58 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.111 0.482 . . . . 75.34 111.151 178.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.2 m -66.97 -40.58 87.51 Favored 'General case' 0 N--CA 1.406 -2.658 0 C-N-CA 123.845 0.858 . . . . 74.22 111.495 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.452 ' HZ ' ' CD2' ' A' ' 33' ' ' LEU . 81.9 t80 -61.26 -47.77 84.51 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.876 -0.602 . . . . 75.44 110.903 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 73' ' ' TRP . 49.6 mm -62.7 -33.47 60.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 CA-C-O 121.311 0.577 . . . . 73.43 110.055 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.41 -39.27 94.06 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.376 -0.829 . . . . 64.11 109.184 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -75.33 -42.97 53.14 Favored 'General case' 0 C--O 1.194 -1.817 0 N-CA-C 110.252 -0.277 . . . . 74.34 110.252 178.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -49.86 -53.97 22.39 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 125.495 1.518 . . . . 72.33 109.212 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.464 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 52.7 t -63.31 -35.7 81.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.456 -0.793 . . . . 75.44 111.321 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -76.2 -54.6 6.56 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.183 0.516 . . . . 73.34 111.335 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -71.05 -39.31 72.33 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.539 -0.755 . . . . 73.54 112.627 -172.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.4 mt -82.58 -8.4 59.61 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.397 -0.521 . . . . 73.15 109.912 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 t70 49.86 68.66 0.71 Allowed 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 125.503 1.521 . . . . 73.12 112.86 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.31 116.86 10.32 Favored Pre-proline 0 C--N 1.296 -1.754 0 N-CA-C 105.967 -1.864 . . . . 73.31 105.967 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -69.49 103.74 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 121.768 1.645 . . . . 75.31 109.638 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.464 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 44.1 mt -81.18 -46.98 14.05 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 120.715 -0.394 . . . . 74.22 110.815 -175.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t70 70.13 -45.14 0.58 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 124.756 1.223 . . . . 74.41 110.961 -173.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.419 ' H ' ' C ' ' A' ' 88' ' ' LEU . 25.7 mmt -87.95 40.38 0.94 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 124.453 1.101 . . . . 71.14 110.096 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.623 ' O ' HG11 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -69.19 -46.32 67.74 Favored 'General case' 0 C--O 1.191 -2.006 0 C-N-CA 120.437 -0.505 . . . . 75.12 111.356 -177.144 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.538 ' O ' HG21 ' A' ' 95' ' ' VAL . 33.2 mm -64.49 -43.37 71.2 Favored Pre-proline 0 CA--C 1.567 1.6 0 C-N-CA 124.202 1.001 . . . . 74.33 109.632 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.521 ' HA ' ' O ' ' A' ' 13' ' ' LEU . 65.0 Cg_exo -50.22 -37.16 48.66 Favored 'Trans proline' 0 CA--C 1.565 2.03 0 C-N-CA 121.346 1.364 . . . . 74.11 112.167 167.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.417 ' O ' HG22 ' A' ' 97' ' ' ILE . 3.8 mm? -70.82 -40.46 72.46 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.589 -0.278 . . . . 72.23 110.479 173.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.623 HG11 ' O ' ' A' ' 91' ' ' GLU . 4.4 m -65.1 -33.93 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 CA-C-O 122.629 1.204 . . . . 75.04 110.562 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 23.0 t -64.27 -19.8 65.64 Favored 'General case' 0 C--N 1.28 -2.417 0 CA-C-N 113.467 -1.697 . . . . 65.21 112.701 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.463 ' CD1' ' HB2' ' A' ' 19' ' ' TRP . 13.5 tt -68.24 -26.78 34.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 C-N-CA 120.169 -0.612 . . . . 72.02 111.043 -174.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.57 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . 57.5 m95 . . . . . 0 N--CA 1.42 -1.936 0 CA-C-O 121.796 0.808 . . . . 75.2 110.854 175.41 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.8 tpp . . . . . 0 C--O 1.242 0.66 0 CA-C-O 122.021 0.915 . . . . 75.21 110.326 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -110.99 24.81 12.47 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.034 -0.985 . . . . 73.41 110.203 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.79 -12.7 60.23 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.772 1.272 . . . . 73.02 109.128 175.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.35 71.42 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 113.191 -1.822 . . . . 72.42 112.347 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 60.0 m -59.29 -47.46 85.3 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 122.464 1.126 . . . . 74.53 110.184 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.511 HD11 ' H ' ' A' ' 11' ' ' ILE . 4.2 mp -72.84 -42.08 61.02 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.237 0 CA-C-N 114.177 -1.374 . . . . 74.54 112.426 -175.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 29.2 mmt180 -76.69 -34.07 58.21 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.123 0.416 . . . . 73.43 112.123 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 12' ' ' ARG . 40.2 mt 67.05 171.72 0.26 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.975 1.31 . . . . 72.5 113.595 -175.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -89.23 170.19 10.81 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.568 -0.742 . . . . 73.11 110.079 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.406 ' OD1' ' HB2' ' A' ' 17' ' ' ASN . 22.0 t-20 -159.26 133.59 7.75 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.082 -0.34 . . . . 74.52 110.082 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.49 -32.68 71.71 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.028 0.751 . . . . 74.11 113.028 -176.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . 0.406 ' HB2' ' OD1' ' A' ' 15' ' ' ASN . 16.2 m120 -64.05 -35.45 80.77 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.499 -0.556 . . . . 75.23 109.499 177.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.71 -36.12 81.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 74.23 110.226 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -65.45 -45.51 83.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 73.34 110.089 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.66 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 74.4 110.329 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -56.96 -50.18 73.42 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.674 -0.694 . . . . 73.24 110.2 174.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -53.15 61.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 124.191 0.932 . . . . 73.21 109.307 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.4 t -55.57 -51.61 56.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 111.922 0.341 . . . . 64.21 111.922 -178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -71.97 -34.18 68.74 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 112.483 0.549 . . . . 75.23 112.483 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -73.79 -46.47 45.27 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.048 -1.093 . . . . 54.1 108.048 -176.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.468 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -65.95 -25.18 67.0 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 123.905 0.882 . . . . 75.13 110.439 -179.207 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.1 m -64.2 -17.61 63.71 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.224 0.535 . . . . 72.24 110.246 174.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.442 ' C ' ' HD3' ' A' ' 30' ' ' PRO . 30.1 mtmt -100.78 0.97 39.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.227 -0.657 . . . . 75.51 109.227 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.468 ' OD1' ' HA ' ' A' ' 26' ' ' LEU . 5.2 m120 -125.19 45.75 1.47 Allowed Pre-proline 0 CA--C 1.547 0.855 0 CA-C-N 115.629 -0.714 . . . . 70.32 110.315 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.446 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 2.8 Cg_endo -71.3 -20.61 27.71 Favored 'Trans proline' 0 C--N 1.355 0.89 0 CA-C-N 121.321 1.508 . . . . 73.32 110.484 -173.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -75.83 -42.53 49.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.264 -1.335 . . . . 74.52 109.247 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.588 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.8 t90 -75.96 -47.75 23.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.735 -0.666 . . . . 72.33 111.1 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -56.71 -49.23 75.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.81 -1.087 . . . . 74.51 111.064 -173.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.588 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.5 p -54.44 -49.11 70.79 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 123.56 0.537 . . . . 75.22 111.522 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.47 -45.88 66.3 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.837 1.255 . . . . 73.11 112.501 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.588 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.8 mmmt -71.1 -30.25 66.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.567 0.222 . . . . 72.44 110.595 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 87.4 mt -66.91 -35.62 80.41 Favored 'General case' 0 C--O 1.202 -1.437 0 N-CA-C 109.776 -0.453 . . . . 65.31 109.776 174.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -60.45 -33.77 73.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.977 0.894 . . . . 64.14 109.825 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 59.6 m -74.32 -50.69 17.77 Favored 'General case' 0 N--CA 1.394 -3.267 0 C-N-CA 125.222 1.409 . . . . 72.53 112.626 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.562 ' CD1' HG22 ' A' ' 72' ' ' THR . 51.9 m-85 -78.43 -44.78 23.87 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.604 0.964 . . . . 71.42 113.604 -177.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.406 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 7.9 mp -85.69 129.03 56.34 Favored Pre-proline 0 C--N 1.301 -1.518 0 C-N-CA 123.578 0.751 . . . . 75.44 112.157 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -93.18 -16.15 0.83 Allowed 'Trans proline' 0 CA--C 1.556 1.606 0 C-N-CA 122.372 2.048 . . . . 74.34 110.874 169.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.8 p -114.4 28.61 8.62 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 124.307 1.043 . . . . 64.41 111.535 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -37.66 110.0 0.11 Allowed 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 126.238 1.815 . . . . 71.41 114.181 -173.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -113.31 56.56 0.69 Allowed 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.791 -1.559 . . . . 75.45 106.791 170.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 pp -95.07 -15.96 23.03 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.576 -1.647 . . . . 75.11 110.846 -174.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -85.91 -2.22 58.05 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 122.003 0.906 . . . . 73.11 109.795 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.7 m -81.51 39.25 0.53 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 115.2 -0.909 . . . . 72.02 111.481 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.1 t -87.69 76.81 8.78 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-O 121.901 0.858 . . . . 73.42 108.822 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 122.732 1.253 . . . . 74.23 110.933 176.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -113.53 160.62 30.97 Favored Pre-proline 1 N--CA 1.379 -4.019 0 N-CA-C 105.478 -2.045 . . . . 64.34 105.478 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -69.22 -141.48 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 122.803 2.335 . . . . 54.43 112.353 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -75.78 38.36 0.16 Allowed 'General case' 0 C--N 1.296 -1.721 0 C-N-CA 123.999 0.92 . . . . 74.15 112.88 -175.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.452 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 6.3 m-20 -60.03 143.52 87.98 Favored Pre-proline 0 N--CA 1.427 -1.594 0 C-N-CA 123.997 0.919 . . . . 74.13 109.52 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.08 -40.92 79.57 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.339 2.693 . . . . 75.24 113.704 -175.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.86 -30.28 61.3 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.32 -0.237 . . . . 74.24 110.948 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.469 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 84.0 t -66.46 -44.86 90.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 N-CA-C 108.249 -1.019 . . . . 72.44 108.249 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.45 -49.09 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 114.564 -1.198 . . . . 74.52 109.385 176.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.0 t-160 -56.24 -35.4 67.34 Favored 'General case' 0 C--O 1.206 -1.214 0 CA-C-N 116.281 -0.418 . . . . 75.53 111.123 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.471 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.5 ttt180 -58.93 -44.33 91.31 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.557 0.694 . . . . 74.34 111.206 176.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 59.0 mt-30 -72.21 -38.42 69.0 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.211 -0.904 . . . . 74.42 110.142 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -72.05 -30.18 64.9 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.891 -1.049 . . . . 72.54 110.439 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.544 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 9.2 t30 -61.64 -32.58 72.74 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 124.648 1.179 . . . . 73.42 109.398 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -67.52 -33.36 74.92 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 115.154 -0.93 . . . . 74.33 111.899 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -72.29 -37.93 68.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 109.11 -0.7 . . . . 64.33 109.11 176.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.544 ' HB3' ' O ' ' A' ' 63' ' ' ASN . 34.9 t80 -52.88 -43.92 66.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.483 -1.235 . . . . 74.0 108.415 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.81 -16.7 60.69 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.975 -1.012 . . . . 73.23 113.345 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 39.0 mm-40 -82.98 -44.3 15.42 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 118.671 0.668 . . . . 64.03 110.571 177.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 173.03 143.13 4.08 Favored Glycine 0 CA--C 1.475 -2.433 0 C-N-CA 120.019 -1.086 . . . . 73.32 112.678 -175.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.549 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.4 ptt? -70.47 -27.27 64.1 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 106.684 -1.599 . . . . 75.23 106.684 170.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.85 -34.36 57.85 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.391 -1.277 . . . . 75.5 108.16 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.562 HG22 ' CD1' ' A' ' 40' ' ' PHE . 93.3 m -63.6 -36.12 82.76 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.387 -0.824 . . . . 73.45 109.41 174.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -63.12 -50.88 68.72 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.636 -0.505 . . . . 75.11 109.636 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 70' ' ' MET . 84.3 mttt -54.75 -42.23 71.4 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.839 -0.619 . . . . 73.2 111.294 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -65.31 -47.68 75.73 Favored 'General case' 0 N--CA 1.411 -2.398 0 C-N-CA 123.256 0.622 . . . . 74.22 111.142 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -59.34 -51.08 71.46 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.332 -0.849 . . . . 75.0 111.104 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.2 mm -64.79 -36.91 78.81 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 O-C-N 123.411 0.444 . . . . 73.3 110.842 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -58.55 -46.31 87.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.05 -0.523 . . . . 74.03 110.083 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 72.1 m-20 -72.14 -39.33 68.86 Favored 'General case' 0 C--O 1.185 -2.306 0 C-N-CA 120.795 -0.362 . . . . 70.55 110.94 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -49.79 -54.2 20.64 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.963 1.305 . . . . 73.23 110.535 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.411 ' SG ' HD11 ' A' ' 88' ' ' LEU . 59.1 m -63.18 -32.26 73.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.073 -0.967 . . . . 72.11 111.246 -179.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -76.2 -52.86 9.18 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.631 -0.713 . . . . 74.44 111.14 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 28.9 mt-10 -66.76 -44.68 80.77 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.846 0.858 . . . . 71.02 112.582 -173.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 79.8 mt -80.28 -10.81 59.76 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 120.164 -0.614 . . . . 74.32 109.456 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.5 t70 55.74 71.15 0.57 Allowed 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.079 -1.418 . . . . 75.2 111.612 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.7 t -124.86 104.95 29.84 Favored Pre-proline 0 C--N 1.303 -1.419 0 CA-C-N 114.701 -1.136 . . . . 72.11 108.52 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -75.98 73.04 5.02 Favored 'Trans proline' 0 N--CA 1.449 -1.101 0 C-N-CA 122.011 1.807 . . . . 74.42 111.092 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.411 HD11 ' SG ' ' A' ' 81' ' ' CYS . 0.3 OUTLIER -95.87 -24.35 16.48 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.024 1.12 . . . . 73.12 114.024 -178.4 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 62.41 17.83 9.8 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 121.977 0.894 . . . . 73.01 111.247 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.515 ' O ' HD22 ' A' ' 94' ' ' LEU . 63.8 mtt -113.12 17.52 18.67 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.794 -1.093 . . . . 72.22 109.969 -177.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.63 ' O ' HG11 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -60.9 -56.07 25.49 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.218 -0.446 . . . . 73.54 111.165 -175.7 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.526 ' O ' HG21 ' A' ' 95' ' ' VAL . 35.2 mm -66.64 -42.84 48.1 Favored Pre-proline 0 CA--C 1.571 1.764 0 C-N-CA 123.181 0.592 . . . . 74.33 110.728 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -48.05 -41.85 32.99 Favored 'Trans proline' 0 CA--C 1.557 1.638 0 C-N-CA 121.759 1.64 . . . . 62.3 111.943 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.696 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 4.3 mm? -69.45 -36.2 76.38 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 122.795 0.438 . . . . 75.13 110.804 173.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.63 HG11 ' O ' ' A' ' 91' ' ' GLU . 5.8 m -68.21 -35.02 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-O 121.986 0.898 . . . . 74.21 110.156 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.8 t -59.53 -26.42 65.32 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 125.501 1.52 . . . . 71.2 110.99 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.696 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 2.7 mt -50.09 -47.46 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 C-N-CA 123.883 0.873 . . . . 72.34 110.949 176.071 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.467 ' CD1' ' HA ' ' A' ' 66' ' ' PHE . 7.8 t-105 . . . . . 0 N--CA 1.409 -2.491 0 CA-C-O 122.813 1.292 . . . . 71.41 110.044 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.412 ' SD ' HD13 ' A' ' 92' ' ' ILE . 6.4 tpt . . . . . 0 N--CA 1.447 -0.601 0 N-CA-C 107.518 -1.289 . . . . 71.4 107.518 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.59 25.22 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.089 1.514 . . . . 74.22 115.089 -173.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.26 -17.44 56.67 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.857 1.313 . . . . 74.5 109.129 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -31.49 72.75 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 113.408 -1.724 . . . . 75.15 112.925 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.427 ' HB2' HD12 ' A' ' 11' ' ' ILE . 51.7 m -61.86 -27.84 69.08 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.672 0.748 . . . . 72.34 110.483 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.427 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.62 -29.74 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.427 -1.26 . . . . 71.35 111.76 -173.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.417 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 37.2 mmt180 -85.91 -38.13 18.35 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.9 1.074 . . . . 75.11 113.9 -172.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.15 -51.85 0.27 Allowed 'General case' 0 CA--C 1.552 1.027 0 N-CA-C 117.407 2.373 . . . . 73.41 117.407 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.538 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 42.3 m-80 -126.42 -80.59 0.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.588 1.329 . . . . 73.43 114.588 -173.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 67.99 84.67 0.15 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.187 0.995 . . . . 74.31 110.92 -175.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.68 -47.17 55.96 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.379 -0.828 . . . . 72.31 113.086 -177.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -61.23 -33.1 72.95 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.126 0.417 . . . . 72.12 112.126 -176.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.403 HD13 HD23 ' A' ' 94' ' ' LEU . 94.3 mt -64.87 -33.95 77.21 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.056 -0.52 . . . . 75.04 111.595 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.488 ' CA ' HD11 ' A' ' 97' ' ' ILE . 65.9 t-105 -63.9 -39.96 95.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.32 -0.4 . . . . 74.31 110.289 177.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.48 -38.95 91.26 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.593 -0.276 . . . . 74.13 110.435 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 76.7 t90 -58.76 -50.38 74.15 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.861 -0.792 . . . . 75.52 108.861 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.16 -52.89 62.94 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 114.893 -1.049 . . . . 74.14 110.773 -176.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 67.2 t -53.16 -51.76 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.124 0.57 . . . . 75.23 112.117 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.43 -0.35 . . . . 74.0 111.533 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -74.44 -47.12 35.59 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 107.695 -1.224 . . . . 63.41 107.695 -176.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.679 ' HA ' ' ND2' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -68.11 -24.74 65.06 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 124.237 1.015 . . . . 73.43 111.211 -178.67 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 48.0 t -63.53 -15.11 57.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.079 -0.711 . . . . 65.21 109.079 174.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -100.39 -4.53 28.84 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-O 121.064 0.459 . . . . 72.24 110.084 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.679 ' ND2' ' HA ' ' A' ' 26' ' ' LEU . 8.4 p30 -133.93 48.36 3.17 Favored Pre-proline 0 N--CA 1.472 0.658 0 N-CA-C 113.362 0.875 . . . . 61.4 113.362 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.479 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.4 Cg_exo -72.36 -22.95 21.11 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.612 1.541 . . . . 75.23 111.154 -175.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -75.6 -51.32 13.13 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.857 -0.794 . . . . 75.34 108.857 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.536 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 60.9 t90 -60.72 -44.14 96.97 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.06 -0.973 . . . . 74.24 109.668 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.534 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -58.08 -43.4 86.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.627 -0.715 . . . . 75.55 109.641 -178.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.7 m -61.99 -49.44 76.06 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 116.26 -0.427 . . . . 73.25 110.964 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.14 -39.85 63.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.727 0.811 . . . . 64.32 111.612 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.2 mmmt -74.21 -33.48 63.4 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.979 -0.289 . . . . 73.52 111.306 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.9 mt -59.1 -34.1 71.62 Favored 'General case' 0 C--O 1.19 -2.05 0 N-CA-C 110.342 -0.244 . . . . 73.21 110.342 174.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 -59.33 -39.12 82.14 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.287 0.565 . . . . 75.2 110.51 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -72.26 -38.91 68.76 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 114.907 -1.042 . . . . 44.34 110.396 -176.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.537 ' CD1' HG22 ' A' ' 72' ' ' THR . 69.7 m-85 -89.29 -50.19 6.28 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 113.559 0.948 . . . . 73.02 113.559 -176.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 mp -79.65 128.38 74.89 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 123.591 0.756 . . . . 74.44 110.498 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -72.85 -22.12 20.48 Favored 'Trans proline' 0 C--N 1.321 -0.914 0 C-N-CA 122.23 1.953 . . . . 74.44 111.761 177.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.5 p -108.62 -30.59 8.14 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 113.871 1.063 . . . . 73.14 113.871 -176.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.29 1.1 ptm 41.32 92.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 116.205 1.928 . . . . 65.44 116.205 -175.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -99.12 56.8 1.05 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 123.171 1.463 . . . . 72.42 108.244 177.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 pp -92.18 -17.33 25.03 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.577 -1.647 . . . . 64.04 112.634 -173.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -88.74 0.21 56.7 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.025 0.917 . . . . 74.54 110.744 -176.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.3 m -81.78 69.46 8.46 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.615 -0.721 . . . . 72.32 109.697 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.3 m -93.15 82.89 4.58 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-O 121.896 0.855 . . . . 73.12 109.582 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.66 -28.28 30.76 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 122.698 1.237 . . . . 73.13 110.333 176.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -134.11 167.53 22.42 Favored Pre-proline 1 N--CA 1.376 -4.158 0 N-CA-C 104.948 -2.241 . . . . 74.41 104.948 176.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -76.83 -149.45 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 121.691 1.594 . . . . 75.44 110.648 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.3 p -76.0 38.65 0.17 Allowed 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 123.666 0.786 . . . . 74.1 112.788 -177.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.94 150.98 46.86 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 125.156 1.382 . . . . 72.44 111.591 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -52.87 -43.85 53.1 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 123.529 2.819 . . . . 75.21 113.956 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.4 -28.92 61.3 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 120.977 -0.289 . . . . 73.43 111.37 -178.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.541 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 99.8 t -65.87 -52.54 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.362 -1.347 . . . . 75.11 107.362 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.0 mm -55.48 -47.41 78.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.641 -1.163 . . . . 75.43 110.148 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -54.16 -40.93 67.94 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.337 0.655 . . . . 75.21 111.462 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.442 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.0 ttm180 -68.17 -41.44 81.52 Favored 'General case' 0 C--N 1.297 -1.705 0 C-N-CA 123.412 0.685 . . . . 74.55 111.093 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 46.0 mt-30 -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.349 -0.841 . . . . 71.12 111.175 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.414 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -77.9 -30.58 50.73 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.452 -0.795 . . . . 72.33 110.678 -178.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.442 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 24.0 t-20 -54.59 -46.01 73.71 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.244 1.017 . . . . 64.24 110.622 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -54.03 -33.83 58.34 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.114 -1.403 . . . . 75.23 112.075 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.9 mt -72.45 -42.92 64.47 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.734 0.302 . . . . 74.21 111.026 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -64.83 -32.51 74.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.815 -0.63 . . . . 74.25 109.581 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.9 -24.8 63.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.287 -0.87 . . . . 72.13 111.624 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -74.29 -37.37 63.69 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 108.615 -0.883 . . . . 73.42 108.615 175.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.49 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . 170.81 138.78 2.59 Favored Glycine 0 N--CA 1.415 -2.737 0 CA-C-N 114.678 -1.146 . . . . 64.23 110.909 -176.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.525 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.48 -26.55 63.67 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 106.864 -1.532 . . . . 72.22 106.864 171.385 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.44 -37.54 65.81 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 113.986 -1.461 . . . . 75.21 108.374 174.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.537 HG22 ' CD1' ' A' ' 40' ' ' PHE . 53.1 m -58.99 -42.47 90.12 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.488 -0.778 . . . . 74.15 109.707 173.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.463 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -61.27 -46.0 92.15 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.03 -0.532 . . . . 72.33 110.639 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' A' ' 70' ' ' MET . 95.2 mttt -53.76 -46.39 70.91 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 122.581 0.352 . . . . 74.42 110.852 175.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.7 m -65.63 -42.28 91.67 Favored 'General case' 0 N--CA 1.407 -2.593 0 C-N-CA 123.033 0.533 . . . . 75.42 111.756 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 94.5 t80 -58.37 -49.22 78.01 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.042 -0.527 . . . . 75.04 111.584 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.3 mm -61.13 -33.92 58.16 Favored 'Isoleucine or valine' 0 C--O 1.244 0.792 0 O-C-N 123.336 0.397 . . . . 73.53 111.177 -177.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.432 ' HA ' ' OE1' ' A' ' 91' ' ' GLU . 5.7 t30 -57.96 -49.02 78.21 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.857 -0.611 . . . . 75.14 110.156 175.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.432 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.6 m-20 -72.85 -40.12 65.97 Favored 'General case' 0 C--O 1.194 -1.846 0 CA-C-N 114.928 -1.033 . . . . 72.22 110.666 -178.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.498 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.5 tm? -50.95 -54.47 24.02 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 125.229 1.412 . . . . 73.15 109.732 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.7 m -65.95 -40.67 91.55 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.151 -0.477 . . . . 62.52 110.281 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -65.38 -49.02 70.89 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 73.43 111.986 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 33.9 mt-10 -81.11 -17.71 49.01 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 112.942 0.719 . . . . 74.04 112.942 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -103.17 -39.39 6.88 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 112.501 0.556 . . . . 75.44 112.501 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -138.3 -151.64 0.39 Allowed 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.871 -1.159 . . . . 71.45 107.871 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.2 m -105.04 166.45 11.43 Favored Pre-proline 0 C--N 1.295 -1.771 0 N-CA-C 107.35 -1.352 . . . . 75.25 107.35 175.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.9 86.69 0.73 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.501 1.467 . . . . 71.44 111.577 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.49 ' CD1' ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -77.48 -13.43 59.92 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-N 115.905 -0.589 . . . . 72.21 112.003 178.058 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.6 t70 53.48 83.63 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 116.1 1.889 . . . . 75.54 116.1 174.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.49 ' HG2' ' CD2' ' A' ' 88' ' ' LEU . 26.2 ptm -156.12 32.25 0.34 Allowed 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.04 -2.578 . . . . 75.03 104.04 168.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.588 ' O ' HG11 ' A' ' 95' ' ' VAL . 35.2 tt0 -60.4 -50.84 72.0 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 111.547 -2.569 . . . . 71.43 111.759 -172.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.534 ' O ' HG21 ' A' ' 95' ' ' VAL . 42.4 mm -60.56 -45.4 97.2 Favored Pre-proline 0 CA--C 1.559 1.29 0 C-N-CA 123.011 0.525 . . . . 72.21 111.536 -177.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -47.89 -37.25 28.67 Favored 'Trans proline' 0 CA--C 1.553 1.454 0 C-N-CA 121.911 1.741 . . . . 74.45 111.812 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.403 HD23 HD13 ' A' ' 18' ' ' LEU . 4.4 mm? -76.26 -34.98 59.14 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 122.797 0.439 . . . . 72.35 110.972 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.588 HG11 ' O ' ' A' ' 91' ' ' GLU . 5.2 m -68.53 -30.59 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-O 122.799 1.285 . . . . 75.31 110.748 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.417 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 30.0 t -83.5 2.86 34.81 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 113.635 -1.62 . . . . 74.0 112.39 -178.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.538 ' HA ' ' O ' ' A' ' 14' ' ' ASN . 9.7 tt -62.67 -25.86 39.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 114.143 1.164 . . . . 73.31 114.143 -170.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 94.2 m95 . . . . . 0 C--N 1.322 -0.619 0 O-C-N 121.777 -0.577 . . . . 74.33 111.533 -179.821 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.186 0 CA-C-O 122.048 0.928 . . . . 65.42 111.165 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -106.34 25.68 10.78 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 114.903 -1.044 . . . . 71.22 110.897 177.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.02 -17.25 57.3 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-O 121.396 0.617 . . . . 73.31 109.355 174.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.414 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -53.24 -40.4 64.52 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 126.049 1.74 . . . . 74.42 115.222 -177.315 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 33.5 t -58.35 -41.52 84.88 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 124.457 1.103 . . . . 74.12 110.261 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.509 HD11 ' H ' ' A' ' 11' ' ' ILE . 3.5 mp -87.2 -36.69 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.147 0 CA-C-N 114.711 -1.131 . . . . 71.44 111.648 -176.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.435 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 15.5 mmt180 -72.66 -49.48 31.41 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 114.405 1.261 . . . . 73.32 114.405 -176.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 12' ' ' ARG . 3.9 mm? 63.1 -168.91 0.19 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.862 0.726 . . . . 71.43 110.054 -171.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -138.85 178.59 7.05 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 121.631 -0.668 . . . . 73.24 111.279 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -114.2 145.02 42.25 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.9 -1.148 . . . . 75.21 107.9 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -64.17 -29.38 70.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.096 0.558 . . . . 72.5 110.516 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -39.01 86.03 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 109.082 -0.71 . . . . 72.43 109.082 176.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.7 tt -72.31 -38.4 68.72 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.152 -1.386 . . . . 73.02 109.182 -177.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 66.8 t-105 -60.77 -51.14 70.6 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.312 -0.404 . . . . 73.32 109.968 175.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.49 -38.23 86.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 115.689 -0.687 . . . . 72.34 110.558 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.7 t-105 -61.48 -50.89 70.94 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.302 0.376 . . . . 75.01 111.074 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.85 -50.15 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.529 -0.545 . . . . 74.11 109.529 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -61.16 -46.32 96.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.947 -0.569 . . . . 72.0 111.811 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 78.3 ttt180 -69.12 -42.48 75.99 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.7 -0.227 . . . . 73.42 111.606 -176.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -67.31 -43.73 80.96 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.446 -0.576 . . . . 71.11 109.446 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mt -70.02 -25.18 63.46 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 122.444 0.298 . . . . 73.32 111.673 177.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -70.2 -12.91 61.92 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.794 -0.817 . . . . 75.24 108.794 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 7.0 mtmp? -101.17 -5.15 26.0 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.512 -0.551 . . . . 74.35 109.512 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.484 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 92.3 m-20 -136.72 52.06 5.52 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.411 -0.813 . . . . 74.32 111.172 -175.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.484 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 6.1 Cg_exo -71.97 -21.78 23.89 Favored 'Trans proline' 0 C--N 1.358 1.04 0 N-CA-C 108.687 -1.313 . . . . 72.31 108.687 -177.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.49 -36.93 68.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.49 -1.686 . . . . 73.54 109.914 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.579 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 69.2 t90 -75.11 -45.16 42.96 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.571 -0.852 . . . . 75.12 109.098 173.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.461 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 60.3 tp -56.46 -48.82 76.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.367 -1.288 . . . . 63.43 112.346 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.7 m -55.99 -36.74 68.24 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 123.575 0.547 . . . . 72.21 111.641 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -66.81 -38.84 87.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.382 0.611 . . . . 70.31 110.184 179.358 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.579 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.8 mmmt -76.53 -37.25 56.98 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.685 -0.406 . . . . 71.44 111.392 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 88.0 mt -54.37 -49.71 69.19 Favored 'General case' 0 C--O 1.186 -2.251 0 O-C-N 123.574 0.546 . . . . 75.2 110.264 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.477 ' HA ' ' HB3' ' A' ' 44' ' ' MET . 28.4 ptt180 -65.22 -30.49 71.39 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 113.463 0.912 . . . . 74.34 113.463 -178.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 72.1 m -69.93 -23.47 63.22 Favored 'General case' 0 N--CA 1.385 -3.709 0 CA-C-N 115.314 -0.857 . . . . 64.22 111.793 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.448 ' CD1' HG21 ' A' ' 72' ' ' THR . 57.7 m-85 -100.66 -44.11 5.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 123.825 0.85 . . . . 65.24 112.639 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 37' ' ' LEU . 9.5 mp -76.59 120.48 81.85 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 124.438 1.095 . . . . 72.43 110.67 178.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -62.98 -34.5 70.64 Favored 'Trans proline' 0 CA--C 1.535 0.575 0 C-N-CA 122.953 2.436 . . . . 74.14 113.533 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.6 p -114.34 -5.37 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.18 0.514 . . . . 74.54 112.062 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.477 ' HB3' ' HA ' ' A' ' 38' ' ' ARG 0.286 6.4 ptt? 41.96 92.12 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 115.532 1.679 . . . . 71.43 115.532 -174.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -100.92 58.22 0.9 Allowed 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 107.908 -1.145 . . . . 62.42 107.908 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 pp -96.17 -5.18 41.17 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.743 -1.117 . . . . 74.21 112.915 -175.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -80.7 -13.34 59.09 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.767 0.794 . . . . 75.42 111.326 -176.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -75.53 91.09 2.78 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.195 -0.911 . . . . 75.4 110.153 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.1 t -141.74 76.53 1.55 Allowed 'General case' 0 N--CA 1.419 -1.975 0 N-CA-C 108.352 -0.981 . . . . 72.43 108.352 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.31 -28.56 69.29 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-N 113.83 -1.532 . . . . 74.03 112.475 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -122.73 169.44 9.8 Favored Pre-proline 0 C--N 1.247 -3.864 0 N-CA-C 106.187 -1.783 . . . . 63.54 106.187 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -68.04 -156.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.558 1.685 0 C-N-CA 121.321 1.347 . . . . 71.33 111.517 173.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.0 m -75.72 39.12 0.16 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 124.154 0.982 . . . . 75.04 113.197 -174.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -57.08 149.6 44.83 Favored Pre-proline 0 N--CA 1.432 -1.354 0 C-N-CA 126.186 1.794 . . . . 63.32 111.295 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -46.65 -45.89 18.96 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.35 3.367 . . . . 72.0 114.243 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -74.6 -25.98 59.61 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.178 0.513 . . . . 74.13 110.966 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 95.5 t -73.97 -47.73 41.43 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.572 -0.899 . . . . 64.52 108.572 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.4 mm -59.02 -41.81 84.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.962 -1.017 . . . . 72.4 109.861 176.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -55.62 -46.58 77.36 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 115.643 -0.708 . . . . 62.4 110.025 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -58.89 -43.34 90.95 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.365 0.603 . . . . 74.15 111.209 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.33 -46.45 76.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.012 -0.995 . . . . 74.53 111.603 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.44 -30.59 61.96 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.465 -0.788 . . . . 75.42 111.918 -177.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -63.13 -38.45 91.23 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 123.706 0.802 . . . . 73.3 109.854 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 9.5 tpp85 -59.5 -29.46 67.88 Favored 'General case' 1 N--CA 1.375 -4.181 0 C-N-CA 124.924 1.29 . . . . 75.13 111.877 178.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -71.09 -38.07 72.42 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.795 -0.446 . . . . 73.4 109.795 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -69.08 -31.23 69.83 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.899 -0.778 . . . . 71.54 108.899 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.88 -26.72 66.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.436 -0.802 . . . . 74.14 110.944 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -70.83 -48.56 53.42 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 107.782 -1.192 . . . . 75.24 107.782 174.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.428 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -174.92 139.69 4.95 Favored Glycine 0 CA--C 1.474 -2.499 0 CA-C-N 114.635 -1.166 . . . . 55.14 110.739 -176.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.609 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -66.08 -29.73 70.12 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 106.211 -1.774 . . . . 75.55 106.211 171.666 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.22 -35.54 59.0 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.789 -1.55 . . . . 63.5 108.718 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.448 HG21 ' CD1' ' A' ' 40' ' ' PHE . 91.1 m -58.75 -41.16 85.87 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.742 -0.663 . . . . 74.11 110.03 175.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.549 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -63.33 -49.37 74.2 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.441 -0.345 . . . . 65.04 110.424 176.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.609 ' HG3' ' O ' ' A' ' 70' ' ' MET . 86.7 mttt -54.7 -35.39 63.57 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.325 0.65 . . . . 74.33 111.545 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.1 m -72.17 -49.94 31.73 Favored 'General case' 0 N--CA 1.409 -2.507 0 N-CA-C 109.69 -0.485 . . . . 72.52 109.69 176.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -50.51 -48.51 56.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 124.125 0.97 . . . . 75.55 112.189 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.1 mm -57.4 -37.07 55.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 N-CA-C 112.644 0.609 . . . . 75.3 112.644 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -65.92 -34.06 77.26 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.288 0.566 . . . . 74.33 110.169 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.402 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 1.2 m-20 -78.21 -42.77 30.35 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.712 -0.676 . . . . 73.53 110.174 175.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -50.19 -54.52 20.29 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.869 1.668 . . . . 74.42 110.542 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 13.2 p -64.48 -33.36 75.71 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.379 -0.828 . . . . 71.42 111.643 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -75.93 -54.64 6.58 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.063 -0.971 . . . . 72.53 111.778 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 40.5 mt-10 -70.93 -31.35 67.93 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.504 0.927 . . . . 72.54 113.504 -170.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.5 -49.34 19.05 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 119.993 -0.683 . . . . 71.33 111.857 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -161.69 -97.3 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.13 0.269 . . . . 74.42 110.514 -176.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -140.64 165.02 32.72 Favored Pre-proline 0 C--N 1.3 -1.573 0 N-CA-C 105.445 -2.057 . . . . 74.32 105.445 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -43.5 107.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 122.967 2.444 . . . . 71.22 112.101 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -8.86 59.61 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.835 -1.075 . . . . 74.5 112.823 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -175.12 -161.64 0.1 Allowed 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 103.179 -2.897 . . . . 73.42 103.179 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.496 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -86.59 141.62 28.88 Favored 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 106.926 -1.509 . . . . 74.32 106.926 178.448 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.563 ' O ' HG11 ' A' ' 95' ' ' VAL . 36.2 tt0 -52.78 -52.25 57.44 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 124.977 1.311 . . . . 65.43 112.94 -175.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.435 ' O ' HG22 ' A' ' 95' ' ' VAL . 39.3 mm -64.44 -45.6 77.46 Favored Pre-proline 0 C--O 1.169 -3.154 0 CA-C-O 117.534 -1.222 . . . . 71.34 113.136 -172.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -49.38 -35.13 34.71 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 CA-C-N 122.837 2.049 . . . . 74.35 112.097 172.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.496 HD22 ' O ' ' A' ' 90' ' ' MET . 3.4 mm? -72.2 -36.59 69.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.691 -0.686 . . . . 71.54 109.385 175.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.563 HG11 ' O ' ' A' ' 91' ' ' GLU . 2.9 m -69.87 -36.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-O 122.385 1.088 . . . . 74.31 109.993 177.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.6 m -70.42 5.24 1.86 Allowed 'General case' 0 C--N 1.293 -1.858 0 C-N-CA 127.694 2.398 . . . . 73.25 113.007 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 10.3 tp -66.61 -28.56 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.088 0.47 . . . . 64.23 111.163 -175.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 . . . . . 0 N--CA 1.421 -1.887 0 N-CA-C 108.126 -1.064 . . . . 74.1 108.126 -179.796 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 tpt . . . . . 0 N--CA 1.45 -0.469 0 CA-C-O 121.201 0.524 . . . . 73.02 110.162 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -78.32 25.09 0.24 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.933 0.893 . . . . 70.34 112.205 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.56 -13.27 60.09 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.22 -1.03 . . . . 75.11 108.22 174.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.88 -38.24 84.96 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.376 -1.284 . . . . 72.3 112.142 178.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.447 ' HB2' HD11 ' A' ' 11' ' ' ILE . 68.0 m -54.92 -32.17 60.89 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 124.679 1.192 . . . . 74.33 111.727 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.447 HD11 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -83.88 -25.91 7.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 C-N-CA 124.91 1.284 . . . . 74.31 110.322 -173.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -110.16 7.4 23.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.646 -0.707 . . . . 65.23 111.964 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.4 tt -51.35 121.43 6.27 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.576 1.151 . . . . 74.41 112.586 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.404 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 26.4 t-20 -152.42 149.43 28.58 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 105.093 -2.188 . . . . 71.01 105.093 177.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -122.17 -73.77 0.64 Allowed 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 118.815 -1.154 . . . . 74.21 113.122 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.97 -34.34 75.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.958 1.466 . . . . 72.12 114.958 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -70.26 -40.21 74.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 120.259 -0.576 . . . . 73.13 110.966 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.8 mt -74.44 -34.86 63.3 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.242 -0.436 . . . . 74.42 110.241 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -61.15 -50.12 74.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.278 -0.419 . . . . 73.13 110.769 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.11 85.73 Favored 'General case' 0 C--O 1.243 0.74 0 O-C-N 123.225 0.328 . . . . 74.25 110.902 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 22.2 t-105 -63.88 -51.03 66.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.739 -0.664 . . . . 74.5 110.948 176.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.8 tp -60.08 -49.2 78.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.998 -0.546 . . . . 72.44 110.076 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.3 t -57.42 -46.38 85.64 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 CA-C-N 115.681 -0.69 . . . . 73.35 111.446 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.44 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 19.7 tpt180 -68.52 -44.26 75.02 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 116.644 -0.253 . . . . 72.4 110.728 -176.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -67.93 -42.96 80.22 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 109.674 -0.491 . . . . 75.44 109.674 -176.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.3 mt -71.61 -24.53 61.9 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 112.008 0.373 . . . . 74.14 112.008 177.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.6 t -67.09 -23.28 65.83 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 107.723 -1.214 . . . . 71.24 107.723 175.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 31.1 mtmt -90.94 -10.2 43.32 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.66 -0.7 . . . . 71.43 110.084 178.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -135.4 52.3 6.86 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 122.883 0.473 . . . . 74.2 111.33 -177.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.01 -17.88 24.6 Favored 'Trans proline' 0 C--N 1.368 1.556 0 N-CA-C 108.759 -1.285 . . . . 72.22 108.759 -178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -71.55 -38.58 71.0 Favored 'General case' 0 N--CA 1.417 -2.099 0 CA-C-N 113.386 -1.734 . . . . 73.03 109.455 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.433 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.1 t90 -74.67 -47.98 28.75 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.657 -0.817 . . . . 71.35 109.554 176.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.542 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 52.8 tp -54.05 -51.48 63.92 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.009 -1.45 . . . . 72.22 112.418 -175.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.488 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.9 p -50.34 -51.79 42.63 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 123.878 0.736 . . . . 75.01 112.127 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.73 -43.48 76.63 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 125.083 1.353 . . . . 74.33 112.081 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 39' ' ' SER . 31.0 mmmt -74.05 -30.03 62.19 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.325 -0.235 . . . . 73.33 110.436 178.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 98.0 mt -63.77 -35.88 82.03 Favored 'General case' 0 C--O 1.187 -2.205 0 N-CA-C 109.256 -0.646 . . . . 74.23 109.256 173.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -61.51 -33.56 74.02 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.269 0.557 . . . . 73.35 110.562 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.3 m -74.56 -41.59 60.28 Favored 'General case' 0 N--CA 1.402 -2.855 0 C-N-CA 124.981 1.312 . . . . 72.03 112.324 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.533 ' CD1' HG21 ' A' ' 72' ' ' THR . 67.1 m-85 -88.99 -48.31 7.52 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 113.091 0.775 . . . . 74.45 113.091 -177.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 8.4 mp -89.85 139.0 27.57 Favored Pre-proline 0 C--N 1.295 -1.777 0 C-N-CA 124.425 1.09 . . . . 72.22 112.139 -177.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_endo -91.04 -13.0 2.14 Favored 'Trans proline' 0 CA--C 1.551 1.326 0 C-N-CA 122.241 1.96 . . . . 73.43 109.284 166.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.9 p -114.37 26.59 10.13 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 125.668 1.587 . . . . 71.54 111.567 -172.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.257 0.0 OUTLIER -59.11 96.08 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 115.946 1.832 . . . . 75.4 115.946 -173.943 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.42 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 16.4 m-20 -83.72 74.06 10.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.004 -1.48 . . . . 74.41 107.004 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.6 pp -95.81 -27.35 15.26 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-N 115.24 -0.891 . . . . 74.41 111.456 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -103.66 6.13 36.85 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 122.265 1.031 . . . . 73.1 109.668 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 63.6 m -81.72 74.33 8.72 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 122.407 1.099 . . . . 51.31 109.464 177.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.4 t -90.52 83.33 5.84 Favored 'General case' 0 N--CA 1.403 -2.793 0 CA-C-N 114.36 -1.291 . . . . 72.4 110.142 -176.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -79.76 -28.79 40.36 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 123.166 1.46 . . . . 75.31 108.696 170.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -135.0 161.87 61.11 Favored Pre-proline 1 N--CA 1.373 -4.313 0 CA-C-N 112.03 -2.35 . . . . 63.21 105.191 177.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.441 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.2 Cg_exo -67.81 -143.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.846 2.364 . . . . 74.34 111.917 175.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.9 m -76.91 37.64 0.19 Allowed 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 124.1 0.96 . . . . 71.44 110.489 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.441 ' H ' ' C ' ' A' ' 52' ' ' PRO . 7.2 m-20 -65.32 152.23 92.39 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 126.795 2.038 . . . . 74.34 113.258 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -54.32 -41.67 74.36 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 123.954 3.103 . . . . 64.45 114.272 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.47 -29.69 61.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.225 0.536 . . . . 75.41 110.478 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.438 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 86.8 t -66.38 -51.65 55.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.207 -1.034 . . . . 72.33 108.207 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.9 mm -59.65 -41.56 85.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.561 -1.199 . . . . 75.43 109.709 177.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -56.42 -42.15 77.55 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.838 0.455 . . . . 74.22 111.251 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.519 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 21.2 ttt180 -61.21 -42.0 97.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.599 0.714 . . . . 75.41 110.953 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 84.6 mt-30 -71.39 -42.24 68.63 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.942 -1.026 . . . . 75.41 111.764 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -75.51 -31.11 60.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 115.347 -0.842 . . . . 73.01 110.547 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.519 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 23.7 t-20 -53.33 -49.77 66.4 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.957 1.303 . . . . 73.31 110.23 173.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 30.0 mmt180 -54.69 -33.6 61.14 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.553 -1.658 . . . . 62.21 113.071 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -67.02 -40.66 87.29 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.641 0.258 . . . . 73.41 110.575 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -67.17 -32.95 74.39 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.812 -0.81 . . . . 74.42 108.812 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.09 -18.96 63.27 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.321 -0.854 . . . . 74.5 111.281 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -79.52 -55.85 4.74 Favored 'General case' 0 N--CA 1.413 -2.277 0 N-CA-C 107.137 -1.431 . . . . 74.42 107.137 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -166.51 140.29 6.25 Favored Glycine 0 N--CA 1.42 -2.372 0 CA-C-N 114.132 -1.395 . . . . 73.1 111.036 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.437 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 45.8 ttm -65.13 -30.88 71.85 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 106.137 -1.801 . . . . 71.24 106.137 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.15 -35.52 59.16 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.641 -1.618 . . . . 72.33 109.123 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.533 HG21 ' CD1' ' A' ' 40' ' ' PHE . 54.9 m -59.96 -36.95 78.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.813 -0.631 . . . . 72.34 110.007 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.497 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 75.1 t-105 -61.94 -53.0 61.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.678 -0.49 . . . . 75.13 109.678 176.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 70' ' ' MET . 92.4 mttt -51.28 -46.58 62.5 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.89 0.876 . . . . 75.25 111.727 177.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.66 -44.11 74.79 Favored 'General case' 0 N--CA 1.41 -2.444 0 C-N-CA 123.035 0.534 . . . . 63.12 112.168 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -57.06 -46.02 82.79 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 122.816 0.446 . . . . 74.11 110.382 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.479 HG23 ' HB2' ' A' ' 94' ' ' LEU . 45.4 mm -63.71 -31.35 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.019 0 CA-C-N 115.751 -0.659 . . . . 74.12 111.565 -177.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.22 -40.77 94.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.5 -0.556 . . . . 73.42 109.5 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 82.7 m-20 -68.44 -42.28 79.06 Favored 'General case' 0 C--O 1.187 -2.221 0 CA-C-N 116.017 -0.538 . . . . 72.23 109.756 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.468 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -50.52 -53.91 26.49 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.085 1.354 . . . . 75.22 109.767 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.4 m -64.24 -35.14 79.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 64.24 111.403 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -76.33 -54.29 6.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.206 0.526 . . . . 73.3 112.105 -178.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 31.0 mt-10 -74.78 -22.57 58.68 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.734 1.013 . . . . 73.04 113.734 -169.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.6 mt -79.71 -42.13 25.29 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 119.046 -1.061 . . . . 75.42 111.823 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . 0.25 4.3 p30 -171.19 -90.48 0.01 OUTLIER 'General case' 0 C--O 1.241 0.641 0 N-CA-C 112.677 0.621 . . . . 74.34 112.677 174.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 69.4 t -130.51 148.04 68.37 Favored Pre-proline 0 C--N 1.301 -1.507 0 N-CA-C 106.297 -1.742 . . . . 74.32 106.297 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -39.22 109.0 0.08 OUTLIER 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 123.393 2.729 . . . . 74.45 112.207 173.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.29 -15.58 60.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.026 -0.988 . . . . 75.11 112.91 -178.297 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.86 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 105.207 -2.146 . . . . 74.13 105.207 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.1 mmt -168.5 163.66 12.51 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 102.886 -3.005 . . . . 74.02 102.886 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.554 ' C ' HG11 ' A' ' 95' ' ' VAL . 0.9 OUTLIER -72.01 -43.66 64.68 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 118.489 0.586 . . . . 75.14 111.105 -179.548 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.5 ' O ' HG22 ' A' ' 95' ' ' VAL . 29.5 mm -50.47 -44.14 81.95 Favored Pre-proline 0 CA--C 1.572 1.796 0 C-N-CA 125.7 1.6 . . . . 75.42 114.132 -171.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.03 -43.38 58.75 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.494 1.463 . . . . 65.41 110.793 174.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.479 ' HB2' HG23 ' A' ' 77' ' ' ILE . 2.8 mm? -75.15 -31.88 61.17 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.586 -1.188 . . . . 74.03 109.78 -179.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.554 HG11 ' C ' ' A' ' 91' ' ' GLU . 4.1 m -67.74 -31.36 52.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-O 122.176 0.989 . . . . 72.31 110.49 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.4 t -80.79 5.8 14.84 Favored 'General case' 0 C--N 1.281 -2.386 0 CA-C-N 113.708 -1.587 . . . . 72.43 112.408 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 14' ' ' ASN . 15.4 tt -60.46 -27.81 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 CA-C-O 121.478 0.656 . . . . 64.52 110.448 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.428 -1.533 0 N-CA-C 106.913 -1.514 . . . . 74.05 106.913 173.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.8 tmm? . . . . . 0 CA--C 1.487 -1.479 0 N-CA-C 108.369 -0.974 . . . . 75.23 108.369 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -168.19 23.46 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 114.352 -1.294 . . . . 73.4 109.495 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.417 ' HB3' ' HB ' ' A' ' 92' ' ' ILE . . . -77.63 -12.03 59.93 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.765 1.269 . . . . 52.24 108.788 178.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.447 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -66.65 -30.57 70.86 Favored 'General case' 0 N--CA 1.415 -2.224 0 CA-C-N 112.917 -1.947 . . . . 71.35 111.892 178.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.4 m -67.38 -37.79 83.7 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.638 0.732 . . . . 74.32 111.699 177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.426 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.1 mp -84.63 -49.26 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.285 0 CA-C-N 115.168 -0.924 . . . . 75.44 112.015 -176.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -77.91 -36.16 49.84 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.977 -0.689 . . . . 74.14 112.302 -176.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt 60.09 106.91 0.02 OUTLIER 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.39 1.076 . . . . 72.33 113.856 -177.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -69.12 155.57 40.15 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.762 -0.653 . . . . 65.31 110.872 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -157.22 179.88 8.85 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.855 -0.612 . . . . 75.2 109.829 -174.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 mp0 -61.91 -34.68 76.5 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.441 0.697 . . . . 75.32 112.794 -175.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -59.7 -46.92 87.63 Favored 'General case' 0 CA--C 1.474 -1.978 0 CA-C-O 123.0 1.381 . . . . 75.34 109.513 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.84 -39.51 90.88 Favored 'General case' 0 N--CA 1.407 -2.625 0 CA-C-N 111.667 -2.515 . . . . 64.01 110.361 -174.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.452 ' CE3' HG12 ' A' ' 97' ' ' ILE . 61.3 t-105 -68.72 -45.75 70.74 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.824 0.345 . . . . 72.43 110.366 174.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.39 85.41 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.634 -0.712 . . . . 73.51 111.309 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.59 -47.34 70.22 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.019 0.528 . . . . 74.12 111.406 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -60.9 -49.99 75.24 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.005 -0.543 . . . . 74.11 110.076 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.797 -0.638 . . . . 72.33 111.443 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 40.1 mmt180 -72.01 -42.92 65.83 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 112.213 0.449 . . . . 75.32 112.213 -175.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.411 ' CD1' HD12 ' A' ' 84' ' ' LEU . 2.6 tm? -67.99 -38.23 82.44 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.407 -0.59 . . . . 73.41 109.407 -177.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 mt -71.98 -25.45 61.86 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 112.248 0.462 . . . . 71.43 112.248 176.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 t -69.38 -20.98 63.82 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.054 -1.091 . . . . 72.14 108.054 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.44 -2.56 51.65 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.584 -0.735 . . . . 72.0 109.956 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.445 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -138.32 52.39 4.69 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 115.686 -0.688 . . . . 73.44 111.682 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.445 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.1 Cg_exo -68.6 -22.36 38.2 Favored 'Trans proline' 0 C--N 1.364 1.346 0 N-CA-C 108.342 -1.446 . . . . 75.12 108.342 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -67.2 -44.62 79.14 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.01 -1.45 . . . . 72.25 110.375 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.456 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 64.3 t90 -74.31 -44.22 53.46 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 119.387 -0.925 . . . . 71.31 109.251 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.582 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.8 tp -57.74 -52.45 65.4 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.082 -1.417 . . . . 72.54 111.799 -175.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 p -51.52 -48.02 63.11 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 124.014 0.821 . . . . 72.52 111.807 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.36 85.01 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.878 0.871 . . . . 72.02 111.691 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.7 mmmt -68.9 -38.47 79.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.71 -0.396 . . . . 72.43 111.638 177.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 99.0 mt -58.61 -30.95 67.64 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 123.335 0.654 . . . . 74.51 111.118 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -61.87 -30.97 71.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.743 0.417 . . . . 73.12 111.841 -178.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.7 t -84.08 -27.07 28.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.645 0.736 . . . . 62.5 110.185 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.435 ' CD1' HG22 ' A' ' 72' ' ' THR . 65.6 m-85 -89.75 -54.74 3.93 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.631 -0.713 . . . . 75.13 112.518 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.568 HD21 ' SD ' ' A' ' 44' ' ' MET . 9.9 mp -87.49 121.22 71.23 Favored Pre-proline 0 C--N 1.311 -1.088 0 N-CA-C 112.627 0.603 . . . . 74.5 112.627 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -84.14 -15.9 6.43 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 C-N-CA 122.105 1.87 . . . . 74.23 110.49 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 t -115.15 27.83 9.12 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.292 -0.867 . . . . 74.55 110.004 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.623 ' SD ' ' HB3' ' A' ' 37' ' ' LEU . 5.3 tpt -58.2 111.4 1.19 Allowed 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 113.828 1.047 . . . . 73.21 113.828 -174.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -99.6 68.63 1.58 Allowed 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 107.663 -1.236 . . . . 70.52 107.663 174.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.441 HD21 ' CG ' ' A' ' 44' ' ' MET . 3.0 pp -95.1 -20.64 19.12 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 114.888 -1.051 . . . . 75.41 111.068 -174.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.51 -17.9 50.16 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.124 -0.944 . . . . 74.52 110.696 -174.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.9 m -93.32 74.87 4.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.771 -1.104 . . . . 61.51 112.06 -175.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 p -89.91 84.73 6.23 Favored 'General case' 0 N--CA 1.412 -2.369 0 CA-C-O 121.944 0.878 . . . . 74.23 110.009 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -28.64 68.72 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 114.713 -1.13 . . . . 73.54 111.563 177.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -123.53 164.34 29.03 Favored Pre-proline 1 N--CA 1.369 -4.481 0 N-CA-C 105.215 -2.142 . . . . 74.12 105.215 177.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.476 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 29.0 Cg_endo -65.68 -155.19 0.03 OUTLIER 'Trans proline' 0 CA--C 1.551 1.345 0 C-N-CA 122.562 2.175 . . . . 74.34 112.592 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.7 m -75.52 37.45 0.14 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.453 0.701 . . . . 72.24 110.739 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.476 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 5.0 m-20 -60.59 147.54 83.31 Favored Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 124.822 1.249 . . . . 74.42 113.227 -176.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -43.52 -50.52 6.82 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 124.411 3.407 . . . . 74.54 113.688 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -74.89 -18.96 60.34 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 113.407 0.892 . . . . 72.44 113.407 -178.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.458 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 90.5 t -75.43 -42.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 N-CA-C 107.611 -1.255 . . . . 74.22 107.611 175.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.4 mm -66.2 -42.03 90.35 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-N 115.09 -0.959 . . . . 74.35 108.854 175.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -54.52 -45.74 73.42 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 124.878 1.271 . . . . 75.42 112.854 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 57' ' ' VAL . 6.7 ptm180 -64.59 -31.55 72.82 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-N 118.549 0.613 . . . . 75.42 111.792 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.0 mt-30 -72.52 -44.01 62.79 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.574 0.702 . . . . 75.52 109.435 -177.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.11 -33.09 65.37 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.859 -1.064 . . . . 75.3 110.429 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -56.83 -52.4 65.25 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 124.095 0.958 . . . . 75.32 109.854 175.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.486 ' CB ' HD22 ' A' ' 41' ' ' LEU . 21.8 mmt180 -56.71 -29.55 62.55 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.36 -1.291 . . . . 74.54 113.474 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.2 mt -68.79 -45.07 72.27 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 121.125 -0.23 . . . . 74.51 110.863 176.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -70.3 -25.21 63.22 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 119.807 -0.757 . . . . 71.12 109.62 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.19 -30.38 67.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.437 -0.801 . . . . 75.11 110.719 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -66.35 -38.72 88.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 109.003 -0.74 . . . . 75.41 109.003 177.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -179.59 139.56 3.91 Favored Glycine 0 N--CA 1.404 -3.449 0 CA-C-N 114.575 -1.193 . . . . 53.5 111.29 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.575 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -66.01 -31.47 72.39 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.022 -1.844 . . . . 75.15 106.022 171.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.64 -41.84 44.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.059 -1.428 . . . . 63.51 108.975 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.435 HG22 ' CD1' ' A' ' 40' ' ' PHE . 89.6 m -53.35 -41.27 65.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.845 0.458 . . . . 65.15 110.276 175.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.417 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.9 t-105 -62.63 -50.98 69.1 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.693 -0.685 . . . . 74.23 110.358 177.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 70' ' ' MET . 87.5 mttt -55.42 -42.76 74.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.616 0.366 . . . . 74.22 111.374 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.9 m -66.12 -46.99 75.6 Favored 'General case' 0 N--CA 1.409 -2.5 0 C-N-CA 123.355 0.662 . . . . 75.5 110.674 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -57.14 -50.83 71.59 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.746 -0.661 . . . . 74.31 110.624 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.428 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 32.1 mm -59.76 -32.77 50.31 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.439 -0.8 . . . . 75.54 111.607 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -64.71 -43.53 93.16 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.568 -0.53 . . . . 74.33 109.568 177.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -72.24 -37.9 69.02 Favored 'General case' 0 C--O 1.189 -2.096 0 CA-C-N 116.403 -0.362 . . . . 75.5 110.385 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.456 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.0 tm? -49.53 -54.59 17.16 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 125.402 1.481 . . . . 75.12 110.135 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.8 m -67.82 -35.21 78.21 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 115.942 -0.572 . . . . 73.04 111.09 -178.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -75.81 -48.77 20.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.838 -0.619 . . . . 73.31 111.393 -176.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -71.33 -27.06 63.11 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 122.906 0.482 . . . . 75.32 111.755 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.411 HD12 ' CD1' ' A' ' 25' ' ' LEU . 85.8 mt -92.26 -3.54 55.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 116.192 -0.458 . . . . 70.51 109.955 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 t70 59.24 38.72 23.29 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.021 1.328 . . . . 61.31 111.551 174.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 m -120.0 105.44 42.64 Favored Pre-proline 0 C--N 1.304 -1.375 0 CA-C-N 115.245 -0.889 . . . . 73.34 111.241 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.75 102.64 1.34 Allowed 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 121.963 1.776 . . . . 64.42 108.959 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.2 mt -96.79 -14.94 21.6 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.437 0.532 . . . . 74.52 112.437 -173.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.401 ' C ' ' H ' ' A' ' 91' ' ' GLU . 7.7 t70 70.69 -64.84 0.36 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 124.709 1.204 . . . . 72.22 110.572 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.411 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 23.9 ptp -77.31 35.11 0.17 Allowed 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.68 1.592 . . . . 74.22 112.411 -175.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.695 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 17.8 tt0 -58.9 -36.12 74.17 Favored 'General case' 0 C--O 1.186 -2.246 0 C-N-CA 125.831 1.652 . . . . 74.4 110.039 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.5 ' O ' HG22 ' A' ' 95' ' ' VAL . 47.1 mm -70.88 -45.29 15.72 Favored Pre-proline 0 C--O 1.176 -2.791 0 O-C-N 121.268 -0.895 . . . . 71.5 109.484 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.447 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 21.4 Cg_exo -47.62 -38.21 28.31 Favored 'Trans proline' 0 CA--C 1.554 1.498 0 CA-C-N 121.2 1.464 . . . . 71.14 111.855 164.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.695 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 8.9 mp -59.6 -47.74 84.39 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 108.688 -0.856 . . . . 74.53 108.688 171.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.618 HG11 ' O ' ' A' ' 91' ' ' GLU . 3.7 m -64.91 -35.63 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 CA-C-O 122.267 1.032 . . . . 72.21 111.381 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.0 t -83.94 6.05 23.23 Favored 'General case' 0 C--N 1.276 -2.62 0 C-N-CA 125.715 1.606 . . . . 63.03 111.87 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.452 HG12 ' CE3' ' A' ' 19' ' ' TRP . 3.0 tp -65.47 -18.56 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 108.336 -0.987 . . . . 74.2 108.336 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 75.3 t90 . . . . . 0 N--CA 1.42 -1.96 0 C-N-CA 125.541 1.536 . . . . 74.54 108.194 176.51 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.9 ttm . . . . . 0 C--O 1.238 0.474 0 CA-C-O 123.305 1.526 . . . . 71.4 107.466 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -157.41 26.08 0.29 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.335 -2.211 . . . . 75.14 108.312 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.544 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -61.81 -13.34 23.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.286 -0.87 . . . . 70.34 112.955 -178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.63 -37.62 84.63 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.652 0.781 . . . . 75.51 109.745 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.1 m -75.78 -17.66 59.79 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-N 114.051 -1.432 . . . . 70.22 110.541 -174.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.544 HG12 ' HA ' ' A' ' 8' ' ' ALA . 6.6 mm -87.6 -44.31 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 CA-C-N 115.412 -0.813 . . . . 74.44 110.247 -174.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -104.13 -45.33 4.75 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 114.431 1.271 . . . . 74.45 114.431 -174.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 54.91 83.64 0.08 Allowed 'General case' 0 C--N 1.344 0.368 0 N-CA-C 108.896 -0.779 . . . . 73.33 108.896 -166.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.466 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 5.5 t-20 -120.31 -168.51 1.64 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.122 -0.49 . . . . 72.34 110.109 -170.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.674 ' O ' HD13 ' A' ' 18' ' ' LEU . 5.6 t-20 -148.98 -173.05 4.26 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 109.19 -0.671 . . . . 74.35 109.19 -176.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -48.14 -27.48 2.39 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 128.192 2.597 . . . . 73.23 114.099 -171.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -57.98 -28.97 64.86 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 123.09 0.556 . . . . 73.41 110.975 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.674 HD13 ' O ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -62.17 -33.33 74.32 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.533 -0.758 . . . . 75.05 110.653 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.486 ' N ' HD12 ' A' ' 18' ' ' LEU . 75.9 t-105 -68.43 -32.43 72.46 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-N 115.672 -0.695 . . . . 75.33 110.117 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.95 -31.18 70.73 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.093 0.473 . . . . 74.11 109.971 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.569 ' CZ2' ' HG ' ' A' ' 25' ' ' LEU . 73.4 t90 -63.09 -50.07 71.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.635 -0.876 . . . . 73.51 108.635 173.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.06 -53.23 58.52 Favored 'General case' 0 CA--C 1.516 -0.361 0 O-C-N 124.509 1.13 . . . . 73.43 110.415 -176.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.8 t -53.82 -53.64 25.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 O-C-N 123.8 0.688 . . . . 72.25 112.052 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.425 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 26.6 mmt180 -74.57 -32.01 62.25 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 113.233 0.827 . . . . 75.12 113.233 -176.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.569 ' HG ' ' CZ2' ' A' ' 21' ' ' TRP . 1.8 tm? -70.59 -42.64 70.75 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.699 -0.852 . . . . 71.53 108.699 -178.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.2 mt -70.76 -24.63 62.64 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.924 -0.58 . . . . 71.11 111.185 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 p -69.71 -11.95 61.25 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.907 0.86 . . . . 64.24 108.854 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.9 mtmt -99.56 -9.87 22.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.307 -0.627 . . . . 63.42 109.307 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.448 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.3 m-80 -133.62 53.39 10.2 Favored Pre-proline 0 C--O 1.24 0.578 0 CA-C-N 115.664 -0.698 . . . . 72.53 111.934 -175.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.448 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -70.07 -22.19 31.01 Favored 'Trans proline' 0 C--N 1.363 1.335 0 N-CA-C 108.472 -1.395 . . . . 72.22 108.472 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.11 -41.86 85.49 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 113.325 -1.762 . . . . 72.25 109.929 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.517 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 73.5 t90 -73.83 -43.04 59.95 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 119.646 -0.822 . . . . 73.44 109.47 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.487 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.0 tm? -60.36 -43.26 96.71 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.105 -0.952 . . . . 74.32 110.344 -174.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 m -63.98 -35.16 79.77 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 120.799 0.333 . . . . 71.21 111.625 178.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.26 80.49 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 121.261 0.553 . . . . 74.21 110.172 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.5 mmtt -76.74 -40.61 47.95 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.117 -0.633 . . . . 75.44 112.609 173.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 78.0 mt -51.56 -41.7 61.32 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.189 0.596 . . . . 75.41 111.938 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.418 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 0.1 OUTLIER -59.54 -28.06 66.76 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.383 1.253 . . . . 74.43 114.383 -177.673 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.4 t -77.06 -40.45 46.22 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 115.745 -0.661 . . . . 72.34 110.133 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -81.84 -47.25 13.04 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 123.655 0.782 . . . . 74.54 112.637 -176.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 mp -80.9 124.89 81.17 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 123.379 0.672 . . . . 73.44 109.867 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -72.01 -36.47 5.88 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.045 2.497 . . . . 75.31 114.014 -177.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.5 p -106.12 -5.59 19.26 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.775 0.798 . . . . 71.23 110.316 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.418 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 2.0 mpp? 40.68 92.18 0.01 OUTLIER 'General case' 0 N--CA 1.408 -2.572 0 C-N-CA 127.69 2.396 . . . . 72.03 115.735 -175.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -101.62 70.03 1.25 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 122.733 1.254 . . . . 65.05 108.459 168.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -95.79 -5.13 42.59 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 113.146 -1.843 . . . . 65.3 110.607 -176.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -75.84 47.35 0.42 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.388 1.475 . . . . 71.24 110.436 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.4 m -86.08 -3.47 58.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.629 -0.714 . . . . 74.54 112.715 -176.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 50.7 m -82.95 65.39 8.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.769 0.795 . . . . 63.31 112.733 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.41 -28.22 37.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-O 122.921 1.343 . . . . 75.42 109.931 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.415 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 54.1 mt-10 -116.22 173.39 3.06 Favored Pre-proline 1 N--CA 1.375 -4.185 0 N-CA-C 104.919 -2.252 . . . . 73.44 104.919 175.91 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 50.8 Cg_endo -66.85 -156.52 0.03 OUTLIER 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 121.296 1.331 . . . . 70.04 112.074 175.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.6 m -76.1 38.4 0.17 Allowed 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.194 0.998 . . . . 62.11 112.417 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -60.08 148.39 77.96 Favored Pre-proline 0 N--CA 1.438 -1.054 0 C-N-CA 125.156 1.382 . . . . 74.52 112.308 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.61 -32.93 97.74 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 123.129 2.553 . . . . 65.11 112.781 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.2 mp0 -68.95 -40.39 78.96 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.591 -0.892 . . . . 62.12 108.591 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 78.1 t -63.59 -48.57 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 CA-C-N 114.191 -1.368 . . . . 74.31 109.234 178.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.446 ' HA ' HE21 ' A' ' 61' ' ' GLN . 46.4 mm -59.81 -46.58 93.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.223 -0.899 . . . . 72.44 110.443 177.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -57.15 -38.8 74.08 Favored 'General case' 0 C--O 1.202 -1.406 0 CA-C-O 119.404 -0.331 . . . . 71.42 111.59 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -61.39 -40.56 94.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.851 0.834 . . . . 74.34 111.281 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.446 HE21 ' HA ' ' A' ' 58' ' ' ILE . 50.1 mt-30 -67.23 -47.15 71.67 Favored 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.434 -1.257 . . . . 74.31 110.317 -177.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.94 -31.04 67.52 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.553 -1.203 . . . . 73.52 111.151 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -54.78 -51.13 66.72 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 124.616 1.166 . . . . 71.42 110.015 176.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -55.14 -31.33 61.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.66 -1.154 . . . . 73.23 113.077 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.8 mt -72.64 -43.73 62.84 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 112.273 0.472 . . . . 64.14 112.273 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -69.96 -25.61 63.72 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.717 -0.846 . . . . 75.55 108.717 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.02 -31.27 68.83 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.338 -0.846 . . . . 73.04 110.832 174.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -68.21 -41.6 81.08 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 109.049 -0.723 . . . . 72.42 109.049 176.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.79 142.34 4.79 Favored Glycine 0 N--CA 1.421 -2.328 0 CA-C-N 114.986 -1.006 . . . . 64.24 112.365 -177.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.2 ptm -69.17 -26.57 64.92 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 106.498 -1.667 . . . . 70.21 106.498 170.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.67 -46.9 28.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 113.684 -1.598 . . . . 74.34 108.004 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.9 m -53.55 -41.72 66.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.836 0.71 . . . . 75.31 110.339 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.556 ' O ' HG12 ' A' ' 77' ' ' ILE . 75.9 t-105 -60.17 -49.43 77.67 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.424 -0.807 . . . . 74.23 111.466 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 9.4 ptpt -69.59 -35.02 74.94 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 121.134 0.492 . . . . 74.53 111.479 -174.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.0 m -67.58 -42.45 82.49 Favored 'General case' 0 N--CA 1.405 -2.712 0 CA-C-N 115.632 -0.713 . . . . 71.23 110.361 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.4 -49.62 75.62 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.601 0.761 . . . . 74.44 111.522 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 73' ' ' TRP . 47.2 mm -59.0 -33.87 51.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.466 -0.788 . . . . 74.25 111.852 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.1 -39.02 93.15 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.965 0.412 . . . . 71.32 110.266 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.437 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 2.4 m-20 -74.51 -36.01 63.2 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.942 0.401 . . . . 71.41 110.474 176.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.517 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.0 tm? -54.4 -54.54 39.2 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.715 1.206 . . . . 71.54 110.225 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 29.9 p -66.9 -32.67 74.07 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.81 -0.632 . . . . 75.33 111.394 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -71.27 -54.75 9.79 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.04 -0.982 . . . . 74.24 111.926 -176.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 19.8 mt-10 -73.31 -22.28 60.37 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 112.52 0.563 . . . . 72.42 112.52 -171.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.9 mt -86.97 -2.26 58.48 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.492 -0.483 . . . . 63.24 111.548 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 t70 72.9 -32.02 0.24 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 114.546 1.313 . . . . 70.52 114.546 174.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.439 ' O ' HD22 ' A' ' 88' ' ' LEU . 61.4 t -48.68 124.43 12.24 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 124.367 1.067 . . . . 73.35 111.891 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -80.27 44.01 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.462 2.774 . . . . 75.4 111.696 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.48 HD11 ' CZ3' ' A' ' 21' ' ' TRP . 2.0 pt? -62.88 -48.47 78.83 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.506 -0.315 . . . . 73.31 111.326 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.404 ' N ' ' HG ' ' A' ' 88' ' ' LEU . 48.2 m-20 56.3 31.27 18.25 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.139 0.971 . . . . 65.32 111.856 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.63 ' SD ' ' HB2' ' A' ' 18' ' ' LEU . 50.4 mtt -99.76 13.99 31.78 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.116 -1.068 . . . . 64.13 108.116 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.649 ' O ' HG11 ' A' ' 95' ' ' VAL . 3.3 tt0 -47.14 -60.92 2.15 Favored 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 125.184 1.394 . . . . 73.52 113.35 -174.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -64.14 -44.03 75.9 Favored Pre-proline 0 C--O 1.201 -1.48 0 CA-C-N 119.111 0.869 . . . . 74.32 111.717 -178.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -48.37 -35.49 27.98 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 121.476 1.451 . . . . 74.23 111.763 170.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.555 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 3.3 mm? -67.98 -51.97 41.23 Favored 'General case' 0 C--O 1.202 -1.406 0 N-CA-C 109.078 -0.712 . . . . 71.54 109.078 169.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.649 HG11 ' O ' ' A' ' 91' ' ' GLU . 2.7 m -60.44 -37.57 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-O 122.062 0.934 . . . . 73.12 113.204 -171.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.1 t -93.52 6.17 49.11 Favored 'General case' 0 C--N 1.26 -3.312 0 CA-C-N 114.146 -1.388 . . . . 73.33 111.774 -174.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.427 HG22 ' O ' ' A' ' 94' ' ' LEU . 8.3 tt -55.24 -39.73 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 112.833 0.679 . . . . 73.35 112.833 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 43.7 m95 . . . . . 0 N--CA 1.411 -2.377 0 N-CA-C 107.608 -1.256 . . . . 73.51 107.608 179.559 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 9' ' ' GLU . 2.2 mpt? . . . . . 0 C--O 1.206 -1.223 0 N-CA-C 111.961 0.356 . . . . 74.23 111.961 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.33 25.33 1.21 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 113.328 0.862 . . . . 73.22 113.328 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.21 -15.7 58.56 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-O 121.821 0.82 . . . . 61.11 108.987 172.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.511 ' CB ' ' HB2' ' A' ' 96' ' ' SER . 0.0 OUTLIER -56.68 -41.36 77.16 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.643 1.177 . . . . 74.24 114.001 -179.251 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.432 ' HB2' HD13 ' A' ' 11' ' ' ILE . 74.7 m -55.06 -36.64 65.81 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 125.058 1.343 . . . . 64.15 110.36 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.472 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -81.73 -29.71 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.969 0 C-N-CA 125.164 1.386 . . . . 75.12 109.672 -175.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -76.6 -64.88 1.02 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.87 -0.604 . . . . 73.53 112.486 -177.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -175.42 -75.98 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 110.048 -0.353 . . . . 73.33 110.048 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.6 t30 65.31 109.12 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.377 1.071 . . . . 73.11 111.644 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -172.78 163.4 5.07 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 122.358 -0.214 . . . . 74.23 110.463 -176.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.04 -27.88 35.03 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.519 1.528 . . . . 73.02 111.472 177.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.2 -28.13 62.59 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 112.599 0.592 . . . . 72.41 112.599 177.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.494 HD12 HD22 ' A' ' 94' ' ' LEU . 3.6 mm? -71.1 -34.59 71.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.219 0.533 . . . . 72.1 109.741 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -65.98 -42.34 89.98 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.401 -0.818 . . . . 75.13 110.236 -178.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.72 -42.65 97.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.061 -0.518 . . . . 72.45 110.35 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -59.41 -50.44 73.93 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.103 -0.499 . . . . 74.21 110.531 176.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -57.3 -53.31 59.61 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.94 0.775 . . . . 75.43 109.551 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.36 -46.96 94.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 112.849 0.685 . . . . 62.55 112.849 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -72.3 -36.79 69.03 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 112.301 0.482 . . . . 72.1 112.301 -174.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.67 -40.8 63.41 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.943 -0.762 . . . . 74.05 108.943 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 3.6 mt -71.36 -24.14 62.04 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 112.656 0.613 . . . . 73.2 112.656 178.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.0 t -62.81 -20.96 65.54 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.275 -1.009 . . . . 73.22 108.275 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -97.46 -0.05 46.8 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.061 0.458 . . . . 75.11 110.218 177.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.426 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.2 m-80 -139.36 54.66 6.22 Favored Pre-proline 0 C--O 1.245 0.825 0 C-N-CA 122.886 0.474 . . . . 73.51 111.352 -177.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.426 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -71.22 -21.66 26.67 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.247 1.298 . . . . 74.3 108.808 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -71.71 -36.61 70.59 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 113.625 -1.625 . . . . 74.42 110.437 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.484 ' CZ2' ' HA ' ' A' ' 80' ' ' LEU . 82.0 t90 -75.0 -48.09 25.85 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 119.518 -0.873 . . . . 73.1 110.016 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.551 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -56.76 -45.65 81.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.822 -1.081 . . . . 70.54 111.172 -172.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.432 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 10.6 p -57.81 -44.93 86.71 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.126 -0.488 . . . . 74.11 112.21 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.87 -44.35 78.03 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 124.106 0.963 . . . . 64.11 111.598 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 39' ' ' SER . 70.7 mmtt -71.38 -29.67 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.933 -0.307 . . . . 74.25 111.548 176.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.6 mt -62.7 -36.07 81.74 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 110.263 -0.273 . . . . 73.43 110.263 174.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -63.39 -35.22 79.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.63 0.729 . . . . 75.25 109.769 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.8 m -71.91 -47.47 52.33 Favored 'General case' 0 N--CA 1.392 -3.374 0 C-N-CA 124.883 1.273 . . . . 71.13 111.902 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.54 ' CD1' HG21 ' A' ' 72' ' ' THR . 52.8 m-85 -84.61 -46.48 11.48 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 114.059 1.133 . . . . 73.14 114.059 -174.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.54 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.9 mm? -95.85 112.83 60.61 Favored Pre-proline 0 N--CA 1.424 -1.739 0 C-N-CA 122.317 0.247 . . . . 74.51 110.423 -175.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.83 -37.9 18.97 Favored 'Trans proline' 0 C--O 1.217 -0.542 0 C-N-CA 122.303 2.002 . . . . 72.44 111.193 178.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.8 t -103.95 30.15 5.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.613 -0.722 . . . . 73.3 110.787 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.464 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -43.61 131.78 5.06 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 115.294 1.59 . . . . 73.0 115.294 178.343 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -124.81 59.77 1.2 Allowed 'General case' 0 C--N 1.276 -2.598 0 CA-C-N 114.499 -1.228 . . . . 73.22 109.198 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.2 pp -84.55 -16.53 41.93 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.336 -1.302 . . . . 74.14 110.079 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.35 -18.14 62.39 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 114.927 -1.033 . . . . 75.51 110.124 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.9 m -80.69 84.4 6.25 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 114.511 -1.222 . . . . 52.21 108.87 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 m -117.19 78.41 1.22 Allowed 'General case' 0 N--CA 1.424 -1.769 0 CA-C-O 121.915 0.864 . . . . 74.04 109.792 -177.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -63.89 1.14 Allowed 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 113.543 -1.662 . . . . 72.32 111.334 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -99.78 162.02 22.49 Favored Pre-proline 1 C--N 1.237 -4.313 0 CA-C-N 113.823 -1.535 . . . . 74.52 109.372 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.49 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 17.8 Cg_endo -62.66 -150.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.561 1.84 0 C-N-CA 124.085 3.19 . . . . 73.34 113.154 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.425 ' H ' ' HB2' ' A' ' 52' ' ' PRO . 16.5 m -75.34 37.79 0.13 Allowed 'General case' 0 CA--C 1.572 1.795 0 C-N-CA 123.655 0.782 . . . . 74.42 112.365 -175.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.49 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 6.0 m-20 -65.54 150.25 96.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 C-N-CA 125.926 1.69 . . . . 73.45 112.687 -178.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.3 -47.48 27.19 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.717 2.944 . . . . 71.1 113.382 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -71.76 -25.73 62.15 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 112.971 0.73 . . . . 72.44 112.971 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.518 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 95.7 t -66.21 -42.97 92.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.196 0 N-CA-C 108.485 -0.932 . . . . 75.33 108.485 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.422 ' O ' HD22 ' A' ' 62' ' ' LEU . 49.4 mm -67.14 -46.01 85.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.051 -0.977 . . . . 64.0 109.215 175.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -54.22 -40.1 67.34 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.114 0.966 . . . . 72.44 110.981 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -54.98 -55.69 27.99 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.768 0.794 . . . . 73.13 110.712 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 60.4 mt-30 -62.26 -34.69 77.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.256 -1.338 . . . . 74.45 110.932 -176.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.422 HD22 ' O ' ' A' ' 58' ' ' ILE . 4.3 mm? -77.04 -35.6 56.76 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-N 114.903 -1.044 . . . . 73.5 111.926 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.416 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 0.2 OUTLIER -57.46 -35.88 70.72 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.227 1.011 . . . . 71.03 108.695 177.321 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.54 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 12.5 mmt180 -55.37 -42.72 74.33 Favored 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.486 -1.233 . . . . 72.52 111.534 175.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.6 mt -72.22 -33.7 67.77 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.026 0.441 . . . . 73.44 110.085 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.506 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 90.5 t80 -58.34 -31.17 67.33 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.839 -1.073 . . . . 71.41 109.482 174.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.59 -34.19 53.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.445 -0.798 . . . . 73.34 111.54 177.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -67.39 -56.7 8.63 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.116 0.413 . . . . 74.31 112.116 -178.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.67 143.46 5.26 Favored Glycine 0 CA--C 1.474 -2.519 0 C-N-CA 120.005 -1.093 . . . . 71.22 113.299 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.514 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.6 ptt? -70.61 -28.48 64.88 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 107.106 -1.442 . . . . 72.01 107.106 169.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.73 -35.78 65.1 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 114.41 -1.268 . . . . 74.23 107.949 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.54 HG21 ' CD1' ' A' ' 40' ' ' PHE . 98.9 m -65.8 -38.9 90.21 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.616 -1.175 . . . . 75.32 109.747 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.45 ' O ' HG12 ' A' ' 77' ' ' ILE . 36.9 t-105 -64.37 -42.11 96.36 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 108.921 -0.77 . . . . 75.41 108.921 177.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.534 ' HG2' HG21 ' A' ' 95' ' ' VAL . 93.5 mttt -55.76 -51.78 66.21 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.583 0.353 . . . . 74.22 110.87 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.4 m -61.89 -39.75 93.06 Favored 'General case' 0 N--CA 1.408 -2.539 0 C-N-CA 123.761 0.824 . . . . 70.14 110.719 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -62.8 -52.96 61.15 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.826 -1.079 . . . . 74.24 111.618 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 73' ' ' TRP . 27.0 mm -69.13 -32.07 52.59 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 119.843 -0.743 . . . . 75.24 110.352 -175.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -57.04 -52.15 66.4 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.893 -1.049 . . . . 72.44 108.807 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.441 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 4.7 m-20 -67.42 -38.44 84.6 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 115.312 -0.858 . . . . 70.12 111.648 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.484 ' HA ' ' CZ2' ' A' ' 32' ' ' TRP . 2.6 tm? -51.16 -55.62 16.94 Favored 'General case' 0 C--N 1.311 -1.096 0 C-N-CA 124.711 1.204 . . . . 75.45 110.502 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.553 ' SG ' ' HB3' ' A' ' 91' ' ' GLU . 56.1 m -68.54 -32.93 73.21 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.872 -0.603 . . . . 64.41 111.204 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -70.98 -46.27 62.61 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.557 -0.747 . . . . 75.22 112.048 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 15.1 mt-10 -83.8 -19.62 34.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 113.175 0.806 . . . . 74.43 113.175 -173.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 72.7 mt -79.93 33.32 0.27 Allowed 'General case' 0 C--O 1.243 0.728 0 N-CA-C 113.145 0.794 . . . . 75.22 113.145 -177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 76.32 -27.12 0.18 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.906 1.682 . . . . 72.11 114.27 171.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.8 p -136.93 105.8 8.85 Favored Pre-proline 0 C--N 1.296 -1.75 0 CA-C-O 120.953 0.406 . . . . 73.2 111.503 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.8 83.7 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.014 1.809 . . . . 70.32 109.675 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.17 -6.96 54.93 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.627 1.343 . . . . 73.23 114.627 -175.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.9 t70 54.46 81.19 0.11 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.983 1.475 . . . . 74.14 114.983 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 24.1 ptm -153.11 22.37 0.56 Allowed 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 105.546 -2.02 . . . . 71.11 105.546 172.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.553 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 9.2 pt-20 -70.54 -36.32 73.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 112.77 -2.014 . . . . 64.11 111.512 -173.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.531 ' HA ' HG13 ' A' ' 95' ' ' VAL . 47.2 mm -69.39 -49.13 23.98 Favored Pre-proline 0 C--N 1.277 -2.567 0 CA-C-N 115.977 -0.556 . . . . 73.4 110.793 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -50.72 -44.47 40.61 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.091 1.861 . . . . 73.13 111.54 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.494 HD22 HD12 ' A' ' 18' ' ' LEU . 4.2 mm? -62.76 -39.19 93.4 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.642 0.608 . . . . 72.25 112.642 175.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.534 HG21 ' HG2' ' A' ' 74' ' ' LYS . 5.7 p -75.5 -32.64 25.52 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.122 0 CA-C-O 122.131 0.967 . . . . 73.13 113.105 -177.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.511 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . 21.9 t -58.67 -20.21 46.19 Favored 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 114.075 -1.42 . . . . 71.15 111.521 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 3.6 tt -67.58 -16.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 116.183 -0.462 . . . . 75.31 111.664 -175.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.506 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 61.4 t90 . . . . . 0 N--CA 1.445 -0.697 0 N-CA-C 109.311 -0.626 . . . . 73.51 109.311 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.6 ptp . . . . . 0 CA--C 1.507 -0.687 0 CA-C-O 121.638 0.732 . . . . 74.03 109.135 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.65 71.99 1.43 Allowed 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 126.208 1.803 . . . . 74.34 112.749 -171.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.24 -34.41 49.18 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 114.422 -1.263 . . . . 73.11 110.188 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.508 ' CD ' ' HB3' ' A' ' 96' ' ' SER . 0.0 OUTLIER -57.53 -31.46 66.1 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 124.079 0.951 . . . . 74.4 111.288 -178.036 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.6 m -60.29 -30.14 69.29 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 125.043 1.337 . . . . 73.35 111.089 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.1 mp -87.36 -20.43 7.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 114.512 -1.222 . . . . 74.41 109.824 -176.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.558 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.6 mmm180 -107.38 -66.69 1.01 Allowed 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 112.706 0.632 . . . . 74.52 112.706 -177.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 12' ' ' ARG . 11.4 mt 170.63 173.84 0.07 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.089 1.756 . . . . 75.34 110.562 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.7 p30 -160.19 170.29 21.47 Favored 'General case' 0 C--O 1.252 1.231 0 N-CA-C 107.208 -1.404 . . . . 75.02 107.208 172.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -160.45 167.86 26.37 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 118.096 0.407 . . . . 73.42 110.839 -176.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.59 -28.07 12.99 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 126.073 1.749 . . . . 72.45 112.717 178.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -57.03 -29.33 63.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.588 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.33 -43.15 91.87 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.185 0.517 . . . . 62.23 110.362 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -69.22 -46.44 67.38 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.305 -0.861 . . . . 75.2 110.706 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.79 97.97 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 71.01 111.443 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 -56.48 -49.31 75.03 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.025 -0.534 . . . . 71.43 110.537 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.8 -53.29 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 123.834 0.709 . . . . 74.45 110.211 -178.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.14 -50.3 78.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 112.612 0.597 . . . . 75.44 112.612 -176.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 5.1 tpm_? -72.65 -33.73 66.8 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.973 -0.291 . . . . 75.42 110.54 -175.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.81 -44.88 69.12 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.548 -0.908 . . . . 64.33 108.548 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.425 HD11 HD22 ' A' ' 33' ' ' LEU . 3.6 mt -71.44 -24.48 62.03 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.604 -0.725 . . . . 55.55 112.118 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 p -67.81 -15.67 63.74 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 108.766 -0.827 . . . . 75.35 108.766 177.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 34.6 mtmt -97.39 -4.1 39.02 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 121.729 0.776 . . . . 75.22 109.39 179.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.452 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.1 m-80 -138.78 54.92 7.12 Favored Pre-proline 0 C--O 1.243 0.73 0 CA-C-N 115.128 -0.942 . . . . 65.23 110.638 -176.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.452 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 9.2 Cg_exo -72.29 -21.22 23.49 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 121.437 1.425 . . . . 64.15 108.698 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -71.68 -39.76 70.04 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 114.224 -1.353 . . . . 70.35 109.944 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.597 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 72.2 t90 -74.2 -42.7 59.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.242 -0.983 . . . . 74.01 109.823 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.458 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.2 tm? -62.93 -44.57 95.7 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.074 -0.966 . . . . 75.01 110.654 -174.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.535 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 15.8 p -57.89 -47.68 82.07 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.652 0.263 . . . . 73.3 111.524 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.63 67.98 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 124.315 1.046 . . . . 71.0 111.468 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.597 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 32.8 mmmt -72.09 -32.82 67.37 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 120.642 -0.423 . . . . 73.12 111.058 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.3 mt -61.88 -32.9 73.3 Favored 'General case' 0 C--O 1.191 -1.976 0 N-CA-C 109.894 -0.41 . . . . 72.22 109.894 174.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' A' ' 34' ' ' SER . 39.8 mtt180 -64.67 -28.64 69.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.08 0.467 . . . . 75.25 110.885 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.6 t -84.72 -41.38 16.28 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.463 -0.79 . . . . 74.34 110.563 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.525 ' CD1' HG21 ' A' ' 72' ' ' THR . 66.7 m-85 -82.22 -46.24 13.99 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.781 0.66 . . . . 75.04 112.781 -177.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 7.0 mp -88.6 120.49 70.26 Favored Pre-proline 0 C--N 1.305 -1.345 0 C-N-CA 124.02 0.928 . . . . 75.14 110.107 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.14 -24.39 12.64 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 121.914 1.743 . . . . 75.32 111.113 177.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.4 p -114.97 28.51 8.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 123.809 0.844 . . . . 71.42 110.945 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.46 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.4 98.81 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.693 1.368 . . . . 73.22 114.693 -174.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -103.33 72.87 1.18 Allowed 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.899 1.333 . . . . 65.03 107.44 176.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 pp -96.14 -12.5 24.64 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 113.375 -1.738 . . . . 62.05 113.538 -173.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -83.4 -11.15 57.91 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.468 0.651 . . . . 74.24 111.131 -174.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.6 t -72.78 106.75 4.87 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 115.023 -0.989 . . . . 71.24 109.216 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.8 p -139.23 87.13 2.17 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.913 0.863 . . . . 70.3 112.001 -177.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.32 -25.85 60.81 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.645 -1.161 . . . . 71.42 112.116 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -129.63 161.86 56.64 Favored Pre-proline 0 N--CA 1.381 -3.889 0 CA-C-N 113.629 -1.623 . . . . 62.54 107.446 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -68.37 -148.85 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.928 2.419 . . . . 74.33 111.617 173.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.1 m -75.27 37.86 0.13 Allowed 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 124.419 1.088 . . . . 60.21 112.705 -175.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.406 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 7.3 m-20 -58.05 147.04 66.72 Favored Pre-proline 0 N--CA 1.436 -1.166 0 C-N-CA 125.025 1.33 . . . . 73.02 111.27 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -53.35 -34.9 72.82 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 123.892 3.062 . . . . 74.41 112.377 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -73.23 -39.95 65.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.79 -0.641 . . . . 75.33 109.341 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.406 ' CG2' ' HB2' ' A' ' 54' ' ' ASN . 96.3 t -67.46 -44.69 86.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.618 -1.174 . . . . 75.11 109.248 -178.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.417 ' O ' HD22 ' A' ' 62' ' ' LEU . 46.3 mm -63.44 -43.45 98.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.457 -0.792 . . . . 73.34 109.669 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 12.8 t-160 -58.13 -37.28 74.32 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 116.229 -0.442 . . . . 75.31 111.128 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.94 -44.84 96.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.315 0.578 . . . . 74.33 111.109 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.4 ' OE1' HD12 ' A' ' 33' ' ' LEU . 70.3 mt-30 -64.52 -47.08 80.2 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.144 -0.935 . . . . 63.43 110.115 -178.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.417 HD22 ' O ' ' A' ' 58' ' ' ILE . 4.3 mm? -68.83 -30.77 69.39 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.326 -1.306 . . . . 63.53 111.656 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 4.7 t30 -61.26 -37.39 82.96 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 123.853 0.861 . . . . 74.21 109.62 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -59.37 -31.36 69.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.868 -1.06 . . . . 75.53 112.041 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.18 -43.73 64.11 Favored 'General case' 0 CA--C 1.501 -0.916 0 N-CA-C 109.635 -0.506 . . . . 73.52 109.635 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -61.04 -39.54 90.2 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.409 -0.96 . . . . 74.22 108.409 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.42 66.12 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.918 -1.037 . . . . 74.42 111.957 177.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -81.45 -50.24 9.67 Favored 'General case' 0 N--CA 1.415 -2.175 0 N-CA-C 108.605 -0.887 . . . . 73.01 108.605 173.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.421 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -179.02 143.23 5.69 Favored Glycine 0 CA--C 1.477 -2.29 0 CA-C-N 115.508 -0.769 . . . . 75.22 112.563 -175.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -26.77 64.01 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 106.772 -1.566 . . . . 74.41 106.772 170.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.39 -36.96 68.8 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.121 -1.4 . . . . 72.34 108.201 174.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.525 HG21 ' CD1' ' A' ' 40' ' ' PHE . 53.0 m -62.39 -33.94 75.74 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.916 -1.038 . . . . 73.31 110.733 177.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -66.48 -38.58 87.62 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.323 -0.621 . . . . 74.4 109.323 178.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.618 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 8.8 mtmt -68.31 -32.23 72.21 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 113.205 0.817 . . . . 73.23 113.205 176.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.3 m -68.33 -38.15 81.26 Favored 'General case' 0 N--CA 1.402 -2.837 0 CA-C-O 121.953 0.882 . . . . 74.43 109.063 171.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -65.52 -53.84 36.66 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 114.365 -1.289 . . . . 62.23 112.966 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -64.04 -32.14 56.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.993 0 CA-C-N 118.611 0.642 . . . . 74.23 111.245 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.15 -42.39 99.21 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.4 -0.818 . . . . 72.11 109.331 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 83.1 m-20 -74.94 -41.19 60.12 Favored 'General case' 0 C--O 1.193 -1.878 0 CA-C-N 115.959 -0.564 . . . . 75.43 111.175 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.427 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.4 tm? -50.12 -53.98 23.71 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 125.454 1.502 . . . . 72.0 110.505 -179.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.402 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 50.8 t -66.76 -34.43 77.82 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.207 -0.906 . . . . 64.5 110.702 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -75.75 -50.19 15.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.333 -0.849 . . . . 74.03 112.381 -175.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.474 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 36.1 mt-10 -75.32 -28.36 59.62 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 112.196 0.443 . . . . 71.01 112.196 -173.039 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.8 mt -85.16 -13.64 49.48 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.261 -0.644 . . . . 72.04 109.261 176.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.7 t70 54.01 57.84 5.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.261 1.424 . . . . 74.12 110.743 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 6.0 m -134.52 108.09 11.05 Favored Pre-proline 0 C--N 1.301 -1.529 0 CA-C-N 114.012 -1.449 . . . . 61.55 109.392 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -63.43 111.0 1.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.279 1.986 . . . . 74.12 109.66 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.402 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 41.2 mt -82.91 -39.8 21.02 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.852 -0.739 . . . . 74.14 109.272 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 62.19 12.25 4.98 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.228 1.011 . . . . 74.51 110.688 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 18.8 ttt -157.25 34.26 0.28 Allowed 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 106.949 -1.5 . . . . 75.05 106.949 -176.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.97 -34.5 71.48 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-N 114.458 -1.246 . . . . 74.01 109.632 -179.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.512 ' HA ' HG12 ' A' ' 95' ' ' VAL . 49.0 mm -63.35 -50.5 73.93 Favored Pre-proline 0 C--N 1.288 -2.074 0 CA-C-N 115.319 -0.855 . . . . 60.53 111.989 -177.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.464 ' HA ' ' OE1' ' A' ' 9' ' ' GLU . 50.4 Cg_exo -58.7 -24.38 70.7 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 121.782 1.654 . . . . 70.44 111.756 172.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -31.95 62.52 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.898 -1.149 . . . . 75.43 107.898 177.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.618 ' CG2' ' HA ' ' A' ' 74' ' ' LYS . 9.0 p -88.2 -46.72 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.949 0 N-CA-C 113.949 1.092 . . . . 75.01 113.949 -178.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.508 ' HB3' ' CD ' ' A' ' 9' ' ' GLU . 4.0 t -78.73 3.44 16.56 Favored 'General case' 0 C--N 1.27 -2.871 0 CA-C-N 115.627 -0.715 . . . . 65.42 110.846 -175.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.427 HG22 ' CD1' ' A' ' 98' ' ' TRP . 17.2 tt -56.81 -40.01 68.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.347 0.659 . . . . 75.24 109.952 176.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.427 ' CD1' HG22 ' A' ' 97' ' ' ILE . 46.6 m95 . . . . . 0 N--CA 1.448 -0.553 0 N-CA-C 108.924 -0.769 . . . . 75.41 108.924 178.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 53.1 tpp . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 121.785 0.803 . . . . 75.13 110.639 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.08 24.99 12.34 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.729 -0.669 . . . . 62.11 109.674 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.49 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.64 -9.54 59.42 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 114.966 -1.015 . . . . 61.33 109.768 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -44.34 95.25 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.4 1.08 . . . . 72.31 112.173 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 75.2 m -54.48 -31.73 56.4 Favored 'General case' 0 C--N 1.288 -2.108 0 C-N-CA 125.354 1.462 . . . . 72.21 111.302 174.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.49 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -85.13 -38.2 12.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 C-N-CA 125.026 1.331 . . . . 75.04 110.367 -174.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.74 -38.41 28.76 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.996 0.739 . . . . 73.22 112.996 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.5 mt 61.51 -175.27 0.13 Allowed 'General case' 0 C--O 1.242 0.679 0 C-N-CA 124.38 1.072 . . . . 71.34 113.221 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.492 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 9.7 p30 -125.02 -177.79 3.97 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.84 -0.537 . . . . 73.13 111.562 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.529 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.7 t30 -154.39 153.11 31.05 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.382 -0.97 . . . . 74.14 108.382 -174.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -69.79 -34.53 73.87 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.146 0.43 . . . . 72.21 112.002 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -62.05 -35.95 80.14 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 122.122 0.963 . . . . 75.43 109.041 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.529 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 7.3 tt -65.84 -39.06 90.45 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.34 -1.755 . . . . 74.43 110.062 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 20.8 t-105 -71.42 -46.71 59.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.78 0.324 . . . . 65.42 110.245 174.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.01 -40.86 74.03 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-N 115.857 -0.611 . . . . 74.4 110.884 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -53.04 -50.44 64.3 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 124.134 0.896 . . . . 73.05 110.847 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mt -66.49 -45.15 80.61 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 112.741 0.645 . . . . 63.42 112.741 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -51.71 -53.73 15.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 123.738 0.649 . . . . 70.31 111.467 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -73.13 -33.7 65.67 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 112.13 0.418 . . . . 75.5 112.13 -176.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.67 -46.5 46.13 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 73.32 109.598 -177.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.415 HD22 ' N ' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -66.24 -25.36 66.86 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 123.679 0.792 . . . . 74.33 110.553 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.437 ' OG ' ' HB3' ' A' ' 53' ' ' SER . 57.7 m -72.58 -10.17 59.47 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.256 0.55 . . . . 72.13 110.838 176.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -98.44 -11.43 22.36 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 108.31 -0.996 . . . . 74.33 108.31 177.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.469 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 47.5 m-80 -132.44 51.35 7.03 Favored Pre-proline 0 N--CA 1.436 -1.169 0 CA-C-N 114.499 -1.228 . . . . 55.15 110.822 -175.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 2.8 Cg_exo -72.75 -19.37 24.09 Favored 'Trans proline' 0 C--N 1.361 1.191 0 N-CA-C 108.65 -1.327 . . . . 70.24 108.65 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -74.89 -37.23 62.18 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 114.189 -1.369 . . . . 72.11 109.641 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -73.21 -42.97 62.03 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.467 -0.893 . . . . 75.3 109.002 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -59.32 -47.16 86.45 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.616 -1.175 . . . . 74.24 110.226 -176.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.1 p -62.27 -38.44 89.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.686 0.279 . . . . 70.1 111.478 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.49 96.75 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.045 0.538 . . . . 72.44 111.272 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -74.52 -52.41 11.99 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 112.6 0.592 . . . . 73.32 112.6 177.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.7 mp -53.41 -31.22 44.1 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 113.999 1.111 . . . . 73.11 113.999 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.582 ' HB2' ' SD ' ' A' ' 44' ' ' MET . 31.5 ptt180 -66.69 -30.84 71.18 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.394 0.887 . . . . 74.05 113.394 179.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 t -72.88 -31.99 65.07 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.495 0.664 . . . . 70.41 109.704 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.537 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.2 m-85 -83.11 -58.61 2.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.706 -0.679 . . . . 75.35 111.497 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mp -72.52 121.69 85.52 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 123.977 0.911 . . . . 75.32 110.439 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.56 -33.73 21.57 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 122.562 2.174 . . . . 75.42 112.617 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 p -94.07 -5.48 47.29 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.206 -0.452 . . . . 65.25 110.609 -178.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.582 ' SD ' ' HB2' ' A' ' 38' ' ' ARG . 8.9 mtt 36.48 91.51 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 127.643 2.377 . . . . 75.42 112.309 -175.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -101.92 72.87 1.37 Allowed 'General case' 0 C--N 1.287 -2.116 0 CA-C-O 122.485 1.136 . . . . 74.31 108.852 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.7 mt -92.55 -40.32 10.86 Favored 'General case' 0 CA--C 1.487 -1.464 0 CA-C-N 112.945 -1.934 . . . . 73.42 107.633 -175.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.14 3.35 10.77 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 112.948 -1.933 . . . . 75.43 110.994 -176.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.04 -15.29 63.63 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 125.039 1.336 . . . . 71.12 111.429 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.8 m -75.85 69.28 2.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.657 0.741 . . . . 74.45 111.895 -179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.47 -9.05 57.03 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.128 0.965 . . . . 73.51 111.609 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.63 ' OE2' HG23 ' A' ' 57' ' ' VAL . 2.6 pt-20 -111.09 160.23 29.76 Favored Pre-proline 0 C--N 1.28 -2.42 0 CA-C-N 114.323 -1.308 . . . . 75.43 109.075 175.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -62.37 -170.74 0.09 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.874 2.382 . . . . 74.31 113.696 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.437 ' HB3' ' OG ' ' A' ' 27' ' ' SER . 13.2 m -76.46 36.91 0.16 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 115.169 -0.923 . . . . 74.23 112.005 -175.06 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.41 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 5.1 m-20 -68.39 147.55 98.18 Favored Pre-proline 0 N--CA 1.434 -1.275 0 O-C-N 122.253 -0.28 . . . . 75.54 110.955 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -56.51 -40.1 86.84 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.206 2.604 . . . . 74.34 113.275 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -74.92 -24.08 58.45 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.114 0.483 . . . . 65.55 110.731 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.63 HG23 ' OE2' ' A' ' 51' ' ' GLU . 89.8 t -69.96 -47.68 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 107.871 -1.159 . . . . 72.31 107.871 175.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -61.03 -45.36 98.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 114.23 -1.35 . . . . 71.13 109.725 177.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -55.2 -39.73 69.95 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.823 0.849 . . . . 73.45 111.633 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.35 -41.52 97.19 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.728 0.811 . . . . 72.54 111.365 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -71.81 -43.87 64.89 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.145 -0.934 . . . . 63.51 110.374 -176.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.406 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -72.41 -29.91 64.15 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.827 -1.079 . . . . 75.11 111.47 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -53.27 -42.17 66.26 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 75.45 110.335 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.2 mmt85 -55.04 -32.87 62.21 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.653 -1.158 . . . . 75.4 112.707 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.3 mt -72.35 -39.24 68.24 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 120.604 0.24 . . . . 65.2 110.81 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -64.38 -37.67 88.34 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.636 -0.876 . . . . 73.42 108.636 174.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.01 -28.25 69.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.668 -1.151 . . . . 74.41 111.439 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -74.56 -57.49 3.9 Favored 'General case' 0 N--CA 1.409 -2.491 0 N-CA-C 107.772 -1.196 . . . . 72.32 107.772 174.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . 0.443 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -170.5 142.42 7.14 Favored Glycine 0 CA--C 1.466 -3.005 0 CA-C-N 114.917 -1.038 . . . . 54.32 112.369 -175.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.584 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.6 tpp -67.14 -33.11 74.73 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.378 -1.712 . . . . 64.34 106.378 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.95 -37.31 84.05 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 114.594 -1.184 . . . . 52.31 108.483 176.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.537 HG23 ' CD1' ' A' ' 40' ' ' PHE . 99.2 m -61.9 -42.63 99.3 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.677 -1.147 . . . . 72.44 110.442 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.487 ' NE1' ' HA ' ' A' ' 95' ' ' VAL . 70.0 t-105 -67.32 -41.23 85.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 110.345 -0.243 . . . . 75.02 110.345 179.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 70' ' ' MET . 73.5 mttt -56.99 -39.52 74.81 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.391 0.615 . . . . 74.22 111.278 175.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.7 m -70.95 -44.15 66.67 Favored 'General case' 0 N--CA 1.4 -2.936 0 CA-C-N 115.663 -0.698 . . . . 74.24 110.015 177.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.31 -46.12 89.45 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 123.868 0.867 . . . . 52.3 112.475 -178.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 91' ' ' GLU . 43.7 mm -66.34 -31.17 52.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.155 0 C-N-CA 119.223 -0.991 . . . . 72.11 111.611 -176.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -64.76 -40.78 95.85 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.514 -0.55 . . . . 75.01 109.514 174.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -65.19 -42.16 93.85 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 116.459 -0.337 . . . . 73.15 110.322 175.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.455 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -51.97 -55.02 23.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.839 1.256 . . . . 74.05 109.585 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 26.0 p -67.89 -40.46 83.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.279 0.474 . . . . 71.03 112.279 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -63.56 -54.33 37.78 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 123.389 0.676 . . . . 71.44 110.504 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -72.84 -37.12 67.55 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 113.915 1.08 . . . . 74.32 113.915 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 89.3 mt -85.2 -31.92 22.94 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.976 -0.69 . . . . 72.32 111.985 -177.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -146.36 -100.55 0.09 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.268 -0.973 . . . . 71.22 111.924 -178.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.404 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 76.3 t -141.16 151.44 61.84 Favored Pre-proline 0 C--N 1.307 -1.279 0 N-CA-C 106.853 -1.536 . . . . 74.33 106.853 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -51.31 108.05 0.21 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 121.846 1.697 . . . . 74.45 108.93 168.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 86' ' ' VAL . 86.7 mt -90.95 -22.89 20.63 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 113.973 1.101 . . . . 74.55 113.973 -168.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.98 17.2 9.58 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 123.665 1.698 . . . . 72.23 108.82 -172.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.452 ' O ' HD21 ' A' ' 94' ' ' LEU . 63.8 mtt -120.13 12.92 11.98 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 113.434 -1.712 . . . . 75.32 107.479 175.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.578 ' O ' HG22 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -71.41 -36.14 71.25 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.313 -0.858 . . . . 74.32 111.002 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.583 ' HA ' HG12 ' A' ' 95' ' ' VAL . 35.7 mm -61.18 -46.46 95.81 Favored Pre-proline 0 C--N 1.287 -2.137 0 CA-C-N 115.648 -0.706 . . . . 71.51 112.275 -178.345 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.438 ' HD2' ' C ' ' A' ' 90' ' ' MET . 76.3 Cg_exo -51.49 -38.57 64.37 Favored 'Trans proline' 0 C--N 1.359 1.113 0 C-N-CA 122.232 1.955 . . . . 63.35 112.134 170.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.452 HD21 ' O ' ' A' ' 90' ' ' MET . 4.5 mm? -72.04 -33.28 67.88 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.809 -0.632 . . . . 74.22 111.564 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.583 HG12 ' HA ' ' A' ' 92' ' ' ILE . 3.3 p -78.25 -29.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 122.395 1.093 . . . . 75.12 112.147 177.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.6 t -73.24 4.28 4.73 Favored 'General case' 0 C--N 1.259 -3.336 0 CA-C-N 113.899 -1.5 . . . . 74.33 111.665 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.492 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 14.5 tt -64.33 -28.85 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 75.15 111.197 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 11.5 m95 . . . . . 0 N--CA 1.422 -1.856 0 N-CA-C 105.054 -2.202 . . . . 74.52 105.054 171.878 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.439 -1.013 0 N-CA-C 114.073 1.138 . . . . 70.54 114.073 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -110.14 23.79 13.85 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.297 -0.961 . . . . 75.43 111.131 177.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.99 -14.56 59.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.8 0.81 . . . . 64.33 109.776 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.427 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -65.13 -33.01 74.99 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.033 -0.985 . . . . 74.22 113.175 -178.588 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.9 t -61.78 -37.31 83.88 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.949 0.881 . . . . 73.14 109.897 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.444 ' H ' HD12 ' A' ' 11' ' ' ILE . 2.9 mp -87.5 -43.77 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 114.625 -1.171 . . . . 73.23 112.415 -177.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -81.94 -30.78 31.59 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.028 0.751 . . . . 72.51 113.028 -175.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 64.82 133.39 0.02 OUTLIER 'General case' 0 C--O 1.247 0.952 0 C-N-CA 125.976 1.711 . . . . 75.4 115.374 -178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -72.89 156.3 39.02 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 115.495 -0.775 . . . . 73.2 108.938 175.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -157.76 143.39 17.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.092 -1.077 . . . . 74.44 108.092 -174.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -52.84 -28.51 23.19 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.304 1.041 . . . . 74.32 111.442 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -56.63 -39.6 73.92 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.124 0.969 . . . . 63.44 110.158 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 mt -70.67 -36.71 73.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.779 -1.101 . . . . 72.45 110.551 -175.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -69.44 -42.22 75.23 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.408 -0.59 . . . . 75.15 109.408 177.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.04 -48.19 82.93 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.503 -0.317 . . . . 71.05 110.222 177.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -54.5 -50.28 68.18 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.782 -0.645 . . . . 75.4 110.77 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.47 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -59.79 -53.05 62.5 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 123.74 0.65 . . . . 62.35 109.286 -177.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.4 t -56.48 -50.57 72.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 116.233 -0.439 . . . . 75.02 112.131 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 97.3 mtt180 -69.63 -41.56 75.48 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.285 0.476 . . . . 73.42 112.285 -174.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.57 -42.91 86.34 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.262 -0.644 . . . . 75.33 109.262 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -70.34 -25.1 63.13 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.961 -0.563 . . . . 71.0 110.437 -179.255 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.9 m -71.56 -18.9 62.22 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.287 -0.634 . . . . 73.05 109.287 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.49 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 40.3 mtmt -91.84 1.37 57.22 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.814 0.816 . . . . 75.45 109.188 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -141.03 55.64 5.65 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 114.81 -1.086 . . . . 73.24 110.267 -178.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -67.98 -26.01 37.86 Favored 'Trans proline' 0 C--N 1.363 1.34 0 C-N-CA 121.389 1.393 . . . . 63.45 108.986 -176.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -66.85 -42.07 86.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-N 113.55 -1.659 . . . . 72.32 110.131 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.581 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 80.1 t90 -74.57 -45.47 45.13 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 119.809 -0.757 . . . . 74.12 109.664 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' HD12 ' A' ' 37' ' ' LEU . 2.9 tm? -57.4 -52.52 65.02 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.392 -1.276 . . . . 73.23 110.537 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.409 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 12.9 p -54.28 -42.59 70.21 Favored 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 112.371 0.508 . . . . 65.21 112.371 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.65 86.91 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 124.254 1.021 . . . . 73.22 112.447 177.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.581 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.2 mmmt -72.13 -31.26 65.83 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.891 0.377 . . . . 75.43 110.394 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.628 HD12 ' O ' ' A' ' 33' ' ' LEU . 5.2 mp -61.49 -31.08 71.05 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 122.679 0.392 . . . . 73.51 111.701 173.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 34' ' ' SER . 28.6 mtm180 -66.23 -35.4 80.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.986 0.898 . . . . 71.03 109.537 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 50.2 m -75.47 -36.07 60.74 Favored 'General case' 0 N--CA 1.399 -3.0 0 C-N-CA 125.734 1.614 . . . . 73.35 112.648 -178.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.576 ' CD1' HG22 ' A' ' 72' ' ' THR . 66.1 m-85 -94.51 -47.43 6.55 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 113.192 0.812 . . . . 74.03 113.192 -178.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.601 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.0 OUTLIER -101.0 115.92 64.66 Favored Pre-proline 0 N--CA 1.436 -1.157 0 O-C-N 122.315 -0.241 . . . . 70.43 110.699 -176.146 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.14 -25.61 9.97 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.823 1.682 . . . . 71.21 111.248 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 43' ' ' THR . 15.5 m -99.12 23.89 8.53 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.511 1.148 . . . . 75.51 110.875 -174.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.484 ' HE2' ' HA ' ' A' ' 44' ' ' MET . 4.0 tpt -74.95 104.19 5.45 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 113.846 1.054 . . . . 70.3 113.846 -176.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -94.01 77.02 4.12 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 106.369 -1.715 . . . . 74.44 106.369 170.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 pp -89.22 -17.49 28.96 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.165 -1.38 . . . . 74.31 112.305 -174.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -72.39 -18.43 61.73 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.532 0.682 . . . . 74.53 111.73 -175.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.7 m -100.74 95.03 6.38 Favored 'General case' 0 C--N 1.276 -2.595 0 CA-C-N 115.649 -0.705 . . . . 75.1 110.625 -176.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.8 m -91.76 95.39 9.84 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.547 0.689 . . . . 75.31 109.669 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.21 -48.44 81.48 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.864 -1.062 . . . . 75.2 110.939 176.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -116.97 164.62 18.02 Favored Pre-proline 0 C--N 1.245 -3.936 0 CA-C-N 113.281 -1.781 . . . . 72.22 106.877 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.8 -150.87 0.04 OUTLIER 'Trans proline' 0 CA--C 1.553 1.453 0 C-N-CA 122.221 1.948 . . . . 75.23 110.812 174.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -75.47 38.08 0.14 Allowed 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 124.189 0.996 . . . . 72.44 112.334 -176.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.17 146.81 91.91 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 123.637 0.775 . . . . 74.42 111.019 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.21 -27.92 78.89 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.724 2.283 . . . . 64.5 111.933 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -68.74 -40.28 79.94 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.533 -0.914 . . . . 75.24 108.533 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.486 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 58.4 t -66.47 -50.36 67.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.717 -1.129 . . . . 73.3 109.042 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.451 ' O ' HD22 ' A' ' 62' ' ' LEU . 47.3 mm -55.15 -39.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-N 114.792 -1.094 . . . . 72.42 109.776 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.494 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 57.0 t-80 -61.89 -28.98 69.9 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.604 -0.725 . . . . 63.32 111.461 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -74.22 -40.75 62.24 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 122.317 1.056 . . . . 74.43 108.251 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 41.1 mt-30 -70.25 -43.88 69.61 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 113.555 -1.657 . . . . 73.25 110.534 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.451 HD22 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -73.42 -30.5 63.27 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.875 -1.057 . . . . 73.15 111.232 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.494 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 0.2 OUTLIER -56.42 -43.37 79.34 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.467 1.107 . . . . 71.35 108.858 175.449 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.601 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 34.0 mmt180 -58.48 -37.01 74.63 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.758 -1.11 . . . . 74.33 112.343 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.5 mt -71.82 -44.68 63.48 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 116.552 -0.295 . . . . 73.41 111.571 -177.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -67.38 -27.77 67.38 Favored 'General case' 0 C--O 1.245 0.851 0 N-CA-C 108.851 -0.796 . . . . 73.11 108.851 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.24 81.0 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.245 -0.889 . . . . 73.53 110.709 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.484 HE21 HD12 ' A' ' 41' ' ' LEU . 48.9 mm-40 -60.4 -47.94 83.89 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.054 -0.721 . . . . 73.12 109.054 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.81 141.02 5.43 Favored Glycine 0 N--CA 1.403 -3.539 0 CA-C-N 114.772 -1.104 . . . . 72.23 111.143 -178.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.615 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 21.7 ptp -69.67 -26.61 64.47 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.025 -1.843 . . . . 72.14 106.025 169.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.5 67.01 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.37 -1.286 . . . . 74.12 108.262 173.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.576 HG22 ' CD1' ' A' ' 40' ' ' PHE . 81.2 m -55.39 -40.82 71.85 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 123.399 0.68 . . . . 72.33 110.129 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.434 ' CZ3' HD11 ' A' ' 62' ' ' LEU . 73.5 t-105 -61.26 -49.29 77.68 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 115.765 -0.652 . . . . 72.22 110.247 176.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.615 ' HG3' ' O ' ' A' ' 70' ' ' MET . 91.5 mttt -55.82 -42.48 75.75 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.959 0.409 . . . . 71.44 110.754 176.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 42.3 m -65.88 -44.93 83.88 Favored 'General case' 0 N--CA 1.406 -2.636 0 C-N-CA 123.334 0.654 . . . . 75.11 110.773 179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -58.33 -49.52 76.9 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.718 -0.673 . . . . 74.13 111.006 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.49 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 49.5 mm -64.47 -38.31 82.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 O-C-N 123.349 0.406 . . . . 74.44 110.738 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -69.67 -32.93 71.85 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.198 0.523 . . . . 74.34 110.781 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 67.9 m-20 -74.01 -39.61 63.48 Favored 'General case' 0 C--O 1.193 -1.875 0 C-N-CA 119.867 -0.733 . . . . 70.25 110.163 171.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.49 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.8 tm? -50.76 -53.96 27.38 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.924 1.29 . . . . 70.24 111.073 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 25.3 p -63.29 -33.7 76.08 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.623 -0.717 . . . . 75.43 111.662 -178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -73.47 -54.35 8.46 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 123.554 0.742 . . . . 74.43 111.129 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 42.3 mt-10 -68.61 -36.73 79.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.396 -0.82 . . . . 62.35 112.814 -172.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.6 -10.24 44.06 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.936 -0.706 . . . . 73.23 110.032 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.5 t70 55.95 69.48 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.194 0.998 . . . . 63.01 110.219 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -132.88 129.08 21.01 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 115.082 -0.963 . . . . 74.12 110.666 -177.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -75.89 109.55 2.91 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.115 1.877 . . . . 74.43 110.076 176.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 65.9 mt -86.05 -31.1 22.14 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 120.175 -0.61 . . . . 71.22 109.634 -179.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.7 t70 71.31 -49.68 0.68 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.854 1.261 . . . . 65.41 111.559 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.467 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . 20.6 ptp -116.43 68.56 0.73 Allowed 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.098 0.951 . . . . 74.11 108.55 175.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.534 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 36.2 tt0 -70.36 -46.04 64.9 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.354 -1.293 . . . . 72.45 112.13 -172.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.575 ' O ' HG23 ' A' ' 95' ' ' VAL . 44.4 mm -64.43 -42.8 68.88 Favored Pre-proline 0 C--O 1.175 -2.852 0 C-N-CA 123.358 0.663 . . . . 72.2 111.034 -178.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.467 ' HG2' ' HB2' ' A' ' 90' ' ' MET . 3.1 Cg_exo -48.37 -33.33 22.35 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.937 1.758 . . . . 72.21 112.89 167.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.534 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 4.5 mm? -68.32 -44.06 76.23 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 108.952 -0.759 . . . . 64.55 108.952 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 92' ' ' ILE . 2.8 m -63.77 -34.47 68.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.278 0 CA-C-O 123.051 1.405 . . . . 72.31 110.712 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.3 m -89.21 7.23 36.45 Favored 'General case' 0 C--N 1.274 -2.713 0 C-N-CA 127.667 2.387 . . . . 53.25 113.453 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.5 tp -60.91 -24.95 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.078 0.551 . . . . 74.05 111.598 -176.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 23.9 m0 . . . . . 0 N--CA 1.432 -1.339 0 C-N-CA 124.961 1.304 . . . . 75.13 112.278 -174.33 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 28.5 ttt . . . . . 0 N--CA 1.432 -1.362 0 CA-C-O 122.913 1.34 . . . . 73.35 109.531 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.52 ' O ' HD12 ' A' ' 11' ' ' ILE . 28.7 t70 -161.85 25.12 0.12 Allowed 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 112.119 -2.31 . . . . 73.14 108.175 -177.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.94 -31.94 64.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.9 1.333 . . . . 61.02 107.468 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.8 pm0 -55.93 -38.88 70.89 Favored 'General case' 0 N--CA 1.422 -1.858 0 CA-C-N 112.768 -2.014 . . . . 73.51 112.216 175.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -66.92 -26.74 67.0 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.779 0.799 . . . . 73.34 111.19 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.52 HD12 ' O ' ' A' ' 7' ' ' ASP . 1.0 OUTLIER -83.51 -24.91 7.85 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.836 0 CA-C-N 115.143 -0.935 . . . . 75.02 110.453 -175.296 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.47 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 38.2 mmt180 -84.68 -65.03 1.06 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.373 -0.376 . . . . 73.23 110.19 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 41.5 mt 50.83 166.08 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 117.196 2.295 . . . . 71.24 117.196 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.6 t30 51.46 87.61 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.907 1.683 . . . . 53.45 113.231 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.477 ' HB3' HD22 ' A' ' 18' ' ' LEU . 46.7 m-80 -125.32 89.86 3.12 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.893 -0.594 . . . . 74.41 110.942 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.82 -39.24 69.94 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.251 -0.431 . . . . 74.21 111.63 -177.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.02 -34.07 76.78 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.274 0.559 . . . . 74.43 110.127 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.477 HD22 ' HB3' ' A' ' 15' ' ' ASN . 4.6 mm? -67.12 -37.99 84.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.167 -0.924 . . . . 72.34 110.914 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.4 t-105 -66.24 -46.76 76.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.348 -0.387 . . . . 74.31 110.307 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.77 -32.54 74.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.005 -0.543 . . . . 64.24 111.133 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -67.74 -50.17 58.66 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.347 -0.612 . . . . 74.34 109.347 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.1 -52.77 63.1 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.727 0.811 . . . . 63.45 110.077 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.3 t -57.51 -48.62 82.6 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 C-N-CA 122.898 0.479 . . . . 75.44 111.575 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -72.3 -31.68 65.92 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.271 -0.422 . . . . 71.34 111.483 -175.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -72.98 -43.97 61.62 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 107.964 -1.124 . . . . 61.24 107.964 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.8 mt -73.43 -24.23 60.22 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 113.304 0.853 . . . . 74.11 113.304 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . 0.45 ' HA ' ' HB3' ' A' ' 53' ' ' SER . 53.2 p -59.15 -22.04 60.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.515 0.674 . . . . 73.11 109.792 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.6 mtmt -92.43 -15.2 27.48 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.483 -0.781 . . . . 73.22 109.522 -178.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -133.96 51.5 6.6 Favored Pre-proline 0 C--O 1.242 0.701 0 CA-C-N 114.902 -1.044 . . . . 61.23 111.849 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.38 -22.31 29.42 Favored 'Trans proline' 0 C--N 1.366 1.49 0 N-CA-C 108.939 -1.216 . . . . 75.22 108.939 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -66.71 -39.62 88.1 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-N 113.352 -1.749 . . . . 73.13 110.09 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.564 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 70.6 t90 -74.34 -45.49 46.9 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 119.605 -0.838 . . . . 73.43 109.378 178.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.587 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 3.1 tm? -59.05 -49.52 77.57 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.61 -1.177 . . . . 73.54 110.947 -174.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 21.1 p -58.94 -45.27 90.85 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.029 0.381 . . . . 63.2 112.029 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.95 70.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.109 0.964 . . . . 62.0 111.416 176.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.51 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 26.3 mmmt -72.56 -35.8 68.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.99 -0.284 . . . . 75.52 110.668 178.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.4 mt -59.41 -31.13 68.98 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.969 -0.56 . . . . 74.24 110.855 177.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 34' ' ' SER . 59.7 mtp180 -61.5 -34.82 76.14 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.04 -0.527 . . . . 72.33 112.234 -176.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -87.58 -38.97 15.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.273 -0.421 . . . . 65.41 110.476 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.443 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 76.4 m-85 -73.85 -47.89 35.1 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.066 0.765 . . . . 74.45 113.066 -178.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.515 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.5 mm? -102.43 112.54 65.65 Favored Pre-proline 0 N--CA 1.432 -1.34 0 CA-C-O 120.758 0.313 . . . . 73.25 110.957 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -81.15 3.06 8.11 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.511 2.141 . . . . 74.03 111.373 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 27.6 p -111.53 -2.0 15.64 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.061 -0.972 . . . . 75.43 111.193 -177.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.492 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 36.9 tpp -65.22 110.07 2.44 Favored 'General case' 0 N--CA 1.413 -2.315 0 N-CA-C 115.489 1.663 . . . . 74.32 115.489 -174.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -108.79 82.92 1.68 Allowed 'General case' 0 N--CA 1.428 -1.532 0 N-CA-C 105.243 -2.132 . . . . 73.41 105.243 165.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.492 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 4.6 pp -81.75 5.01 19.88 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-N 114.58 -1.191 . . . . 74.41 111.486 -173.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -80.34 -9.35 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.999 -1.0 . . . . 63.45 111.452 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.3 p -89.35 77.59 7.36 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.966 0.889 . . . . 74.04 111.931 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.5 m -95.02 83.07 3.87 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.315 -0.857 . . . . 72.53 109.217 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -22.96 57.84 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.74 1.257 . . . . 74.14 111.846 178.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -137.03 161.6 60.48 Favored Pre-proline 1 N--CA 1.374 -4.273 0 N-CA-C 105.678 -1.971 . . . . 72.35 105.678 178.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.423 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.1 Cg_exo -69.57 -143.47 0.02 OUTLIER 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 122.975 2.45 . . . . 73.25 110.923 175.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . 0.45 ' HB3' ' HA ' ' A' ' 27' ' ' SER . 13.0 m -80.59 38.33 0.43 Allowed 'General case' 0 C--N 1.293 -1.853 0 CA-C-O 122.18 0.99 . . . . 65.01 110.66 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 52' ' ' PRO . 6.7 m-20 -62.35 151.41 82.41 Favored Pre-proline 0 C--N 1.317 -0.823 0 C-N-CA 126.298 1.839 . . . . 75.13 112.802 -178.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -54.07 -43.45 58.17 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 124.011 3.141 . . . . 71.22 114.158 -175.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -73.86 -31.52 63.21 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-O 120.65 0.262 . . . . 75.35 110.372 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -63.7 -52.1 61.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.356 -0.979 . . . . 73.13 108.356 176.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.469 ' O ' HD22 ' A' ' 62' ' ' LEU . 46.0 mm -56.97 -41.44 77.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.708 -1.133 . . . . 75.4 109.259 176.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.492 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 48.7 t-80 -58.92 -36.46 74.76 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-N 115.74 -0.664 . . . . 74.22 112.092 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -64.21 -44.42 92.01 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 108.118 -1.067 . . . . 73.32 108.118 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -67.39 -47.47 70.22 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.208 -1.814 . . . . 74.43 110.885 -172.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.469 HD22 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -74.17 -32.04 62.94 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 114.321 -1.309 . . . . 74.33 111.453 -177.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 67.1 t30 -63.16 -44.62 94.95 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.95 0.881 . . . . 72.34 109.847 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.515 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 19.0 mmt180 -57.56 -29.82 64.72 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.193 -1.367 . . . . 72.52 112.943 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.46 -39.18 85.3 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.658 0.266 . . . . 71.25 110.981 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -70.96 -29.8 65.91 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.566 -0.901 . . . . 74.43 108.566 178.442 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -19.94 65.1 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.738 -0.664 . . . . 71.42 110.529 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -79.84 -49.09 12.47 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 108.517 -0.92 . . . . 71.25 108.517 173.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.44 141.61 6.52 Favored Glycine 0 CA--C 1.479 -2.179 0 CA-C-N 115.001 -0.999 . . . . 71.02 111.526 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.512 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 59.5 ttp -67.74 -29.5 68.74 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.15 -1.796 . . . . 74.35 106.15 171.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.92 -32.95 34.48 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 113.707 -1.588 . . . . 72.11 109.026 177.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.414 HG23 ' CD1' ' A' ' 40' ' ' PHE . 98.7 m -60.4 -38.56 84.35 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.254 -0.647 . . . . 72.32 109.254 175.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.582 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.2 t-105 -61.57 -54.2 46.24 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 123.609 0.568 . . . . 75.54 109.739 175.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 70' ' ' MET . 85.9 mttt -53.97 -45.25 71.31 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.146 0.578 . . . . 72.33 111.935 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -65.34 -45.74 83.0 Favored 'General case' 0 N--CA 1.408 -2.558 0 C-N-CA 123.095 0.558 . . . . 74.44 111.104 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.446 ' HZ ' ' CD2' ' A' ' 33' ' ' LEU . 81.0 t80 -57.49 -45.36 84.99 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.555 -0.748 . . . . 75.43 110.739 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.545 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 49.2 mm -63.5 -33.11 59.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 116.103 -0.499 . . . . 72.12 111.347 -178.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -66.16 -42.61 88.75 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.627 -0.829 . . . . 73.51 109.368 175.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.12 -38.23 90.3 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 120.731 0.3 . . . . 64.42 110.427 175.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.564 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.6 tm? -53.66 -55.56 24.96 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 124.66 1.184 . . . . 74.03 109.863 177.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 87' ' ' PRO . 26.8 p -68.53 -40.24 80.84 Favored 'General case' 0 N--CA 1.42 -1.948 0 CA-C-N 116.15 -0.477 . . . . 72.21 111.674 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -65.86 -48.04 72.89 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.856 -0.611 . . . . 73.54 112.558 -174.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -80.69 -26.89 37.24 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.126 -0.63 . . . . 73.33 112.06 -174.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.3 mt -85.97 -37.39 19.05 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 120.442 -0.503 . . . . 74.55 111.098 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -148.82 -100.3 0.08 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 121.042 -0.263 . . . . 72.32 110.969 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -141.19 164.21 37.07 Favored Pre-proline 0 C--N 1.314 -0.962 0 N-CA-C 108.108 -1.071 . . . . 73.32 108.108 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.482 ' HA ' ' SG ' ' A' ' 81' ' ' CYS . 50.1 Cg_exo -57.8 114.89 2.16 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.898 1.732 . . . . 72.5 108.18 170.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.62 -19.09 29.84 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 113.304 0.853 . . . . 73.34 113.304 -169.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 78.7 -0.1 2.47 Favored 'General case' 0 N--CA 1.506 2.339 0 CA-C-O 123.542 1.639 . . . . 73.42 108.401 -173.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.443 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 27.8 ttt -105.75 6.26 31.65 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 113.157 -1.838 . . . . 75.44 108.071 -179.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.646 ' O ' HG11 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -66.73 -46.53 75.18 Favored 'General case' 0 C--O 1.199 -1.601 0 CA-C-N 116.128 -0.487 . . . . 74.24 111.884 -178.808 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.453 ' O ' HG21 ' A' ' 95' ' ' VAL . 39.9 mm -59.09 -44.57 98.88 Favored Pre-proline 0 C--O 1.185 -2.332 0 CA-C-O 118.646 -0.693 . . . . 75.41 110.081 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.443 ' HD2' ' C ' ' A' ' 90' ' ' MET . 52.5 Cg_exo -47.63 -42.41 29.64 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 121.994 1.796 . . . . 73.33 112.342 169.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.435 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 4.4 mm? -67.01 -39.84 87.15 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.976 0.417 . . . . 73.11 110.616 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.646 HG11 ' O ' ' A' ' 91' ' ' GLU . 2.9 m -68.19 -29.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 122.824 1.297 . . . . 73.43 110.895 -178.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.47 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 24.5 t -82.92 5.13 22.93 Favored 'General case' 0 C--N 1.276 -2.629 0 C-N-CA 127.274 2.23 . . . . 75.44 111.68 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.435 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 17.3 tt -50.21 -48.16 24.54 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 113.439 0.903 . . . . 74.42 113.439 -173.207 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 4.1 p90 . . . . . 0 CA--C 1.499 -0.981 0 C-N-CA 126.339 1.856 . . . . 74.44 107.031 174.181 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 C--O 1.233 0.218 0 N-CA-C 108.493 -0.929 . . . . 74.03 108.493 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.413 ' O ' HD13 ' A' ' 11' ' ' ILE . 3.2 m-20 -105.12 25.71 10.23 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.266 0.839 . . . . 64.33 113.266 -174.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.2 -9.18 58.62 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 122.482 1.134 . . . . 72.12 109.778 175.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.469 ' HB3' ' OG ' ' A' ' 96' ' ' SER . 0.0 OUTLIER -69.19 -30.42 68.6 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.005 -1.452 . . . . 73.12 112.267 179.178 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.455 ' HB2' HD11 ' A' ' 11' ' ' ILE . 70.6 m -66.78 -32.45 73.75 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 122.271 1.034 . . . . 64.44 109.443 177.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.455 HD11 ' HB2' ' A' ' 10' ' ' SER . 1.0 OUTLIER -84.38 -51.45 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.364 0 CA-C-N 113.888 -1.506 . . . . 73.32 110.918 -173.538 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -112.72 -6.92 13.84 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 115.003 1.483 . . . . 71.43 115.003 -173.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 53.29 -92.62 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.062 0.945 . . . . 75.44 113.18 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -170.37 170.55 7.03 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 124.513 1.125 . . . . 73.52 108.053 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -152.67 152.58 31.91 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.08 -38.79 92.58 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 123.752 0.821 . . . . 75.4 111.076 -177.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -61.3 -29.28 69.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.29 -0.414 . . . . 72.41 111.811 -178.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.558 HD23 ' SD ' ' A' ' 90' ' ' MET . 83.4 mt -65.81 -44.93 84.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.491 -0.559 . . . . 72.35 109.491 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 61.3 t-105 -69.48 -36.88 76.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.48 -0.782 . . . . 74.54 109.842 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.35 -44.09 88.8 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 116.215 -0.448 . . . . 54.52 111.249 178.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.528 ' CH2' ' HG ' ' A' ' 25' ' ' LEU . 70.1 t90 -60.76 -48.13 83.18 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.684 -0.858 . . . . 71.13 108.684 176.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.42 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -54.4 -53.22 56.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.93 -1.032 . . . . 73.42 109.294 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.0 t -60.13 -44.66 95.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 112.407 0.521 . . . . 75.44 112.407 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 42.2 ttm180 -69.95 -45.28 67.78 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 120.596 -0.441 . . . . 75.33 111.029 -176.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.528 ' HG ' ' CH2' ' A' ' 21' ' ' TRP . 2.7 tm? -67.82 -40.32 83.8 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.917 -0.401 . . . . 75.4 109.917 -175.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 6.8 mt -71.0 -25.59 62.75 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 120.957 0.408 . . . . 73.04 111.804 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.0 t -68.93 -17.35 63.94 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.606 -0.887 . . . . 73.23 108.606 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 30.1 mtmt -101.66 -2.63 29.91 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.733 -0.667 . . . . 74.44 110.02 177.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -135.53 57.62 20.66 Favored Pre-proline 0 C--O 1.243 0.756 0 CA-C-N 116.139 -0.482 . . . . 71.43 111.185 -178.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -67.98 -28.47 35.37 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 121.307 1.338 . . . . 74.44 108.774 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.88 -44.27 96.55 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-N 113.16 -1.836 . . . . 75.42 110.624 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.506 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 78.2 t90 -74.85 -45.84 40.4 Favored 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 119.92 -0.712 . . . . 75.02 110.055 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.459 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.6 tm? -60.32 -47.14 87.3 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.536 -1.211 . . . . 72.04 111.104 -173.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.576 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 50.1 m -57.43 -48.77 78.24 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 123.191 0.307 . . . . 75.42 111.222 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.02 -39.56 69.24 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.19 0.996 . . . . 71.22 111.854 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.7 mmmt -73.0 -33.25 65.68 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.784 -0.366 . . . . 70.33 111.091 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.2 mt -62.01 -32.46 72.94 Favored 'General case' 0 C--O 1.183 -2.401 0 N-CA-C 109.986 -0.375 . . . . 74.42 109.986 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 34' ' ' SER . 67.6 mtt180 -63.21 -30.47 71.61 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.13 0.491 . . . . 74.33 111.482 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 t -87.47 -35.72 18.07 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 115.48 -0.782 . . . . 73.55 110.536 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.694 ' CD1' HG22 ' A' ' 72' ' ' THR . 56.9 m-85 -86.64 -49.14 7.73 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 113.009 0.744 . . . . 73.32 113.009 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.6 mp -88.99 114.08 58.7 Favored Pre-proline 0 C--N 1.3 -1.561 0 C-N-CA 123.834 0.854 . . . . 73.31 109.228 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.97 -32.38 13.66 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.678 1.585 . . . . 74.43 110.333 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.4 m -105.59 29.13 6.81 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 115.22 -0.9 . . . . 70.21 109.472 -177.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.437 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -44.89 101.49 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.965 1.306 . . . . 71.2 114.311 -174.497 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.45 72.8 6.05 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.333 1.063 . . . . 75.12 108.775 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 pp -96.52 -16.12 21.28 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.327 -1.306 . . . . 74.41 112.192 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -87.12 -1.88 58.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.797 0.808 . . . . 75.53 111.796 -173.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.02 73.59 1.25 Allowed 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.461 -0.495 . . . . 73.34 110.656 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.1 m -101.32 83.97 2.55 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-O 121.595 0.712 . . . . 72.32 109.666 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -30.41 70.66 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 114.715 -1.129 . . . . 73.04 112.172 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -120.74 169.5 8.7 Favored Pre-proline 1 N--CA 1.377 -4.078 0 N-CA-C 106.337 -1.727 . . . . 62.32 106.337 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -81.12 -151.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.804 1.669 . . . . 74.31 110.869 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.5 m -76.47 38.74 0.19 Allowed 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 124.29 1.036 . . . . 74.55 112.607 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -65.88 151.62 94.76 Favored Pre-proline 0 N--CA 1.447 -0.599 0 C-N-CA 123.472 0.709 . . . . 72.24 112.152 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.9 -42.01 60.19 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 123.866 3.044 . . . . 73.35 114.369 -176.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -74.35 -27.9 60.89 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 120.792 0.33 . . . . 74.1 110.9 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 95.0 t -69.84 -47.19 71.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 107.937 -1.134 . . . . 74.2 107.937 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.459 ' O ' HD21 ' A' ' 62' ' ' LEU . 45.9 mm -58.91 -47.66 88.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.557 -1.202 . . . . 74.52 109.507 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 13.1 t-80 -54.89 -37.54 66.43 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.548 -0.751 . . . . 74.22 111.594 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -60.61 -48.1 83.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.607 0.718 . . . . 71.23 110.887 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -66.21 -45.05 82.09 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.675 -1.148 . . . . 74.34 110.712 -176.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.459 HD21 ' O ' ' A' ' 58' ' ' ILE . 3.8 mm? -74.18 -31.17 62.57 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.385 -1.28 . . . . 74.02 111.454 -176.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 52.6 t30 -60.51 -42.42 96.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.716 0.769 . . . . 70.33 109.693 177.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -60.03 -31.02 69.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.605 -1.18 . . . . 73.24 112.69 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.23 -44.54 71.8 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 110.011 -0.366 . . . . 73.32 110.011 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.745 -0.661 . . . . 74.31 109.307 176.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.12 -29.73 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.436 -0.802 . . . . 75.2 111.651 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.402 ' HB2' HG21 ' A' ' 72' ' ' THR . 35.2 mm-40 -68.86 -45.71 70.35 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 121.437 0.637 . . . . 63.33 109.366 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -174.42 142.1 6.23 Favored Glycine 0 N--CA 1.408 -3.185 0 CA-C-N 115.051 -0.977 . . . . 73.23 111.643 -175.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.451 ' O ' ' HZ3' ' A' ' 98' ' ' TRP . 0.0 OUTLIER -67.5 -30.18 69.8 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 105.843 -1.91 . . . . 62.34 105.843 170.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.93 -35.33 64.59 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.866 -1.515 . . . . 73.34 108.824 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.694 HG22 ' CD1' ' A' ' 40' ' ' PHE . 54.1 m -59.18 -45.52 90.82 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 115.434 -0.803 . . . . 70.01 110.654 175.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 66.2 t-105 -66.47 -38.61 87.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 121.095 -0.242 . . . . 73.21 110.457 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.54 ' HG2' HG21 ' A' ' 95' ' ' VAL . 89.1 mttt -56.7 -48.76 76.97 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.264 0.554 . . . . 75.04 110.603 174.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 47.2 m -62.79 -42.27 99.63 Favored 'General case' 0 N--CA 1.4 -2.969 0 CA-C-N 114.771 -1.104 . . . . 74.11 110.455 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.81 -47.98 82.64 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 115.012 -0.994 . . . . 73.23 111.69 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.4 HG23 ' O ' ' A' ' 91' ' ' GLU . 49.7 mm -65.55 -34.75 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 119.551 -0.86 . . . . 75.12 110.903 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -63.95 -37.7 88.37 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.022 -0.535 . . . . 73.33 110.272 177.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.495 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 84.2 m-20 -74.37 -42.62 59.04 Favored 'General case' 0 C--O 1.192 -1.96 0 CA-C-N 116.517 -0.31 . . . . 71.52 110.731 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -50.13 -53.99 23.75 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.518 1.527 . . . . 64.42 109.947 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 45.0 t -66.59 -32.12 73.26 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.693 -0.685 . . . . 71.11 110.958 -179.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -76.19 -55.13 5.86 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.892 -0.595 . . . . 74.15 111.631 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 21.4 mt-10 -75.33 -25.26 57.66 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 113.132 0.79 . . . . 71.21 113.132 -170.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.421 HD12 HD12 ' A' ' 25' ' ' LEU . 94.4 mt -88.0 12.14 14.13 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.857 0.688 . . . . 73.2 112.857 -176.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.8 t70 72.58 -54.75 0.69 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.675 1.19 . . . . 65.13 113.428 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.62 116.34 39.6 Favored Pre-proline 0 C--N 1.308 -1.197 0 C-N-CA 123.129 0.572 . . . . 73.33 111.302 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -82.96 80.76 2.57 Favored 'Trans proline' 0 N--CA 1.43 -2.242 0 C-N-CA 121.674 1.583 . . . . 74.01 110.786 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -67.57 -25.65 65.9 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.653 -0.703 . . . . 73.1 111.864 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.483 ' O ' HD23 ' A' ' 88' ' ' LEU . 9.4 t70 63.06 -164.14 0.26 Allowed 'General case' 0 CA--C 1.551 0.993 0 O-C-N 124.303 1.002 . . . . 74.14 109.13 175.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.558 ' SD ' HD23 ' A' ' 18' ' ' LEU . 41.3 ttm 60.4 34.01 20.65 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 123.085 1.422 . . . . 74.1 108.363 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.4 ' O ' HG23 ' A' ' 77' ' ' ILE . 35.2 tt0 -53.75 -44.99 70.44 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.46 2.304 . . . . 64.41 112.703 -174.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.552 ' HA ' ' CG1' ' A' ' 95' ' ' VAL . 41.5 mm -71.33 -50.33 11.12 Favored Pre-proline 0 C--O 1.197 -1.658 0 CA-C-O 118.701 -0.666 . . . . 71.02 111.774 -177.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.423 ' HB2' ' HG2' ' A' ' 90' ' ' MET . 47.3 Cg_exo -51.8 -34.21 53.8 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 121.524 1.482 . . . . 71.23 112.147 169.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.438 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 3.6 mm? -65.14 -42.66 93.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.743 0.306 . . . . 74.22 110.897 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.552 ' CG1' ' HA ' ' A' ' 92' ' ' ILE . 2.5 p -70.51 -36.5 66.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 122.39 1.09 . . . . 73.42 111.54 176.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.469 ' OG ' ' HB3' ' A' ' 9' ' ' GLU . 69.7 m -71.21 5.91 1.94 Allowed 'General case' 0 C--N 1.251 -3.709 0 CA-C-N 114.26 -1.336 . . . . 71.22 113.61 176.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.438 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 4.0 tp -67.83 -18.95 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 123.95 0.9 . . . . 74.45 109.288 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . 0.451 ' HZ3' ' O ' ' A' ' 70' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.237 0.411 0 C-N-CA 124.617 1.167 . . . . 73.24 113.833 -176.627 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 31.5 tpp . . . . . 0 C--O 1.205 -1.256 0 CA-C-O 121.531 0.682 . . . . 72.24 109.26 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -87.84 23.7 1.96 Allowed 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.773 -0.649 . . . . 71.34 111.433 -176.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -79.24 -21.24 46.46 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 122.066 0.936 . . . . 73.01 109.21 174.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.422 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.8 OUTLIER -60.85 -30.53 70.18 Favored 'General case' 0 C--O 1.202 -1.407 0 CA-C-N 114.232 -1.349 . . . . 74.21 112.955 -179.26 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.456 ' HB2' HD13 ' A' ' 11' ' ' ILE . 65.9 m -58.22 -38.68 77.28 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 122.186 0.993 . . . . 71.51 110.141 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.456 HD13 ' HB2' ' A' ' 10' ' ' SER . 1.2 mp -79.74 -37.21 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.855 0 CA-C-N 113.413 -1.721 . . . . 72.55 109.94 -175.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -89.84 -4.56 57.52 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.979 -0.555 . . . . 63.53 111.201 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.4 mt 65.88 140.41 0.03 OUTLIER 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.532 1.933 . . . . 73.33 115.207 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -83.64 81.76 8.61 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.597 -2.371 . . . . 75.01 104.597 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -103.95 154.7 19.35 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-N 115.568 -0.742 . . . . 74.33 111.998 -171.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -52.85 -29.04 25.75 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.917 1.687 . . . . 62.44 111.607 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -57.7 -42.51 83.87 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.738 0.815 . . . . 74.25 110.365 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.41 ' HB2' HD11 ' A' ' 97' ' ' ILE . 3.0 mm? -67.01 -40.09 87.21 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.882 -0.599 . . . . 64.41 109.835 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -66.86 -47.51 71.67 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.287 -0.87 . . . . 75.3 109.731 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.14 -37.18 86.53 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.25 -0.432 . . . . 75.41 111.543 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -64.1 -50.45 68.24 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 110.27 -0.271 . . . . 74.2 110.27 175.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.445 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 40.7 tp -60.31 -53.01 62.7 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.721 -0.672 . . . . 73.23 110.166 -178.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.0 t -58.93 -42.17 85.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 C-N-CA 123.299 0.64 . . . . 72.04 112.592 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.42 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 52.5 ttt180 -70.98 -45.36 64.17 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.019 -0.672 . . . . 74.41 110.73 -176.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -66.25 -39.65 89.65 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.181 -0.674 . . . . 75.52 109.181 -177.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 7.9 mt -72.14 -25.48 61.73 Favored 'General case' 0 C--N 1.307 -1.283 0 N-CA-C 112.817 0.673 . . . . 73.35 112.817 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -68.13 -21.67 64.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.245 -1.02 . . . . 73.25 108.245 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.42 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 29.5 mtmt -92.26 -5.72 51.83 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.531 0.681 . . . . 74.11 109.948 178.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.442 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.4 m-80 -135.65 53.81 9.14 Favored Pre-proline 0 C--O 1.242 0.693 0 CA-C-N 115.403 -0.817 . . . . 61.43 112.06 -177.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.7 Cg_exo -68.96 -22.28 36.05 Favored 'Trans proline' 0 C--N 1.36 1.165 0 N-CA-C 108.881 -1.238 . . . . 73.34 108.881 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -67.55 -44.87 77.23 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 113.717 -1.583 . . . . 72.33 110.006 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.438 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 66.3 t90 -74.9 -44.9 46.24 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 119.708 -0.797 . . . . 75.52 110.062 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.551 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -58.01 -48.02 81.3 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.464 -1.244 . . . . 70.15 111.452 -173.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.657 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 19.6 p -54.5 -53.44 54.39 Favored 'General case' 0 C--O 1.21 -1.009 0 O-C-N 123.673 0.608 . . . . 75.24 111.791 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.61 -40.9 63.18 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.528 1.131 . . . . 72.12 112.687 176.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 39' ' ' SER . 31.3 mmmt -74.07 -30.51 62.41 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 120.288 -0.565 . . . . 75.41 111.543 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.635 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 95.4 mt -62.32 -37.95 87.56 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 108.836 -0.801 . . . . 74.33 108.836 172.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.657 ' HG3' ' O ' ' A' ' 34' ' ' SER . 74.7 mtp180 -62.54 -31.34 72.1 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.41 0.624 . . . . 72.43 111.199 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.49 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 39.4 m -73.07 -33.92 65.94 Favored 'General case' 0 N--CA 1.401 -2.897 0 C-N-CA 125.014 1.326 . . . . 72.43 111.814 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.613 ' CD1' HG22 ' A' ' 72' ' ' THR . 60.7 m-85 -95.93 -51.38 4.48 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.661 -0.7 . . . . 74.22 112.589 -176.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.525 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -96.71 111.26 56.78 Favored Pre-proline 0 N--CA 1.429 -1.522 0 N-CA-C 108.581 -0.896 . . . . 71.22 108.581 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.61 -11.93 16.9 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.582 2.188 . . . . 72.53 112.615 -177.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.5 p -114.34 29.52 7.96 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 123.619 0.768 . . . . 73.14 112.161 -176.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.657 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -47.51 111.51 0.43 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 115.222 1.564 . . . . 75.55 115.222 -175.624 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.48 65.83 0.69 Allowed 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 104.758 -2.312 . . . . 73.31 104.758 170.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.657 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.9 pp -91.96 -17.28 25.38 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.628 -1.624 . . . . 71.12 111.341 -171.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.0 -9.08 54.01 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.352 -0.84 . . . . 73.34 112.112 -174.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.0 m -80.15 89.13 5.42 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 115.484 -0.78 . . . . 71.24 112.17 -177.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -111.82 82.87 1.69 Allowed 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.6 -0.889 . . . . 74.4 108.6 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.86 -46.2 90.45 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 122.449 1.118 . . . . 65.44 111.708 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.475 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 53.9 mm-40 -101.26 168.92 8.43 Favored Pre-proline 0 C--N 1.244 -3.996 0 N-CA-C 105.469 -2.049 . . . . 64.24 105.469 175.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.422 ' C ' ' H ' ' A' ' 54' ' ' ASN . 23.4 Cg_exo -67.51 -144.33 0.02 OUTLIER 'Trans proline' 0 CA--C 1.551 1.354 0 C-N-CA 122.616 2.211 . . . . 75.24 112.826 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -76.12 36.87 0.15 Allowed 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.079 0.952 . . . . 73.43 111.409 -177.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.466 ' O ' HG12 ' A' ' 58' ' ' ILE . 5.2 m-20 -67.45 149.06 98.56 Favored Pre-proline 0 N--CA 1.432 -1.33 0 C-N-CA 126.162 1.785 . . . . 74.03 112.419 -175.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . 0.54 ' HG2' ' OE2' ' A' ' 56' ' ' GLU . 16.1 Cg_endo -61.99 -28.24 80.43 Favored 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.016 2.477 . . . . 63.1 111.598 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.54 ' OE2' ' HG2' ' A' ' 55' ' ' PRO . 3.4 mp0 -67.53 -37.9 83.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.526 -0.916 . . . . 73.35 108.526 177.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.475 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 84.9 t -74.29 -36.64 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 114.4 -1.273 . . . . 74.22 109.574 -178.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 54' ' ' ASN . 48.6 mm -64.72 -44.78 96.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.527 -0.76 . . . . 75.03 109.147 174.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . 0.475 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 59.8 t-80 -56.79 -40.84 76.64 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 123.254 0.621 . . . . 71.12 110.437 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.472 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 3.2 tpt180 -53.66 -48.19 69.66 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 125.16 1.384 . . . . 75.41 110.954 177.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.475 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 62.8 mt-30 -70.72 -50.97 30.6 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.869 -1.06 . . . . 65.3 110.756 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.422 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.2 mm? -66.78 -30.42 70.62 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 114.562 -1.199 . . . . 74.0 112.695 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 56.9 t30 -52.95 -40.39 63.62 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 125.132 1.373 . . . . 72.12 110.717 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.525 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 29.3 mmt180 -60.43 -30.76 69.83 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 72.13 112.976 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.03 -38.14 72.58 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.347 . . . . 73.23 110.886 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -71.71 -27.83 63.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.283 -0.636 . . . . 73.34 109.283 177.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.71 -31.94 72.23 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 115.189 -0.914 . . . . 72.34 109.665 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.404 ' HG2' ' CD1' ' A' ' 41' ' ' LEU . 8.7 mm-40 -70.84 -54.44 11.56 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 109.273 -0.64 . . . . 71.21 109.273 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -177.96 146.56 7.6 Favored Glycine 0 N--CA 1.417 -2.614 0 C-N-CA 120.447 -0.882 . . . . 75.42 113.111 -175.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -69.73 -26.76 64.48 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 106.056 -1.831 . . . . 73.44 106.056 169.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.83 -31.61 63.3 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 113.658 -1.61 . . . . 72.22 108.189 175.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.613 HG22 ' CD1' ' A' ' 40' ' ' PHE . 51.6 m -71.25 -39.67 71.48 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 115.538 -0.756 . . . . 73.33 111.07 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.498 ' HD1' ' O ' ' A' ' 95' ' ' VAL . 47.3 t-105 -63.9 -35.01 79.24 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 107.696 -1.224 . . . . 72.43 107.696 174.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.921 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 78.5 tttt -62.23 -45.85 91.5 Favored 'General case' 1 N--CA 1.366 -4.671 0 N-CA-C 114.832 1.419 . . . . 73.32 114.832 173.292 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.2 m -62.75 -34.95 78.26 Favored 'General case' 0 N--CA 1.41 -2.425 0 CA-C-O 122.081 0.943 . . . . 71.12 109.342 175.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . 0.409 ' HB3' ' O ' ' A' ' 73' ' ' TRP . 73.2 t80 -62.26 -52.44 63.72 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 113.835 -1.529 . . . . 73.11 112.623 -178.708 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.56 HG13 ' HA ' ' A' ' 95' ' ' VAL . 50.2 mm -68.04 -29.13 43.65 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 C-N-CA 119.022 -1.071 . . . . 74.21 111.094 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -63.76 -41.22 98.02 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.188 -0.46 . . . . 73.23 110.93 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -76.12 -37.04 58.57 Favored 'General case' 0 C--O 1.21 -1.015 0 C-N-CA 120.412 -0.515 . . . . 73.2 110.307 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.49 -54.21 24.03 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.989 1.315 . . . . 74.21 109.388 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.448 ' SG ' HD11 ' A' ' 88' ' ' LEU . 60.1 m -64.16 -38.36 90.77 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.405 -0.816 . . . . 73.51 111.654 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -75.57 -48.18 23.46 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.067 -0.515 . . . . 75.0 111.404 -175.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -76.48 -33.66 58.68 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 114.918 1.451 . . . . 74.2 114.918 -175.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.6 mt -83.14 -21.63 33.54 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.661 -0.815 . . . . 74.03 111.324 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 70.89 -9.06 0.87 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.321 1.048 . . . . 62.31 112.935 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.02 137.56 94.65 Favored Pre-proline 0 N--CA 1.437 -1.11 0 N-CA-C 109.092 -0.707 . . . . 75.13 109.092 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -84.41 102.81 0.9 Allowed 'Trans proline' 0 N--CA 1.436 -1.854 0 C-N-CA 121.755 1.637 . . . . 65.24 112.978 -177.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.448 HD11 ' SG ' ' A' ' 81' ' ' CYS . 4.5 mp -90.96 -41.07 11.33 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 107.936 -1.135 . . . . 61.44 107.936 173.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.9 t70 68.71 -54.33 0.55 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.531 1.532 . . . . 74.43 112.923 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 64.4 mtt -96.94 82.3 3.22 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.593 -0.892 . . . . 53.35 108.593 175.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -71.3 -34.31 70.5 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 125.735 1.614 . . . . 73.14 112.257 -176.093 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.498 ' HB ' ' HD3' ' A' ' 93' ' ' PRO . 50.1 mm -49.66 -52.07 54.04 Favored Pre-proline 0 CA--C 1.572 1.792 0 C-N-CA 125.004 1.322 . . . . 72.52 113.475 -173.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 13.8 Cg_exo -58.84 -37.94 91.12 Favored 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 121.526 1.484 . . . . 75.42 111.649 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.605 ' O ' HG21 ' A' ' 97' ' ' ILE . 4.2 mm? -64.04 -37.46 87.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.567 0.747 . . . . 65.41 111.286 176.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.921 ' CG2' ' HA ' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -85.69 -27.64 6.32 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.179 0 CA-C-O 121.877 0.846 . . . . 74.5 112.712 -171.234 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' SER . . . . . 0.414 ' CB ' ' HG2' ' A' ' 9' ' ' GLU . 9.4 t -101.66 5.3 41.43 Favored 'General case' 0 C--N 1.256 -3.485 0 C-N-CA 119.245 -0.982 . . . . 72.33 111.279 -177.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.605 HG21 ' O ' ' A' ' 94' ' ' LEU . 15.5 tt -77.14 -49.62 22.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 112.643 0.609 . . . . 75.33 112.643 -177.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.2 m0 . . . . . 0 CA--C 1.56 1.36 0 C-N-CA 126.23 1.812 . . . . 74.42 113.124 -176.577 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.528 ' SD ' ' HB3' ' A' ' 74' ' ' LYS . 34.6 tpp . . . . . 0 C--O 1.216 -0.673 0 CA-C-O 121.621 0.724 . . . . 75.33 110.53 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -109.03 24.96 12.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.743 -0.662 . . . . 75.32 110.606 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.453 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -79.46 -7.43 58.41 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.111 0.958 . . . . 72.0 109.721 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -30.05 67.44 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.937 1.295 . . . . 75.3 111.791 -178.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.499 ' HB2' HD12 ' A' ' 11' ' ' ILE . 49.6 m -57.39 -29.32 63.99 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 125.418 1.487 . . . . 73.33 110.348 174.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.499 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -88.13 -34.28 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.218 0 CA-C-N 114.126 -1.397 . . . . 74.31 111.666 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -75.22 -66.63 0.74 Allowed 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.223 1.564 . . . . 74.34 115.223 -167.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 54.9 177.09 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 115.31 1.596 . . . . 73.13 115.31 -178.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 38.7 t30 68.92 126.66 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 125.317 1.447 . . . . 74.2 110.472 -176.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.471 ' HB2' HG13 ' A' ' 97' ' ' ILE . 9.1 p30 -150.84 28.21 0.69 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 114.315 1.228 . . . . 74.45 114.315 -173.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.48 -49.97 67.07 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.294 -0.963 . . . . 64.03 113.288 -176.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -75.52 -33.03 60.69 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.246 -1.02 . . . . 73.45 108.246 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.476 HD21 ' HA ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -55.76 -46.61 77.83 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 113.73 -1.577 . . . . 74.11 111.262 178.865 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -59.57 -48.15 82.8 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.431 -0.804 . . . . 74.51 110.986 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.71 65.91 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.2 -0.455 . . . . 74.55 111.362 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 42.1 t-105 -71.1 -51.4 25.33 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 110.269 -0.271 . . . . 74.54 110.269 175.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.91 -51.17 67.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.023 -0.535 . . . . 75.12 110.473 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.5 t -60.11 -45.14 96.15 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-N 115.602 -0.727 . . . . 75.3 112.73 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 75.7 ttt180 -71.82 -41.93 67.61 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.483 -0.487 . . . . 74.2 110.864 -177.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.408 HD12 HD12 ' A' ' 84' ' ' LEU . 1.9 tm? -65.66 -41.91 91.96 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.255 0.55 . . . . 73.43 109.864 -177.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.411 HD11 HD22 ' A' ' 33' ' ' LEU . 4.3 mt -72.17 -24.96 61.52 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.342 0.497 . . . . 74.14 112.342 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.8 t -67.04 -24.65 66.02 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 108.4 -0.963 . . . . 71.14 108.4 177.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 59.5 mttt -87.02 -12.95 45.85 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.612 -0.722 . . . . 63.24 109.66 178.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.424 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.6 m-80 -129.97 54.06 13.43 Favored Pre-proline 0 N--CA 1.444 -0.747 0 CA-C-N 115.353 -0.84 . . . . 64.24 113.208 -173.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.424 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.0 Cg_exo -69.48 -22.2 33.72 Favored 'Trans proline' 0 C--N 1.357 1.003 0 N-CA-C 108.24 -1.485 . . . . 74.51 108.24 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.83 -41.8 91.32 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.593 -1.639 . . . . 74.34 109.893 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.478 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 76.5 t90 -75.3 -43.64 49.9 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.518 -0.873 . . . . 74.45 109.934 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.425 HD11 ' HG ' ' A' ' 37' ' ' LEU . 1.9 tm? -60.69 -40.16 91.16 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.38 -1.282 . . . . 73.42 111.191 -173.335 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.501 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 51.0 p -53.46 -53.52 50.26 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.196 0.31 . . . . 74.1 111.21 176.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.427 ' HA ' ' NE ' ' A' ' 38' ' ' ARG . . . -52.1 -48.62 64.65 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.519 1.528 . . . . 74.43 112.192 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.478 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 69.0 mmtt -69.27 -32.03 70.95 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 120.424 -0.51 . . . . 62.31 111.921 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.47 HD12 HD23 ' A' ' 46' ' ' LEU . 37.4 mt -67.15 -31.05 71.22 Favored 'General case' 0 C--O 1.187 -2.212 0 C-N-CA 120.127 -0.629 . . . . 74.43 110.367 173.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.501 ' HG3' ' O ' ' A' ' 34' ' ' SER . 24.6 mtm180 -61.79 -33.61 74.42 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.792 0.806 . . . . 74.22 109.589 177.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 75.3 m -78.4 -29.66 47.34 Favored 'General case' 0 N--CA 1.398 -3.073 0 C-N-CA 125.126 1.37 . . . . 64.33 113.174 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.566 ' CD1' HG21 ' A' ' 72' ' ' THR . 52.5 m-85 -102.16 -46.63 4.78 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 112.863 0.69 . . . . 74.31 112.863 -178.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.407 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 8.7 mp -91.29 135.59 28.03 Favored Pre-proline 0 C--N 1.294 -1.84 0 C-N-CA 124.491 1.116 . . . . 71.32 110.701 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -90.86 -14.44 1.89 Allowed 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.343 2.029 . . . . 60.02 110.453 169.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.2 p -114.01 28.2 8.94 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 124.44 1.096 . . . . 71.31 111.531 -175.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.407 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -68.43 113.2 5.78 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.664 -1.153 . . . . 74.41 112.733 -177.295 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -147.14 75.55 1.38 Allowed 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 114.364 -1.289 . . . . 75.02 109.008 173.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -92.81 -12.29 31.55 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.126 -1.397 . . . . 65.44 108.744 -179.268 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.98 -16.66 63.79 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.264 -1.335 . . . . 72.45 111.538 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 51.8 t -79.72 92.95 5.47 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 106.98 -1.489 . . . . 64.43 106.98 173.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.5 m -91.32 86.34 6.09 Favored 'General case' 0 N--CA 1.411 -2.378 0 CA-C-O 121.783 0.802 . . . . 72.02 111.733 -176.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -41.57 82.05 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.867 1.318 . . . . 74.12 108.597 173.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.579 ' HG3' ' CG2' ' A' ' 57' ' ' VAL . 2.5 pt-20 -137.34 163.37 49.38 Favored Pre-proline 0 C--N 1.258 -3.386 0 CA-C-N 112.216 -2.265 . . . . 63.14 108.097 170.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.42 -156.43 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.814 2.343 . . . . 72.04 113.057 -177.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 m -75.59 38.75 0.15 Allowed 'General case' 0 C--O 1.251 1.157 0 C-N-CA 124.616 1.166 . . . . 71.3 112.571 -176.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.456 ' ND2' ' HB2' ' A' ' 51' ' ' GLU . 95.8 m-20 -58.47 152.06 46.65 Favored Pre-proline 0 N--CA 1.436 -1.17 0 C-N-CA 125.5 1.52 . . . . 73.44 111.025 177.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.73 -39.11 90.95 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.514 2.809 . . . . 75.45 112.732 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -72.75 -31.96 65.31 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.683 -0.69 . . . . 72.43 110.05 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.579 ' CG2' ' HG3' ' A' ' 51' ' ' GLU . 67.5 t -69.66 -46.33 75.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.298 -0.864 . . . . 74.23 108.89 178.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.442 ' O ' HD21 ' A' ' 62' ' ' LEU . 46.5 mm -59.45 -46.92 92.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.037 -0.983 . . . . 75.54 109.338 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -55.93 -39.68 72.04 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.791 0.436 . . . . 73.35 111.483 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -64.07 -39.82 94.92 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.349 0.595 . . . . 71.45 111.2 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 78.2 mt-30 -70.81 -45.49 64.51 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.019 -0.992 . . . . 74.13 110.395 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.442 HD21 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -66.14 -31.08 71.71 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.254 -1.339 . . . . 74.32 111.509 -178.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -52.75 -43.06 65.51 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.869 1.268 . . . . 74.13 110.57 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.88 -30.09 63.55 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.305 -1.316 . . . . 73.52 113.076 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.9 mt -72.34 -42.29 65.51 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-O 120.623 0.249 . . . . 70.31 111.431 -177.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -70.55 -28.14 64.68 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.367 -0.975 . . . . 75.34 108.367 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.56 -41.07 96.54 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.079 -0.964 . . . . 64.2 109.841 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.5 mm-40 -63.96 -47.19 81.4 Favored 'General case' 0 N--CA 1.426 -1.666 0 N-CA-C 109.641 -0.503 . . . . 74.44 109.641 176.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -176.92 143.44 6.31 Favored Glycine 0 N--CA 1.407 -3.261 0 C-N-CA 120.356 -0.926 . . . . 73.34 113.841 -176.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -69.87 -27.11 64.55 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 106.565 -1.643 . . . . 74.44 106.565 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.05 -37.66 58.03 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.407 -1.269 . . . . 73.24 108.473 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.566 HG21 ' CD1' ' A' ' 40' ' ' PHE . 94.0 m -59.6 -35.66 74.76 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.093 -0.958 . . . . 75.24 110.754 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 58.5 t-105 -63.88 -42.69 97.44 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 109.668 -0.493 . . . . 75.23 109.668 178.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.528 ' HB3' ' SD ' ' A' ' 6' ' ' MET . 50.3 mttt -62.84 -47.09 84.9 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.198 0.599 . . . . 75.55 110.887 177.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.7 m -61.32 -40.8 95.55 Favored 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 115.914 -0.584 . . . . 71.12 110.882 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -60.64 -50.65 72.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.363 -0.835 . . . . 71.14 111.016 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.455 HG13 ' HA ' ' A' ' 95' ' ' VAL . 32.4 mm -66.88 -33.38 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 120.482 -0.487 . . . . 63.42 111.528 -175.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -60.63 -43.16 97.85 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.862 -0.422 . . . . 73.53 109.862 176.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.466 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.3 m-20 -71.66 -42.11 67.92 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.98 -0.554 . . . . 75.52 111.274 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.463 ' HA ' ' CZ2' ' A' ' 32' ' ' TRP . 2.4 tm? -50.45 -54.62 20.7 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.346 1.458 . . . . 75.3 109.774 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.432 ' SG ' ' HB2' ' A' ' 88' ' ' LEU . 46.9 t -67.55 -32.21 72.83 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.806 -1.088 . . . . 74.21 111.24 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -72.85 -44.58 61.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.448 -0.796 . . . . 74.3 111.65 -176.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 9.8 mt-10 -89.24 -19.67 25.09 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 113.98 1.104 . . . . 73.22 113.98 -171.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.408 HD12 HD12 ' A' ' 25' ' ' LEU 0.255 85.3 mt -82.16 49.13 1.35 Allowed 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 115.658 1.725 . . . . 70.23 115.658 -174.579 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.455 ' OD2' HG23 ' A' ' 86' ' ' VAL . 26.6 t70 71.73 -73.11 0.1 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.684 1.364 . . . . 64.34 114.684 173.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.455 HG23 ' OD2' ' A' ' 85' ' ' ASP . 71.3 t -99.77 124.46 43.94 Favored Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 122.385 -0.197 . . . . 73.44 110.917 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.28 107.06 0.76 Allowed 'Trans proline' 0 C--O 1.252 1.202 0 C-N-CA 122.845 2.363 . . . . 74.12 111.481 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.432 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 4.8 mp -64.45 -38.87 92.55 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.312 -0.858 . . . . 73.35 109.606 179.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.9 t70 65.38 9.94 6.13 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-O 122.818 1.294 . . . . 73.03 111.333 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.456 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 25.5 ptm -124.43 39.95 3.85 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 107.657 -1.238 . . . . 74.2 107.657 177.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -40.13 95.05 Favored 'General case' 0 C--O 1.203 -1.386 0 CA-C-N 114.021 -1.445 . . . . 75.42 111.003 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.556 ' HA ' HG13 ' A' ' 95' ' ' VAL . 31.1 mm -64.53 -48.33 74.76 Favored Pre-proline 0 C--N 1.29 -2.003 0 CA-C-O 119.088 -0.482 . . . . 70.41 111.518 179.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.456 ' HD2' ' C ' ' A' ' 90' ' ' MET . 84.6 Cg_exo -51.23 -38.44 61.4 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 121.507 1.471 . . . . 75.23 111.01 170.077 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.476 ' HA ' HD21 ' A' ' 18' ' ' LEU . 3.2 mm? -63.48 -46.47 86.0 Favored 'General case' 0 C--O 1.188 -2.178 0 O-C-N 123.371 0.42 . . . . 74.12 112.076 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.556 HG13 ' HA ' ' A' ' 92' ' ' ILE . 5.7 p -68.79 -31.53 51.12 Favored 'Isoleucine or valine' 0 C--O 1.251 1.18 0 CA-C-O 122.377 1.084 . . . . 73.11 112.817 -178.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.5 t -62.36 -6.86 3.59 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 113.329 -1.759 . . . . 71.45 111.621 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.471 HG13 ' HB2' ' A' ' 15' ' ' ASN . 15.3 tt -61.21 -28.58 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 124.333 1.053 . . . . 75.35 111.869 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 34.0 t-105 . . . . . 0 C--N 1.315 -0.91 0 C-N-CA 120.539 -0.465 . . . . 72.13 111.478 -174.449 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.431 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 2.1 mpt? . . . . . 0 C--O 1.213 -0.832 0 N-CA-C 111.343 0.127 . . . . 74.23 111.343 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -81.16 24.58 0.52 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 113.055 0.761 . . . . 74.41 113.055 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.46 -17.66 56.0 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.425 -0.583 . . . . 74.31 109.425 174.116 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 6' ' ' MET . 0.3 OUTLIER -54.18 -43.63 70.85 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.078 0.951 . . . . 74.45 111.527 178.973 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -55.83 -31.54 62.81 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 124.743 1.217 . . . . 72.42 111.224 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.403 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.2 mp -87.6 -34.84 7.65 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 C-N-CA 124.825 1.25 . . . . 71.34 111.521 -176.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -91.63 -44.27 9.14 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 115.436 1.643 . . . . 75.33 115.436 -171.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 64.44 171.01 0.19 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.778 0.831 . . . . 75.22 112.989 -174.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . 0.402 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 4.4 p-10 -108.56 -176.97 3.19 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 112.724 0.638 . . . . 72.4 112.724 -175.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . 0.493 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 45.2 t-20 -155.26 142.95 19.78 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.557 -0.905 . . . . 74.34 108.557 -176.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.83 -29.83 67.19 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.779 0.659 . . . . 71.53 112.779 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -68.41 -32.85 73.18 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 122.405 1.098 . . . . 73.43 108.959 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.493 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 7.0 tt -69.92 -35.11 74.31 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 113.158 -1.837 . . . . 74.34 109.568 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 59.2 t-105 -63.63 -44.97 92.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.596 -0.52 . . . . 75.43 109.596 175.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.46 -40.99 93.18 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.033 -0.531 . . . . 74.3 110.308 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -57.49 -50.57 72.64 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.643 -0.708 . . . . 73.4 110.704 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.454 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 57.4 tp -59.53 -51.32 70.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.059 -0.519 . . . . 74.23 110.609 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.54 -51.4 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.095 -0.502 . . . . 75.13 111.984 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -70.27 -38.46 75.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.964 0.357 . . . . 75.33 111.964 -174.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -66.47 -41.52 88.89 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.881 -0.785 . . . . 75.3 108.881 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 5.4 mt -70.71 -24.89 62.73 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.412 0.523 . . . . 71.32 112.412 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.1 m -68.46 -20.91 64.65 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.024 -0.732 . . . . 75.32 109.024 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.1 mtmt -92.06 -3.56 55.61 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.799 -0.637 . . . . 63.31 109.31 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.445 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 54.1 m-80 -137.53 54.08 7.48 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 115.641 -0.709 . . . . 74.43 111.945 -177.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.445 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 13.4 Cg_exo -70.41 -19.86 32.5 Favored 'Trans proline' 0 C--N 1.358 1.044 0 N-CA-C 108.643 -1.329 . . . . 71.53 108.643 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -69.56 -43.93 71.9 Favored 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.06 -1.427 . . . . 75.33 109.731 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.0 t90 -74.77 -43.05 56.87 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 120.133 -0.627 . . . . 75.13 110.196 177.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.4 tm? -59.77 -45.78 91.2 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.178 -0.919 . . . . 72.33 111.016 -173.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.1 p -62.54 -35.37 79.23 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 112.025 0.38 . . . . 62.45 112.025 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.53 99.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.469 0.652 . . . . 65.24 110.391 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 39' ' ' SER . 53.9 mmtt -72.48 -31.7 65.61 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 120.234 -0.586 . . . . 73.02 111.714 175.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 73.0 mt -58.43 -50.84 72.25 Favored 'General case' 0 C--O 1.201 -1.462 0 CA-C-O 119.864 -0.112 . . . . 73.21 111.229 176.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.503 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 8.1 ppt_? -60.4 -30.49 69.63 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.232 0.826 . . . . 74.52 113.232 -178.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.422 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 52.4 m -72.38 -50.13 28.83 Favored 'General case' 1 N--CA 1.375 -4.214 0 CA-C-N 114.55 -1.204 . . . . 74.14 112.078 176.61 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.438 ' CD1' HG22 ' A' ' 72' ' ' THR . 55.5 m-85 -80.8 -43.89 19.37 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.507 0.929 . . . . 75.34 113.507 -175.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.591 ' HG ' ' OE1' ' A' ' 68' ' ' GLN . 6.5 mp -79.43 124.78 83.89 Favored Pre-proline 0 C--N 1.287 -2.116 0 C-N-CA 124.125 0.97 . . . . 74.31 111.605 -176.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -82.08 -10.33 11.45 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.875 1.716 . . . . 72.43 107.957 168.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 p -111.48 29.33 7.92 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 127.29 2.236 . . . . 75.44 109.987 -178.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.503 ' HG2' ' HA ' ' A' ' 38' ' ' ARG 0.314 0.0 OUTLIER -54.0 92.41 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 116.502 2.038 . . . . 75.14 116.502 -179.401 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . 0.63 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 8.7 m-20 -118.44 81.65 1.72 Allowed 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.607 -1.627 . . . . 75.51 106.607 174.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 pp -95.51 -6.52 40.37 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.161 -1.381 . . . . 72.31 111.52 -176.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.78 4.0 49.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.391 -0.822 . . . . 75.34 110.375 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . 0.63 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 64.3 m -88.32 30.46 0.88 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.414 0.626 . . . . 74.53 111.57 -177.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -80.2 89.51 5.46 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 109.236 -0.653 . . . . 70.41 109.236 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.37 -25.51 65.11 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.049 -0.978 . . . . 72.52 112.584 178.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -132.58 167.75 21.15 Favored Pre-proline 1 N--CA 1.378 -4.039 0 CA-C-N 113.925 -1.489 . . . . 65.44 107.176 178.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . 0.401 ' C ' ' H ' ' A' ' 54' ' ' ASN . 43.4 Cg_exo -63.79 -141.06 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.388 2.725 . . . . 72.03 113.285 176.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -76.21 37.65 0.16 Allowed 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.773 0.829 . . . . 75.1 111.963 -177.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . 0.401 ' H ' ' C ' ' A' ' 52' ' ' PRO . 6.4 m120 -67.64 145.78 98.3 Favored Pre-proline 0 C--N 1.301 -1.519 0 C-N-CA 124.497 1.119 . . . . 71.41 111.491 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.1 -38.2 92.57 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.413 2.742 . . . . 71.2 113.187 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.08 -28.69 60.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.741 0.305 . . . . 62.41 110.359 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -66.04 -50.9 66.04 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.511 0 N-CA-C 107.835 -1.172 . . . . 75.03 107.835 176.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.4 mm -59.67 -42.7 89.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.329 -1.305 . . . . 74.33 109.873 177.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -58.44 -36.29 73.42 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.978 -0.556 . . . . 70.12 111.592 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.41 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 31.7 ttm-85 -63.16 -41.79 99.3 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.951 0.882 . . . . 74.15 110.731 177.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -67.23 -39.65 86.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.547 -1.206 . . . . 74.4 110.313 -177.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.461 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.3 mm? -74.09 -31.05 62.65 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.8 -1.091 . . . . 72.04 110.676 177.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . 0.41 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 8.6 t30 -61.87 -35.51 78.51 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 124.247 1.019 . . . . 73.55 109.364 178.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -58.26 -55.84 29.85 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 114.98 -1.009 . . . . 75.3 110.257 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . 0.5 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 79.6 mt -57.27 -33.83 68.02 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.929 0.491 . . . . 74.32 111.327 -177.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -57.15 -45.86 83.21 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.554 -0.748 . . . . 72.13 109.561 176.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.4 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 61.51 110.811 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.591 ' OE1' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -60.25 -47.68 84.98 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 123.842 0.857 . . . . 73.4 111.067 177.046 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 166.47 138.46 2.44 Favored Glycine 0 N--CA 1.411 -3.03 0 C-N-CA 119.867 -1.159 . . . . 61.2 112.695 -178.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.422 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -70.29 -27.07 64.11 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 105.913 -1.884 . . . . 75.41 105.913 170.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.4 67.59 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.111 -1.404 . . . . 73.35 108.044 175.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.438 HG22 ' CD1' ' A' ' 40' ' ' PHE . 98.7 m -64.93 -34.43 78.38 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.356 -0.838 . . . . 73.44 110.087 177.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.461 ' CH2' HD12 ' A' ' 62' ' ' LEU . 33.1 t-105 -66.56 -39.52 88.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.503 -0.554 . . . . 73.43 109.503 179.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.529 ' HG2' HG21 ' A' ' 95' ' ' VAL . 84.3 mttt -57.17 -52.0 67.06 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 122.874 0.469 . . . . 74.41 111.084 174.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.6 m -58.09 -41.82 84.31 Favored 'General case' 0 N--CA 1.411 -2.383 0 CA-C-O 121.791 0.805 . . . . 74.33 110.13 178.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -61.12 -49.96 75.16 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 114.497 -1.229 . . . . 74.12 111.567 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.585 HG23 ' O ' ' A' ' 91' ' ' GLU . 49.1 mm -68.15 -31.38 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 119.676 -0.809 . . . . 74.21 112.01 -175.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -62.04 -37.47 85.04 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.195 0.521 . . . . 73.21 109.745 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.21 -35.92 47.9 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.426 -0.51 . . . . 75.51 111.733 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -53.02 -54.88 28.77 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 124.657 1.183 . . . . 75.1 109.004 178.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 14.8 p -68.34 -36.82 79.82 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.839 -0.618 . . . . 63.2 112.605 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.66 -54.43 7.44 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.932 -0.576 . . . . 72.13 112.029 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -76.31 -21.31 56.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.93 1.085 . . . . 75.13 113.93 -172.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.33 19.21 2.83 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 112.21 0.448 . . . . 72.12 112.21 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 72.94 -63.33 0.44 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.478 1.511 . . . . 75.25 112.65 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.5 m -72.63 120.69 82.04 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-O 121.115 0.483 . . . . 74.34 112.087 -176.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -72.1 117.38 5.11 Favored 'Trans proline' 0 N--CA 1.44 -1.652 0 C-N-CA 121.813 1.675 . . . . 74.33 109.719 177.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.401 ' C ' ' H ' ' A' ' 90' ' ' MET . 80.5 mt -79.97 -28.94 39.5 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 116.231 -0.44 . . . . 75.2 110.231 -178.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.9 t70 71.66 -44.47 0.59 Allowed 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 126.116 1.766 . . . . 74.3 111.301 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.479 ' O ' HD23 ' A' ' 94' ' ' LEU . 67.8 mtt -84.22 47.92 1.41 Allowed 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 125.192 1.397 . . . . 74.32 110.273 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.585 ' O ' HG23 ' A' ' 77' ' ' ILE . 10.7 pt-20 -70.68 -35.63 72.91 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.254 0.55 . . . . 74.42 111.147 -178.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.549 ' HA ' HG12 ' A' ' 95' ' ' VAL . 24.4 mm -63.96 -47.8 79.61 Favored Pre-proline 0 C--O 1.184 -2.354 0 CA-C-O 118.292 -0.861 . . . . 74.32 111.028 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.462 ' HD2' ' C ' ' A' ' 90' ' ' MET . 25.4 Cg_exo -48.76 -37.41 35.44 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 122.098 1.865 . . . . 73.13 112.176 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.486 ' HA ' HD21 ' A' ' 18' ' ' LEU . 4.5 mm? -67.51 -36.42 81.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.193 0.597 . . . . 75.42 111.287 175.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.549 HG12 ' HA ' ' A' ' 92' ' ' ILE . 7.5 p -84.58 -32.69 7.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-O 122.178 0.99 . . . . 72.15 113.026 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.5 t -63.13 -6.5 4.28 Favored 'General case' 0 C--N 1.271 -2.845 0 CA-C-N 113.935 -1.484 . . . . 73.55 112.427 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.402 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 13.8 tt -71.63 -17.36 19.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-O 121.829 0.823 . . . . 74.33 109.654 177.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.469 0 N-CA-C 104.899 -2.26 . . . . 73.24 104.899 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' MET . . . . . 0.532 ' SD ' HD13 ' A' ' 92' ' ' ILE . 47.8 tpp . . . . . 0 CA--C 1.551 0.99 0 CA-C-O 122.57 1.176 . . . . 74.41 110.005 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . 0.421 ' O ' HD12 ' A' ' 11' ' ' ILE . 52.4 m-20 -118.88 24.76 10.65 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-N 114.157 -1.383 . . . . 75.02 108.524 177.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.52 -19.74 52.26 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.935 -0.765 . . . . 71.32 108.935 175.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.465 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -53.66 -45.5 70.28 Favored 'General case' 0 C--O 1.207 -1.148 0 N-CA-C 114.735 1.383 . . . . 75.41 114.735 -177.248 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' SER . . . . . 0.422 ' HB2' HD13 ' A' ' 11' ' ' ILE . 73.0 m -65.24 -35.91 82.51 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-O 121.74 0.781 . . . . 72.44 111.895 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . 0.422 HD13 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.4 -41.06 14.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 C-N-CA 124.383 1.073 . . . . 75.14 111.852 -172.202 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmm180 -103.18 7.89 38.59 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.846 0.858 . . . . 72.43 112.008 -172.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -43.78 126.43 4.65 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.571 1.322 . . . . 74.14 114.571 -173.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -152.36 132.07 13.17 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 103.642 -2.725 . . . . 70.35 103.642 174.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -118.84 -61.37 1.66 Allowed 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.667 -0.813 . . . . 64.41 112.841 -174.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -71.11 -48.4 52.43 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.349 0.499 . . . . 75.32 112.349 -171.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -66.1 -35.83 81.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.871 0.844 . . . . 73.53 109.557 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -70.43 -42.32 71.72 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 114.304 -1.316 . . . . 74.12 110.051 -178.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -60.0 -51.37 69.95 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.575 -0.528 . . . . 72.32 109.575 175.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -57.71 -48.54 79.28 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.79 -0.641 . . . . 73.11 111.119 -178.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.687 ' CH2' ' HB2' ' A' ' 25' ' ' LEU . 7.7 t-105 -56.25 -50.91 69.98 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 123.252 0.345 . . . . 73.13 111.276 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.89 -42.73 94.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 110.358 -0.238 . . . . 72.2 110.358 -176.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.41 -46.04 97.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.248 -0.433 . . . . 72.23 110.787 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.511 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 67.0 mtt180 -62.85 -48.17 80.18 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 109.786 -0.45 . . . . 73.02 109.786 178.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.687 ' HB2' ' CH2' ' A' ' 21' ' ' TRP . 30.1 tp -55.45 -48.56 74.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.693 1.197 . . . . 74.42 111.705 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.65 -23.98 59.93 Favored 'General case' 0 C--N 1.281 -2.393 0 CA-C-N 115.475 -0.784 . . . . 63.42 112.73 -179.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.6 t -75.22 -16.93 60.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 107.735 -1.209 . . . . 62.2 107.735 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 39.1 mtmt -90.61 -13.81 33.65 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.361 -0.607 . . . . 74.11 109.361 174.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.491 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.0 m-80 -137.34 49.48 2.84 Favored Pre-proline 0 C--O 1.241 0.657 0 CA-C-N 115.489 -0.778 . . . . 71.42 112.187 -175.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.491 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.1 Cg_exo -71.33 -20.79 27.41 Favored 'Trans proline' 0 C--N 1.362 1.265 0 N-CA-C 108.522 -1.376 . . . . 65.15 108.522 -178.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.14 -39.45 78.83 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 113.851 -1.522 . . . . 75.02 109.839 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.585 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 61.4 t90 -74.08 -40.13 62.97 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 118.872 -1.131 . . . . 74.02 109.136 178.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.467 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 1.4 tm? -62.84 -39.86 95.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 114.674 -1.148 . . . . 75.5 109.783 -175.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 65.9 m -53.28 -49.53 66.75 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 123.468 0.48 . . . . 74.33 111.024 175.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.46 -46.09 73.25 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.332 1.053 . . . . 64.52 112.002 177.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 39' ' ' SER . 67.5 mmtt -68.6 -35.33 77.18 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 121.054 -0.258 . . . . 75.15 111.433 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.9 mt -60.24 -34.31 73.51 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 122.333 -0.229 . . . . 75.43 110.523 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -61.75 -35.93 79.54 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.635 0.731 . . . . 73.11 110.264 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' SER . . . . . 0.436 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 69.1 m -78.69 -28.52 45.23 Favored 'General case' 0 N--CA 1.402 -2.856 0 C-N-CA 125.362 1.465 . . . . 74.52 113.055 -177.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.593 ' CD1' HG22 ' A' ' 72' ' ' THR . 61.4 m-85 -102.44 -45.8 4.97 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.75 1.019 . . . . 73.11 113.75 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.0 125.53 70.28 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 114.359 1.244 . . . . 74.34 114.359 -173.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.64 -0.3 5.83 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 122.555 2.17 . . . . 73.43 108.396 166.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 p -106.89 17.48 23.06 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 126.297 1.839 . . . . 75.15 109.902 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.24 92.07 0.04 OUTLIER 'General case' 0 N--CA 1.41 -2.459 0 CA-C-N 114.168 -1.378 . . . . 73.24 111.269 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -129.47 56.6 1.7 Allowed 'General case' 0 CA--C 1.484 -1.588 0 N-CA-C 102.811 -3.033 . . . . 72.1 102.811 169.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 pp -90.2 -18.4 25.8 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.484 -1.689 . . . . 74.32 110.051 -171.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.94 -19.88 64.19 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 114.729 -1.123 . . . . 55.33 109.833 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 49.2 t -100.85 107.78 19.4 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.504 -1.225 . . . . 74.33 107.762 177.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.4 m -133.28 117.39 17.31 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.677 0.751 . . . . 73.34 110.799 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.97 -15.04 62.98 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.5 -1.227 . . . . 73.13 114.028 -178.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -137.0 165.86 31.62 Favored Pre-proline 0 N--CA 1.382 -3.848 0 N-CA-C 107.423 -1.325 . . . . 64.42 107.423 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.67 -149.51 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.241 1.961 . . . . 73.43 110.737 175.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.2 m -76.2 37.9 0.17 Allowed 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.019 0.928 . . . . 75.33 112.61 -176.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -63.69 153.01 84.96 Favored Pre-proline 0 N--CA 1.448 -0.562 0 C-N-CA 123.968 0.907 . . . . 74.51 112.196 -177.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.79 -44.56 43.98 Favored 'Trans proline' 0 C--N 1.363 1.301 0 C-N-CA 123.828 3.019 . . . . 72.12 113.341 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -73.92 -23.1 59.49 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 112.301 0.482 . . . . 71.44 112.301 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . 0.634 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 91.6 t -75.59 -36.87 35.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.093 -1.077 . . . . 71.4 108.093 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 mm -64.53 -45.59 95.16 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.036 -1.098 . . . . 72.21 108.036 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -54.16 -42.7 69.89 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.011 0.924 . . . . 74.4 110.462 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.634 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 36.2 ttt180 -54.5 -49.11 70.93 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.583 1.553 . . . . 74.34 110.831 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 90.4 mt-30 -64.58 -48.71 73.96 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.298 -0.865 . . . . 74.23 111.173 -177.407 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.493 HD11 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -72.13 -30.55 65.17 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.86 -1.064 . . . . 72.05 111.546 -175.202 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -53.35 -50.5 64.9 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 124.382 1.073 . . . . 71.43 111.01 175.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -54.92 -32.28 61.05 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.007 -1.451 . . . . 62.43 112.831 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.7 mt -72.18 -43.46 64.51 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.559 -0.291 . . . . 61.12 111.019 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . 0.511 ' CE1' ' HG2' ' A' ' 70' ' ' MET . 78.1 t80 -68.04 -30.21 69.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.768 -0.827 . . . . 70.04 108.768 177.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.56 68.73 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.038 -0.983 . . . . 51.51 110.777 176.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -70.93 -55.43 8.4 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 108.748 -0.834 . . . . 72.34 108.748 174.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.63 145.97 9.13 Favored Glycine 0 CA--C 1.476 -2.364 0 CA-C-N 115.147 -0.933 . . . . 64.25 112.016 -175.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.511 ' HG2' ' CE1' ' A' ' 66' ' ' PHE . 66.3 mtm -70.52 -27.97 64.58 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 105.51 -2.033 . . . . 72.12 105.51 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . 0.475 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . . . -74.13 -39.4 63.35 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.342 -1.754 . . . . 72.54 108.719 175.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.593 HG22 ' CD1' ' A' ' 40' ' ' PHE . 66.8 m -58.87 -42.05 88.53 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.693 -0.685 . . . . 75.11 109.286 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.495 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 70.4 t-105 -65.88 -40.51 91.65 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 116.307 -0.406 . . . . 73.35 111.556 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.63 ' CB ' HG23 ' A' ' 95' ' ' VAL . 14.7 ptpt -67.93 -41.89 81.86 Favored 'General case' 0 CA--C 1.506 -0.72 0 O-C-N 121.518 -0.739 . . . . 74.43 112.22 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.3 m -63.69 -37.15 86.27 Favored 'General case' 0 N--CA 1.406 -2.674 0 CA-C-N 115.332 -0.849 . . . . 74.04 110.171 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.41 -50.72 71.7 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.174 -0.921 . . . . 75.43 111.557 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.522 HG23 ' O ' ' A' ' 91' ' ' GLU . 47.3 mm -62.55 -32.12 54.29 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.407 0.622 . . . . 75.5 111.013 -176.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -57.61 -45.75 84.94 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.826 -1.079 . . . . 73.24 110.151 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . 0.486 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 10.5 m-20 -78.19 -38.42 43.37 Favored 'General case' 0 C--O 1.21 -0.974 0 CA-C-N 116.407 -0.36 . . . . 72.54 111.408 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . 0.585 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.2 tm? -50.07 -55.01 16.57 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 125.492 1.517 . . . . 74.22 110.552 -178.698 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . 0.459 ' SG ' ' HG3' ' A' ' 91' ' ' GLU . 51.3 m -67.83 -32.68 73.39 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.893 -0.594 . . . . 73.44 111.701 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -70.73 -51.51 26.82 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.61 -0.723 . . . . 73.32 111.163 -177.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 13.4 mt-10 -79.23 -17.43 54.8 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 112.98 0.733 . . . . 64.2 112.98 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.4 11.11 22.54 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.168 0.509 . . . . 73.04 111.431 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 69.62 -59.71 0.49 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.142 1.534 . . . . 73.45 115.142 172.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.1 m -70.29 132.53 87.87 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 112.343 0.497 . . . . 75.0 112.343 -175.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -68.11 109.4 1.95 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.468 2.112 . . . . 71.24 109.252 175.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.5 mt -79.75 -44.17 21.21 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 116.503 -0.317 . . . . 74.34 111.435 -174.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 26.0 t0 71.18 161.99 0.24 Allowed 'General case' 0 C--O 1.243 0.76 0 C-N-CA 125.259 1.424 . . . . 74.43 109.945 -175.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 65.86 23.22 11.36 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.572 -0.529 . . . . 60.22 109.572 -171.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.619 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 33.4 tt0 -56.28 -37.75 70.25 Favored 'General case' 0 C--O 1.21 -0.992 0 C-N-CA 125.641 1.576 . . . . 73.13 111.359 -177.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.532 HD13 ' SD ' ' A' ' 6' ' ' MET . 38.5 mm -72.16 -48.78 10.18 Favored Pre-proline 0 C--N 1.274 -2.705 0 O-C-N 120.983 -1.073 . . . . 75.53 109.996 178.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . 0.465 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 68.1 Cg_exo -51.35 -29.9 32.19 Favored 'Trans proline' 0 CA--C 1.563 1.928 0 C-N-CA 121.311 1.341 . . . . 75.31 111.844 166.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 9.2 mp -59.63 -36.5 76.47 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.835 -0.432 . . . . 62.25 109.835 171.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.63 HG23 ' CB ' ' A' ' 74' ' ' LYS . 3.7 p -85.88 -41.63 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-O 122.375 1.083 . . . . 71.2 113.246 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.2 m -71.4 7.17 1.45 Allowed 'General case' 0 C--N 1.246 -3.904 0 C-N-CA 125.189 1.396 . . . . 73.15 113.845 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 15.1 tt -73.34 -17.9 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 N-CA-C 114.193 1.183 . . . . 75.5 114.193 -172.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 96.0 m95 . . . . . 0 C--N 1.315 -0.915 0 N-CA-C 114.738 1.385 . . . . 74.4 114.738 -174.13 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.5 ttt . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 122.005 0.907 . . . . 72.41 109.698 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -91.29 25.83 2.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.267 -0.879 . . . . 71.43 109.926 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.7 -10.35 59.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.937 -1.029 . . . . 55.3 108.882 173.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . 0.613 ' OE2' ' HE2' ' A' ' 74' ' ' LYS . 6.1 pt-20 -58.64 -38.68 78.62 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.241 -0.891 . . . . 74.4 109.697 175.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 50.0 m -57.78 -26.73 62.33 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.226 1.41 . . . . 71.44 111.165 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.1 mp -88.04 -27.59 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.471 -1.241 . . . . 74.21 110.66 -176.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -82.55 -66.82 0.84 Allowed 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.793 1.034 . . . . 73.11 113.793 -172.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 43.99 -172.19 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.508 1.67 . . . . 75.41 115.508 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.9 t30 40.19 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 126.679 1.992 . . . . 74.4 115.843 171.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -179.48 108.24 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.57 0.7 . . . . 75.24 110.356 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -71.98 -28.42 63.4 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 124.636 1.174 . . . . 73.11 112.526 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -58.6 -27.6 64.8 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.782 0.66 . . . . 74.04 112.782 -174.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.413 ' HB2' HD12 ' A' ' 97' ' ' ILE . 3.1 mm? -64.32 -36.3 83.68 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 121.099 -0.24 . . . . 73.44 110.519 176.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TRP . . . . . 0.402 ' HB2' HD13 ' A' ' 97' ' ' ILE . 74.7 t-105 -69.63 -49.58 52.54 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.128 -0.487 . . . . 75.44 110.219 -176.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.27 -39.75 91.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.136 -0.484 . . . . 72.22 110.813 179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TRP . . . . . 0.451 ' HE1' ' HG ' ' A' ' 88' ' ' LEU . 13.6 t-105 -60.85 -50.32 73.89 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.202 -0.454 . . . . 74.25 110.306 176.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.428 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -57.63 -53.07 62.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 124.073 0.858 . . . . 74.43 109.418 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.1 t -58.41 -47.36 88.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.873 -0.603 . . . . 74.35 112.227 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 74.7 mtp180 -69.18 -44.42 72.22 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 112.163 0.431 . . . . 75.43 112.163 -176.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -67.57 -39.84 84.9 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.199 -0.667 . . . . 75.23 109.199 -176.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 4.7 mt -73.9 -25.1 59.83 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.165 -0.471 . . . . 75.41 112.233 177.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -67.02 -20.99 65.95 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.176 -1.046 . . . . 64.42 108.176 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 33.5 mtmt -91.79 -15.21 28.61 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.548 0.69 . . . . 74.22 109.716 177.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.445 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -129.84 51.86 8.28 Favored Pre-proline 0 C--O 1.241 0.647 0 CA-C-N 115.375 -0.829 . . . . 61.41 112.683 -175.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.445 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.8 Cg_exo -68.56 -20.66 40.88 Favored 'Trans proline' 0 C--N 1.365 1.416 0 N-CA-C 108.546 -1.367 . . . . 72.55 108.546 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -63.25 -43.21 98.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 113.187 -1.824 . . . . 75.32 109.549 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TRP . . . . . 0.45 ' HE1' ' HG3' ' A' ' 83' ' ' GLU . 67.8 t90 -76.02 -47.7 23.82 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 121.943 0.878 . . . . 71.23 110.419 176.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.488 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.3 tm? -58.89 -44.29 91.12 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.181 -1.372 . . . . 74.12 112.221 -172.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.7 p -52.76 -54.15 37.98 Favored 'General case' 0 C--N 1.316 -0.879 0 O-C-N 123.54 0.525 . . . . 73.41 111.67 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.24 -45.49 76.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.108 1.363 . . . . 72.41 111.703 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -64.6 -43.9 92.32 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 112.511 0.56 . . . . 74.52 112.511 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.579 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 77.2 mt -55.54 -39.68 70.87 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 123.382 0.426 . . . . 74.01 111.135 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -62.29 -26.23 68.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.387 0.613 . . . . 74.11 112.224 -178.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.6 t -83.52 -22.26 32.51 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.693 -0.685 . . . . 71.22 110.311 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' PHE . . . . . 0.47 ' CD1' HG23 ' A' ' 72' ' ' THR . 48.4 m-85 -98.05 -57.42 2.22 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.281 -0.418 . . . . 64.23 111.784 -178.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.543 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.4 mm? -85.34 113.19 49.14 Favored Pre-proline 0 N--CA 1.423 -1.778 0 N-CA-C 109.009 -0.737 . . . . 74.31 109.009 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.17 -33.38 72.56 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.276 2.651 . . . . 73.32 115.532 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.49 28.22 8.9 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 121.912 0.863 . . . . 73.13 112.525 -176.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.579 ' SD ' ' HB3' ' A' ' 37' ' ' LEU . 23.2 ttm -89.25 106.55 18.51 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 115.275 1.583 . . . . 75.24 115.275 -175.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -111.78 79.23 1.19 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.214 -2.143 . . . . 50.42 105.214 169.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.19 -2.0 57.96 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.145 -0.934 . . . . 74.24 111.727 -173.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -78.39 45.84 0.59 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 122.818 1.294 . . . . 73.0 112.678 -174.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -117.04 97.92 6.19 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 107.118 -1.438 . . . . 70.45 107.118 174.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.2 m -81.86 83.72 7.11 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-O 121.86 0.838 . . . . 74.12 112.053 -175.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.74 -33.55 58.11 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-O 122.529 1.157 . . . . 71.54 110.837 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -137.48 167.51 20.32 Favored Pre-proline 0 N--CA 1.384 -3.769 0 C-N-CA 126.695 1.998 . . . . 73.33 106.501 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -81.93 -148.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 122.001 1.801 . . . . 72.32 110.664 174.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.4 m -76.26 37.28 0.16 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 124.291 1.036 . . . . 75.21 111.776 -176.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -64.18 148.25 95.85 Favored Pre-proline 0 N--CA 1.44 -0.975 0 C-N-CA 123.605 0.762 . . . . 73.31 112.983 -175.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -58.31 -35.12 99.04 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 123.479 2.786 . . . . 73.05 112.68 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -72.6 -31.27 65.05 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.171 0.51 . . . . 71.4 109.96 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 94.6 t -67.8 -52.03 44.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.347 -0.983 . . . . 75.31 108.347 177.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 47.1 mm -55.06 -43.45 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 114.478 -1.237 . . . . 74.03 109.849 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -58.71 -40.53 83.98 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.133 -0.94 . . . . 72.34 111.039 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -64.81 -37.55 88.01 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.681 0.753 . . . . 75.42 110.554 178.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.441 ' O ' ' HB2' ' A' ' 64' ' ' ARG . 94.5 mt-30 -72.66 -48.68 37.29 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 114.492 -1.231 . . . . 73.4 111.525 -176.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.468 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.3 mm? -67.36 -30.61 70.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 115.269 -0.878 . . . . 75.44 110.885 -178.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -54.06 -46.08 71.86 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.658 1.183 . . . . 74.23 110.222 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ARG . . . . . 0.543 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 26.1 mmt180 -56.39 -36.65 69.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 114.626 -1.17 . . . . 65.31 112.594 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.8 mt -71.04 -31.0 67.34 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.7 0.259 . . . . 73.31 111.7 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -59.32 -35.74 74.37 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.055 -0.72 . . . . 74.2 109.055 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.82 -27.41 60.28 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 115.072 -0.967 . . . . 73.21 112.103 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -70.66 -52.7 19.47 Favored 'General case' 0 N--CA 1.423 -1.778 0 C-N-CA 120.824 -0.35 . . . . 73.32 111.36 -179.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.42 143.75 5.32 Favored Glycine 0 CA--C 1.477 -2.319 0 C-N-CA 118.835 -1.65 . . . . 61.44 114.537 -173.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.404 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.2 ptm -67.38 -30.67 70.51 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.887 -1.523 . . . . 71.2 106.887 168.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.7 -37.37 59.54 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 114.36 -1.291 . . . . 64.11 108.538 177.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' THR . . . . . 0.47 HG23 ' CD1' ' A' ' 40' ' ' PHE . 86.6 m -62.19 -38.73 90.21 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 114.912 -1.04 . . . . 71.1 111.089 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' TRP . . . . . 0.485 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 39.8 t-105 -68.25 -36.06 78.86 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.491 -0.559 . . . . 75.23 109.491 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . 0.613 ' HE2' ' OE2' ' A' ' 9' ' ' GLU . 85.5 mttt -58.17 -52.27 66.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 120.763 0.316 . . . . 74.4 110.199 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -60.34 -38.48 83.91 Favored 'General case' 0 N--CA 1.405 -2.688 0 CA-C-N 115.433 -0.803 . . . . 72.21 111.136 179.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -61.14 -50.58 72.63 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-N 115.112 -0.949 . . . . 74.51 110.798 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ILE . . . . . 0.547 HG23 ' O ' ' A' ' 91' ' ' GLU . 46.5 mm -70.15 -30.89 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.627 -0.829 . . . . 63.42 110.573 -177.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.84 -47.47 82.59 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.376 -0.829 . . . . 74.31 109.874 176.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -73.28 -37.25 66.32 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.951 -0.568 . . . . 74.32 111.239 177.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -50.45 -54.27 23.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.846 1.259 . . . . 74.31 109.449 178.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.6 m -66.71 -44.4 81.76 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.687 -0.688 . . . . 65.13 111.347 -178.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -61.62 -54.24 45.59 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.291 0.567 . . . . 65.42 111.097 -175.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . 0.45 ' HG3' ' HE1' ' A' ' 32' ' ' TRP . 22.5 mm-40 -70.21 -40.62 74.43 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.173 -0.921 . . . . 74.41 113.485 -175.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.6 mt -80.32 -39.8 27.98 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 120.011 -0.676 . . . . 65.31 112.63 -174.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -169.2 -96.62 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.03 0.377 . . . . 65.13 110.821 179.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . 0.446 ' O ' HD12 ' A' ' 88' ' ' LEU . 34.8 m -141.04 173.28 5.04 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 104.945 -2.243 . . . . 64.12 104.945 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . 0.44 ' HD2' ' HB ' ' A' ' 86' ' ' VAL . 5.6 Cg_endo -50.89 105.48 0.1 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 121.859 1.706 . . . . 71.21 110.3 171.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LEU . . . . . 0.495 HD22 ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -50.39 -53.3 30.28 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 125.314 1.446 . . . . 74.32 111.227 -172.446 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -154.2 48.81 0.62 Allowed 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 104.344 -2.465 . . . . 61.51 104.344 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' MET . . . . . 0.503 ' O ' HD22 ' A' ' 94' ' ' LEU . 65.7 mtt 74.31 146.14 0.08 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.655 -2.066 . . . . 71.34 109.84 -170.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLU . . . . . 0.547 ' O ' HG23 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -71.73 -35.18 70.08 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.273 1.035 . . . . 73.53 110.817 178.107 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.534 ' HA ' HG11 ' A' ' 95' ' ' VAL . 31.3 mm -59.42 -49.8 90.58 Favored Pre-proline 0 C--N 1.279 -2.487 0 CA-C-N 114.353 -1.294 . . . . 74.33 114.043 -172.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -54.85 -35.46 88.78 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.211 1.941 . . . . 74.51 111.259 174.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LEU . . . . . 0.503 HD22 ' O ' ' A' ' 90' ' ' MET . 4.0 mm? -71.42 -33.6 69.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.845 -1.07 . . . . 73.12 110.916 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' VAL . . . . . 0.534 HG11 ' HA ' ' A' ' 92' ' ' ILE . 4.3 p -83.59 -33.63 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 C-N-CA 119.355 -0.938 . . . . 71.24 112.3 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.3 t -55.71 -26.39 44.98 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 113.768 -1.56 . . . . 64.41 112.068 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 94' ' ' LEU . 12.0 tt -69.02 -30.38 46.45 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.096 0 CA-C-N 116.505 -0.316 . . . . 75.51 110.59 -177.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 16.7 t90 . . . . . 0 C--O 1.244 0.812 0 C-N-CA 127.265 2.226 . . . . 74.14 116.019 -177.172 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.513 0 N-CA-C 111.002 -0.839 . . . . 74.44 111.002 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.67 126.91 12.52 Favored 'Trans proline' 0 C--O 1.237 0.436 0 C-N-CA 122.909 2.406 . . . . 64.44 110.541 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 81.7 mt -115.27 123.18 48.12 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 109.611 -0.514 . . . . 75.33 109.611 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.73 -42.65 61.48 Favored Glycine 0 N--CA 1.44 -1.044 0 N-CA-C 109.891 -1.283 . . . . 63.31 109.891 177.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.8 p -119.84 177.56 4.92 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 108.548 -0.908 . . . . 73.4 108.548 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 42.8 tpp -115.33 9.77 15.72 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 122.065 0.936 . . . . 73.2 108.98 -178.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -74.8 24.85 0.09 Allowed 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 114.338 1.236 . . . . 75.41 114.338 -174.511 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.417 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.2 -15.1 59.63 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 122.411 1.1 . . . . 63.41 109.588 178.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.437 ' CB ' ' HB2' ' A' ' 96' ' ' SER . 1.1 pt-20 -65.35 -41.71 93.57 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 113.808 -1.542 . . . . 75.03 111.52 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.2 m -74.89 -17.23 60.61 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.448 -0.797 . . . . 70.43 109.857 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.417 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.9 mm -87.48 -50.67 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-O 122.138 0.971 . . . . 72.35 108.887 -176.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.3 mmt180 -84.72 6.7 23.2 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.911 -1.495 . . . . 72.13 113.148 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -44.14 122.53 2.96 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 124.902 1.281 . . . . 71.55 112.798 -177.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -162.86 150.73 13.73 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 104.559 -2.385 . . . . 71.32 104.559 176.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . 0.28 21.8 p30 -145.72 -44.5 0.21 Allowed 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 115.562 1.69 . . . . 73.24 115.562 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.52 -46.32 90.47 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 119.201 0.91 . . . . 71.32 111.833 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -67.29 -44.23 79.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.985 -0.552 . . . . 74.03 109.832 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 89.5 mt -66.07 -39.54 90.16 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.375 -0.829 . . . . 74.35 111.58 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 73.0 t-105 -65.42 -43.84 89.29 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 110.274 -0.269 . . . . 75.35 110.274 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.98 -44.36 96.25 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 120.863 0.363 . . . . 72.34 110.666 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 17.9 t-105 -60.45 -48.59 81.1 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.587 -0.733 . . . . 75.31 110.583 175.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.416 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 33.9 tp -58.4 -53.04 62.81 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.675 -0.693 . . . . 73.4 109.862 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -53.85 -46.09 63.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 123.528 0.731 . . . . 71.41 112.441 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.481 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 3.9 mmp_? -72.4 -43.39 63.97 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 120.18 -0.608 . . . . 72.53 112.396 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -68.21 -42.34 80.0 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.047 0.451 . . . . 74.43 109.81 -176.59 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.468 HD13 HD22 ' A' ' 33' ' ' LEU . 1.2 mt -68.56 -25.75 65.06 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 122.854 0.461 . . . . 72.42 110.936 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.4 t -71.56 -18.53 62.24 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 108.99 -0.744 . . . . 75.32 108.99 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.481 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.32 -2.29 52.44 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 121.725 0.774 . . . . 74.44 109.489 178.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.438 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.4 m-80 -137.92 50.21 3.11 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.165 -0.925 . . . . 73.11 111.78 -177.277 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.438 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.2 Cg_exo -65.62 -23.98 56.13 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 121.604 1.536 . . . . 65.2 109.197 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -66.1 -39.58 90.09 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 112.997 -1.911 . . . . 71.33 111.095 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.499 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 84.4 t90 -76.06 -44.73 37.64 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.492 -1.299 . . . . 75.24 107.492 -175.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.641 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 3.5 mm? -53.4 -56.96 12.51 Favored 'General case' 0 N--CA 1.407 -2.601 0 CA-C-N 113.015 -1.902 . . . . 74.33 113.61 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.461 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 3.4 p -53.74 -44.64 70.11 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.927 0.767 . . . . 63.31 111.133 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.92 72.23 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.673 1.589 . . . . 70.13 111.22 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.499 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.1 mmmt -69.28 -35.79 76.41 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-N 115.956 -0.565 . . . . 74.31 111.691 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.641 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 97.2 mt -60.61 -30.97 70.18 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 123.09 0.244 . . . . 71.34 110.817 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.461 ' HG3' ' O ' ' A' ' 34' ' ' SER . 10.3 mtp180 -66.85 -26.75 67.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.328 0.585 . . . . 73.55 111.906 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -78.4 -38.01 42.65 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.716 -0.674 . . . . 74.52 109.434 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.493 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 86.5 m-85 -80.31 -59.47 2.69 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.676 -0.693 . . . . 75.1 111.404 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.491 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.1 mm? -89.33 110.89 42.04 Favored Pre-proline 0 N--CA 1.432 -1.35 0 N-CA-C 109.269 -0.641 . . . . 75.24 109.269 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -70.85 -19.65 30.64 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.218 1.945 . . . . 73.23 111.851 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 p -114.13 28.58 8.65 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.086 -0.961 . . . . 72.21 109.935 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.851 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -43.33 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.941 1.4 . . . . 75.23 112.351 -175.432 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.09 60.06 4.71 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-O 123.088 1.423 . . . . 71.24 108.368 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.851 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.4 pp -81.03 -9.78 59.79 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.23 -1.805 . . . . 71.44 110.799 -176.234 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.25 -14.16 60.14 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.743 -1.117 . . . . 74.23 110.218 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.4 t -85.87 103.79 14.94 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 115.348 -0.842 . . . . 74.5 108.861 178.469 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.1 t -142.13 81.56 1.76 Allowed 'General case' 0 N--CA 1.428 -1.563 0 N-CA-C 107.878 -1.156 . . . . 74.25 107.878 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -39.58 94.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.84 -1.073 . . . . 73.22 111.743 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.25 155.85 53.26 Favored Pre-proline 0 N--CA 1.383 -3.819 0 CA-C-N 113.346 -1.752 . . . . 74.31 106.918 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.418 ' HB2' ' H ' ' A' ' 53' ' ' SER . 32.4 Cg_endo -64.16 -145.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.558 1.677 0 C-N-CA 124.013 3.142 . . . . 53.21 112.164 174.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.418 ' H ' ' HB2' ' A' ' 52' ' ' PRO . 25.0 m -74.73 38.37 0.12 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 123.864 0.866 . . . . 63.13 113.28 -175.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -62.08 149.52 86.18 Favored Pre-proline 0 N--CA 1.435 -1.196 0 C-N-CA 124.417 1.087 . . . . 74.23 110.544 177.565 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.45 -46.83 24.85 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 123.613 2.876 . . . . 73.21 113.703 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -74.34 -23.77 59.08 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.866 0.691 . . . . 74.22 112.866 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.436 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 87.0 t -72.7 -39.51 60.39 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 N-CA-C 108.289 -1.004 . . . . 75.23 108.289 177.257 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.11 -48.01 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 108.136 -1.061 . . . . 72.14 108.136 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 23.5 t-160 -52.03 -43.12 63.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.93 0.892 . . . . 74.33 110.708 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 65.2 ttt-85 -54.73 -41.37 70.29 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.084 0.953 . . . . 74.23 111.897 178.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.436 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.8 mt-30 -73.31 -39.45 65.3 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 115.225 -0.898 . . . . 71.24 110.509 -175.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -75.29 -31.09 60.59 Favored 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 114.603 -1.18 . . . . 74.12 110.883 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -53.89 -47.03 71.52 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.691 1.196 . . . . 73.22 110.602 175.313 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.491 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 32.2 mmt-85 -53.84 -36.62 62.76 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 113.659 -1.61 . . . . 74.21 111.888 178.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.3 mt -72.05 -36.68 69.67 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.95 0.405 . . . . 63.43 111.051 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.43 -25.21 66.64 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.392 -0.822 . . . . 75.3 109.086 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -31.27 59.91 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.431 -0.804 . . . . 72.15 110.832 176.271 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.28 -57.17 5.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-O 121.436 0.636 . . . . 74.33 109.869 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -172.55 141.66 6.37 Favored Glycine 0 CA--C 1.466 -2.987 0 CA-C-N 115.122 -0.944 . . . . 73.22 111.387 -174.143 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 1.9 mpt? -70.45 -30.67 67.57 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.318 -1.734 . . . . 74.4 106.318 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.93 -29.01 58.19 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 113.437 -1.71 . . . . 74.41 108.11 176.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.3 m -70.47 -34.03 71.94 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.241 -0.89 . . . . 74.51 109.421 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.547 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 69.7 t-105 -63.67 -46.89 83.51 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.198 -0.668 . . . . 73.11 109.198 175.182 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 70' ' ' MET . 82.8 mttt -58.56 -36.0 73.24 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 115.968 -0.56 . . . . 75.32 111.521 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.418 ' O ' ' HB3' ' A' ' 78' ' ' ASN . 49.0 m -72.7 -47.22 48.97 Favored 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 123.147 0.579 . . . . 73.33 110.953 177.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.493 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 81.4 t80 -55.79 -50.44 70.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 123.328 0.651 . . . . 74.05 111.73 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.474 HG22 ' HB2' ' A' ' 94' ' ' LEU . 41.0 mm -62.87 -30.75 50.26 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.944 -0.571 . . . . 72.15 111.19 -176.709 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.418 ' HB3' ' O ' ' A' ' 75' ' ' SER . 3.6 t-20 -58.86 -46.51 87.58 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 109.422 -0.584 . . . . 72.13 109.422 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -73.16 -39.65 65.48 Favored 'General case' 0 C--O 1.198 -1.646 0 CA-C-N 115.487 -0.778 . . . . 70.32 110.445 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.434 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.3 tm? -50.33 -53.87 25.72 Favored 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 124.776 1.23 . . . . 74.51 109.249 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.98 -36.53 84.69 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.893 -0.594 . . . . 72.23 111.266 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -73.36 -54.2 8.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.98 0.419 . . . . 64.33 111.658 -176.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -74.98 -24.02 58.37 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.641 -0.709 . . . . 73.54 112.298 -172.01 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 85.4 mt -91.22 4.51 52.1 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.31 -0.556 . . . . 74.2 112.014 179.204 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 72.12 -46.84 0.65 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 114.221 1.193 . . . . 50.05 114.221 174.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 47.3 t -56.88 126.68 73.04 Favored Pre-proline 0 C--N 1.315 -0.909 0 C-N-CA 124.488 1.115 . . . . 73.42 112.864 -175.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo -86.75 102.09 0.58 Allowed 'Trans proline' 0 N--CA 1.44 -1.64 0 C-N-CA 122.466 2.111 . . . . 63.25 110.426 173.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 mp -69.81 -53.15 19.55 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.211 -0.449 . . . . 72.21 109.84 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.1 t70 173.96 -50.77 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.557 1.143 . . . . 63.4 107.968 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.9 ttt -177.47 153.12 0.88 Allowed 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 104.89 -2.263 . . . . 65.13 104.89 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.538 ' O ' HG11 ' A' ' 95' ' ' VAL . 1.1 pm0 -71.46 -42.37 68.23 Favored 'General case' 0 C--O 1.206 -1.216 0 CA-C-N 118.696 0.68 . . . . 73.32 112.342 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.625 ' O ' HG22 ' A' ' 95' ' ' VAL . 35.1 mm -54.23 -39.39 74.22 Favored Pre-proline 0 CA--C 1.594 2.66 0 C-N-CA 125.486 1.514 . . . . 74.3 114.118 -175.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -52.3 -41.8 64.12 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 122.126 1.884 . . . . 72.14 111.035 170.503 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.474 ' HB2' HG22 ' A' ' 77' ' ' ILE . 3.7 mm? -76.29 -25.03 54.45 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.756 -1.111 . . . . 75.22 110.128 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.625 HG22 ' O ' ' A' ' 92' ' ' ILE . 4.6 m -74.62 -29.02 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-O 122.43 1.11 . . . . 74.42 110.789 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.437 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . 6.0 t -81.76 1.18 35.73 Favored 'General case' 0 C--N 1.275 -2.631 0 CA-C-N 113.846 -1.524 . . . . 64.52 111.476 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 18.2 tt -57.38 -30.84 36.77 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 N-CA-C 112.981 0.734 . . . . 73.43 112.981 -173.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 24.5 p-90 -92.97 13.71 19.84 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.362 0.504 . . . . 74.31 112.362 -177.697 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -80.99 -127.84 0.82 Allowed Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 121.19 -0.529 . . . . 62.41 112.32 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.78 130.28 33.45 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 123.434 2.756 . . . . 70.22 112.527 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . 0.297 1.5 ptm180 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 125.754 1.622 . . . . 73.13 113.462 -177.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.401 ' O ' ' HG ' ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.486 -1.759 0 N-CA-C 108.109 -1.997 . . . . 15.03 108.109 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -56.22 99.35 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.952 2.435 . . . . 74.41 113.95 -174.777 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 1' ' ' GLY . 89.0 mt -115.64 -73.59 0.64 Allowed 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 108.003 -1.11 . . . . 75.05 108.003 178.248 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.74 -56.3 4.76 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 115.922 -0.581 . . . . 74.21 111.925 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.1 m -56.27 129.14 39.09 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 124.165 0.986 . . . . 75.02 110.625 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 64.9 mtt -75.54 -6.93 52.71 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 112.227 0.455 . . . . 74.34 112.227 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -104.24 23.5 12.99 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 120.919 0.39 . . . . 72.43 110.08 174.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.433 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.95 -17.58 57.04 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.812 1.292 . . . . 73.22 108.857 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.419 ' HB2' ' HB2' ' A' ' 96' ' ' SER . 0.8 OUTLIER -59.17 -45.65 90.44 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 113.178 -1.828 . . . . 74.51 114.088 -177.745 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 65.0 m -76.22 -16.49 59.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.311 0.577 . . . . 73.31 110.663 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.433 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.0 mm -82.47 -44.26 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 121.937 0.875 . . . . 65.14 108.938 -176.214 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -102.19 7.27 40.92 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.678 -1.146 . . . . 75.54 111.984 -175.287 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -35.21 122.31 0.58 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 126.279 1.831 . . . . 61.42 115.028 -172.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -145.2 151.6 38.67 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.479 -2.786 . . . . 74.22 103.479 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -128.7 -72.58 0.6 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 118.636 0.653 . . . . 72.43 112.244 -174.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.2 -38.21 90.26 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.32 0.859 . . . . 73.41 113.32 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -66.29 -37.84 86.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-O 121.886 0.85 . . . . 74.53 110.542 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 86.4 mt -75.32 -40.79 58.09 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.639 -1.164 . . . . 73.51 110.238 -178.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 44.5 t-105 -64.39 -42.07 96.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 75.4 110.49 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.88 93.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.355 -0.384 . . . . 74.42 110.689 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -60.89 -50.55 72.95 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.685 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.82 -53.04 62.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.505 -0.77 . . . . 74.23 109.287 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.32 -42.4 95.29 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 115.583 -0.735 . . . . 72.12 112.774 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.436 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 20.4 tpt180 -72.62 -41.68 65.28 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 121.93 -0.482 . . . . 74.21 111.411 -177.691 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.451 HD12 HD13 ' A' ' 84' ' ' LEU . 2.0 tm? -69.78 -40.89 75.78 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.601 -0.518 . . . . 74.42 109.601 -176.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.9 mt -69.36 -25.13 64.03 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 112.398 0.518 . . . . 74.32 112.398 176.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -67.58 -19.67 65.28 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.677 -0.86 . . . . 74.1 108.677 175.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.436 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 35.3 mtmt -99.03 -2.1 38.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.635 -0.712 . . . . 65.24 109.491 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.42 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.2 m-80 -145.49 52.85 1.7 Allowed Pre-proline 0 C--O 1.243 0.74 0 N-CA-C 112.717 0.636 . . . . 75.44 112.717 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.42 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 15.8 Cg_exo -68.16 -22.83 40.2 Favored 'Trans proline' 0 C--N 1.356 0.926 0 N-CA-C 108.864 -1.245 . . . . 74.23 108.864 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.64 -43.63 88.85 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 113.477 -1.692 . . . . 65.14 110.583 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.579 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.4 t90 -71.6 -43.18 66.71 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 108.832 -0.803 . . . . 75.44 108.832 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.618 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.6 tm? -58.28 -44.81 88.64 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 114.395 -1.275 . . . . 75.12 109.053 -176.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.444 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.0 m -60.17 -48.54 81.31 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.358 -0.383 . . . . 75.33 111.249 176.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -39.6 70.65 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.742 0.817 . . . . 74.21 111.785 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.579 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.0 mmmt -75.57 -35.95 60.51 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 121.048 -0.261 . . . . 75.53 111.217 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 66.3 mt -58.76 -30.34 67.44 Favored 'General case' 0 C--O 1.203 -1.392 0 N-CA-C 110.466 -0.198 . . . . 74.14 110.466 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.462 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 88.5 mtt180 -58.55 -26.56 63.69 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 123.259 0.35 . . . . 60.54 111.624 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.3 t -88.42 -50.15 6.49 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 109.641 -0.503 . . . . 74.14 109.641 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.453 ' CD1' HG23 ' A' ' 72' ' ' THR . 75.5 m-85 -70.05 -46.06 65.77 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.476 0.917 . . . . 74.52 113.476 -175.388 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.3 mp -87.7 113.47 54.57 Favored Pre-proline 0 C--N 1.312 -1.062 0 C-N-CA 123.993 0.917 . . . . 73.03 110.056 -178.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -61.81 -29.9 83.61 Favored 'Trans proline' 0 N--CA 1.482 0.813 0 C-N-CA 123.712 2.941 . . . . 71.14 114.155 -174.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.1 p -112.55 7.04 18.76 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.39 0.614 . . . . 61.22 110.308 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.462 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 26.5 mtt 41.7 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 127.312 2.245 . . . . 73.35 112.188 -172.799 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -98.11 59.54 1.39 Allowed 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.406 -1.331 . . . . 73.42 107.406 176.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -96.34 -11.47 25.79 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.657 -1.611 . . . . 73.33 111.78 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -80.45 37.61 0.4 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 124.436 1.094 . . . . 73.1 111.87 -175.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.6 m -91.85 -0.34 57.51 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.804 -0.635 . . . . 72.44 111.495 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 72.7 m -91.44 64.65 5.11 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.454 0.645 . . . . 73.02 112.23 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.41 -32.47 29.08 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 122.67 1.224 . . . . 73.44 109.557 173.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.447 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 44.6 mt-10 -93.76 172.8 5.4 Favored Pre-proline 0 C--N 1.264 -3.126 0 CA-C-N 112.487 -2.142 . . . . 55.53 106.574 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 39.8 Cg_endo -66.45 -169.87 0.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 121.27 1.314 . . . . 63.45 111.85 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.0 m -78.18 38.55 0.29 Allowed 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 123.488 0.715 . . . . 64.05 112.248 -175.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.466 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 96.1 m-20 -57.65 149.72 50.37 Favored Pre-proline 0 N--CA 1.438 -1.067 0 C-N-CA 123.984 0.914 . . . . 73.44 111.931 -177.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -44.79 -51.86 6.85 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 124.144 3.23 . . . . 72.33 113.011 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -73.22 -26.27 61.07 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 113.416 0.895 . . . . 64.34 113.416 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.505 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 72.2 t -65.65 -38.64 82.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 108.575 -0.898 . . . . 74.02 108.575 175.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.9 mm -70.53 -50.21 46.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 115.478 -0.783 . . . . 74.5 109.812 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -52.73 -39.99 62.64 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.241 1.017 . . . . 74.35 110.953 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -57.57 -40.62 79.35 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 125.079 1.352 . . . . 73.02 111.856 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 58.9 mt-30 -76.12 -39.46 55.1 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.657 -0.702 . . . . 75.01 110.602 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.46 -30.66 71.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 114.933 -1.031 . . . . 72.42 111.26 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.413 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 47.4 t30 -55.58 -34.37 64.74 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.834 1.254 . . . . 73.31 111.165 177.768 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -63.32 -30.16 71.34 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.644 -0.707 . . . . 75.11 111.969 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.0 mt -73.09 -31.89 64.64 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.086 0.469 . . . . 73.43 110.212 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.468 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 70.9 t80 -61.92 -29.83 70.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.294 -0.866 . . . . 73.55 109.117 177.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.21 -21.52 36.37 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 114.868 -1.06 . . . . 75.42 111.781 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -82.37 -47.18 12.62 Favored 'General case' 0 N--CA 1.419 -2.021 0 O-C-N 122.148 -0.345 . . . . 75.33 111.389 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.66 142.86 4.2 Favored Glycine 0 CA--C 1.473 -2.586 0 C-N-CA 120.275 -0.964 . . . . 62.45 112.56 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.522 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.64 -31.18 68.03 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 106.95 -1.5 . . . . 72.35 106.95 170.492 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.5 64.05 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.595 -1.184 . . . . 64.4 108.264 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.453 HG23 ' CD1' ' A' ' 40' ' ' PHE . 96.1 m -58.1 -40.61 81.6 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.084 -0.962 . . . . 64.03 110.217 176.226 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.411 ' HE1' HG22 ' A' ' 97' ' ' ILE . 65.4 t-105 -61.65 -46.89 87.85 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.97 -0.559 . . . . 73.04 109.906 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 70' ' ' MET . 34.7 mtmt -60.79 -42.79 98.25 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.549 -0.296 . . . . 75.34 111.359 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.4 m -66.06 -42.24 89.74 Favored 'General case' 0 N--CA 1.412 -2.36 0 C-N-CA 123.04 0.536 . . . . 74.24 111.128 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.428 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 79.0 t80 -61.49 -51.25 69.42 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.518 -0.765 . . . . 74.01 111.574 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.491 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 41.9 mm -61.7 -33.28 56.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.303 -0.408 . . . . 74.13 111.878 -175.895 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.57 -45.2 94.0 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.127 -0.694 . . . . 74.02 109.127 176.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.446 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 85.2 m-20 -68.1 -40.15 82.66 Favored 'General case' 0 C--O 1.195 -1.808 0 CA-C-N 115.475 -0.784 . . . . 75.54 110.704 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.491 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 1.5 tm? -50.04 -51.4 42.61 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.039 1.336 . . . . 74.41 108.894 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 72.8 m -67.39 -36.9 82.24 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.95 -1.023 . . . . 65.4 112.187 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -76.59 -40.1 50.54 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 123.398 0.679 . . . . 75.51 112.209 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.446 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 38.8 mt-10 -85.75 -29.25 24.01 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.773 1.027 . . . . 74.14 113.773 -172.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.451 HD13 HD12 ' A' ' 25' ' ' LEU . 95.8 mt -90.81 -28.26 18.33 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 113.706 1.002 . . . . 75.22 113.706 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -148.34 -169.58 3.38 Favored 'General case' 0 C--N 1.283 -2.284 0 N-CA-C 104.602 -2.37 . . . . 75.1 104.602 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.0 m -82.17 134.17 49.58 Favored Pre-proline 0 C--N 1.283 -2.284 0 N-CA-C 107.421 -1.326 . . . . 74.42 107.421 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -22.93 100.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 1 C-N-CA 126.096 4.53 . . . . 74.32 114.171 -174.619 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.8 mt -64.16 -34.26 77.66 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 115.257 -0.883 . . . . 74.33 110.48 -176.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.3 t70 58.19 37.13 26.22 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 123.126 1.441 . . . . 74.25 110.889 173.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -143.46 32.35 1.32 Allowed 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.712 -1.588 . . . . 73.21 106.712 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.579 ' O ' HG11 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -70.69 -39.76 73.3 Favored 'General case' 0 C--O 1.192 -1.938 0 CA-C-N 114.38 -1.282 . . . . 73.44 112.971 -174.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.493 ' O ' HG23 ' A' ' 95' ' ' VAL . 44.5 mm -55.74 -45.73 99.84 Favored Pre-proline 0 CA--C 1.574 1.886 0 C-N-CA 123.783 0.833 . . . . 72.15 112.107 -175.396 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -50.95 -37.53 56.53 Favored 'Trans proline' 0 CA--C 1.555 1.573 0 C-N-CA 121.921 1.747 . . . . 74.44 111.566 171.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.417 ' HB2' HG21 ' A' ' 77' ' ' ILE . 4.3 mm? -76.68 -31.69 57.43 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.838 -0.619 . . . . 73.41 110.911 176.208 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.579 HG11 ' O ' ' A' ' 91' ' ' GLU . 6.5 m -66.54 -29.47 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.301 0 CA-C-O 122.566 1.174 . . . . 73.1 110.815 -177.484 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.419 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 31.3 t -75.47 -16.23 60.34 Favored 'General case' 0 C--N 1.27 -2.88 0 CA-C-N 113.379 -1.737 . . . . 72.44 113.077 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.411 HG22 ' HE1' ' A' ' 73' ' ' TRP . 10.7 tt -72.38 -5.28 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 CA-C-O 121.362 0.601 . . . . 72.14 111.617 -172.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.468 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 47.2 t90 -51.68 -47.64 63.77 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 125.166 1.386 . . . . 71.03 110.4 -179.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -161.05 175.74 37.68 Favored Glycine 0 N--CA 1.425 -2.034 0 N-CA-C 109.528 -1.429 . . . . 73.12 109.528 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.41 101.51 1.33 Allowed 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.296 1.997 . . . . 74.23 110.543 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 . . . . . 0 N--CA 1.411 -2.408 0 N-CA-C 108.597 -0.89 . . . . 74.02 108.597 179.898 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.84 0 N-CA-C 110.777 -0.929 . . . . 64.14 110.777 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.7 108.75 1.5 Allowed 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.365 2.043 . . . . 72.51 111.332 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.9 mt 70.97 160.5 0.22 Allowed 'General case' 0 C--O 1.249 1.069 0 C-N-CA 125.32 1.448 . . . . 75.43 112.42 178.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.95 89.07 1.49 Allowed Glycine 0 CA--C 1.486 -1.763 0 N-CA-C 110.039 -1.224 . . . . 71.14 110.039 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.1 m 66.69 96.96 0.05 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.058 0.943 . . . . 62.01 108.905 -174.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.1 ttt -85.91 59.81 5.86 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 123.511 1.624 . . . . 73.11 111.067 -174.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.513 ' O ' HD12 ' A' ' 11' ' ' ILE . 10.2 m-20 -141.82 24.25 2.04 Favored 'General case' 0 C--N 1.273 -2.75 0 CA-C-N 111.596 -2.547 . . . . 63.14 106.099 173.294 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.466 ' O ' ' HG2' ' A' ' 12' ' ' ARG . . . -74.41 -34.75 63.34 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-N 113.852 -1.522 . . . . 74.1 107.641 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.407 ' HB3' HG22 ' A' ' 92' ' ' ILE . 1.7 pm0 -51.47 -45.35 62.72 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 113.68 -1.6 . . . . 74.14 112.093 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.4 m -56.62 -40.6 75.66 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.362 1.065 . . . . 71.34 111.051 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.513 HD12 ' O ' ' A' ' 7' ' ' ASP . 1.2 mp -83.92 -43.21 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.024 0 CA-C-N 113.958 -1.474 . . . . 73.22 111.022 -175.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.466 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 35.9 mmt180 -69.1 -65.52 0.7 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 116.032 1.864 . . . . 74.43 116.032 -170.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.521 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 2.5 tm? -176.45 141.1 0.39 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.114 0.87 . . . . 61.54 110.991 -172.232 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.453 ' N ' HD11 ' A' ' 13' ' ' LEU . 6.7 p30 -153.65 138.0 16.67 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 106.593 -1.632 . . . . 64.11 106.593 168.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -152.63 153.13 32.72 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.379 -0.528 . . . . 73.34 110.581 -175.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.4 -30.56 71.29 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.112 0.965 . . . . 72.32 112.073 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -65.7 -26.03 67.58 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.142 0.496 . . . . 74.14 111.692 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.81 -35.61 64.9 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.782 -0.821 . . . . 75.33 108.782 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.463 ' HB2' ' CD1' ' A' ' 97' ' ' ILE . 77.0 t-105 -65.38 -45.38 84.28 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.423 -0.808 . . . . 73.24 109.086 177.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.68 87.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 74.41 110.992 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -59.93 -50.83 72.22 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.848 0.717 . . . . 73.01 110.715 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.14 -51.43 70.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.514 -0.767 . . . . 75.41 110.075 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.2 t -60.14 -42.8 91.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.514 -0.767 . . . . 74.11 112.018 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.43 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -69.45 -45.89 67.99 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.322 -0.622 . . . . 74.11 109.322 -176.432 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -65.93 -42.32 90.24 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.534 -0.543 . . . . 74.04 109.534 -177.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.6 mt -72.5 -25.49 61.42 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 112.942 0.719 . . . . 74.01 112.942 178.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 42.6 t -68.03 -20.14 64.96 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.336 -0.987 . . . . 75.55 108.336 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.43 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.2 mtmt -92.78 -7.22 47.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.666 -0.697 . . . . 75.31 109.955 177.413 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.432 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 43.7 m-80 -136.74 54.13 8.43 Favored Pre-proline 0 C--O 1.243 0.724 0 CA-C-N 115.986 -0.552 . . . . 72.44 112.162 -174.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.432 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.4 Cg_exo -68.84 -23.71 34.95 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.309 1.339 . . . . 72.55 109.081 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.7 -44.61 95.78 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 113.93 -1.486 . . . . 75.23 109.637 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.599 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.4 t90 -74.57 -45.13 47.38 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 121.453 0.644 . . . . 74.35 109.967 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.469 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -60.21 -45.31 93.61 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.738 -1.119 . . . . 74.21 110.687 -174.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.403 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.7 m -57.39 -46.53 83.34 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 123.236 0.335 . . . . 64.25 111.19 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.94 -40.54 80.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.287 1.035 . . . . 74.35 111.573 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.599 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.6 mmmt -73.94 -29.96 62.3 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 120.822 -0.351 . . . . 75.55 111.876 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.469 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.2 mt -62.66 -30.27 71.25 Favored 'General case' 0 C--O 1.2 -1.552 0 N-CA-C 109.71 -0.478 . . . . 74.33 109.71 173.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.489 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 70.8 mtt180 -62.87 -31.13 72.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.947 0.403 . . . . 74.14 111.395 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 t -85.28 -39.04 18.17 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.34 0.591 . . . . 75.22 110.826 -179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.569 ' CD1' HG21 ' A' ' 72' ' ' THR . 65.0 m-85 -84.65 -46.45 11.49 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.175 0.806 . . . . 74.41 113.175 -176.464 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 mp -89.74 119.43 69.46 Favored Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 123.328 0.651 . . . . 74.3 110.489 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.51 -41.49 19.81 Favored 'Trans proline' 0 C--N 1.324 -0.714 0 C-N-CA 122.218 1.945 . . . . 74.14 110.872 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.0 t -86.5 -8.92 57.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.494 -0.775 . . . . 75.01 112.594 -176.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.489 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 12.4 mtt 28.75 91.5 0.01 OUTLIER 'General case' 0 C--O 1.236 0.395 0 C-N-CA 126.632 1.973 . . . . 74.02 112.89 -173.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -99.65 61.62 1.16 Allowed 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 123.263 1.506 . . . . 51.13 110.309 177.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 pp -89.19 -19.64 25.19 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 113.157 -1.838 . . . . 72.45 110.494 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.55 5.39 50.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.305 1.05 . . . . 74.35 108.809 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 41.9 t -85.7 21.8 1.77 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.965 -1.016 . . . . 72.41 109.354 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.6 m -73.14 94.04 1.89 Allowed 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 122.03 0.919 . . . . 73.23 108.899 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -20.45 62.2 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.405 -1.271 . . . . 72.34 113.149 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.513 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 37.9 mt-10 -137.04 170.39 10.89 Favored Pre-proline 0 N--CA 1.38 -3.942 0 N-CA-C 107.307 -1.368 . . . . 75.31 107.307 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.04 -151.43 0.01 OUTLIER 'Trans proline' 0 CA--C 1.562 1.894 0 C-N-CA 123.605 2.87 . . . . 72.02 112.962 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.6 p -75.33 37.18 0.13 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.004 0.922 . . . . 65.22 112.663 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.418 ' O ' ' HB ' ' A' ' 57' ' ' VAL . 78.5 m-20 -71.65 148.69 92.9 Favored Pre-proline 0 N--CA 1.431 -1.399 0 C-N-CA 123.987 0.915 . . . . 74.23 112.591 -176.45 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -59.88 -34.26 95.53 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.296 2.664 . . . . 73.34 113.132 -177.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -75.19 -23.82 57.73 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.35 0.595 . . . . 73.13 110.996 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.513 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 95.7 t -74.01 -45.26 49.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 108.047 -1.094 . . . . 54.23 108.047 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.41 ' O ' HD23 ' A' ' 62' ' ' LEU . 47.5 mm -58.67 -37.64 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 114.227 -1.351 . . . . 74.1 109.787 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -54.38 -43.74 71.66 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.712 -0.676 . . . . 74.34 111.6 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.503 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 2.0 tpp180 -54.9 -54.46 42.28 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.968 0.907 . . . . 74.41 110.791 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -59.46 -42.59 92.35 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.296 -1.32 . . . . 73.24 111.79 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.446 HD12 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -79.64 -30.85 41.45 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.418 -0.81 . . . . 71.43 111.535 -177.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.503 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 22.7 t-20 -53.42 -48.25 68.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 124.896 1.278 . . . . 71.12 110.177 174.105 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -55.07 -30.91 60.63 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 113.549 -1.66 . . . . 73.35 112.978 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.1 mt -72.16 -42.47 65.89 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 120.526 0.203 . . . . 71.44 111.283 -178.356 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.57 ' CD1' ' HB3' ' A' ' 98' ' ' TRP . 55.5 t80 -71.32 -24.95 62.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.638 0.732 . . . . 73.32 109.028 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -28.38 64.58 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.159 -0.928 . . . . 71.14 109.875 175.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 37.3 mm-40 -74.79 -56.77 4.43 Favored 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 108.217 -1.031 . . . . 71.34 108.217 173.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -168.97 145.84 9.79 Favored Glycine 0 CA--C 1.479 -2.187 0 CA-C-N 115.495 -0.775 . . . . 53.51 112.147 -175.308 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.59 ' SD ' ' HD3' ' A' ' 100' ' ' PRO . 56.7 ttp -68.8 -32.27 71.88 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 105.606 -1.998 . . . . 75.41 105.606 170.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.7 68.32 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.623 -1.626 . . . . 72.22 108.3 176.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.569 HG21 ' CD1' ' A' ' 40' ' ' PHE . 96.8 m -57.36 -40.76 78.78 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.577 -0.738 . . . . 63.23 110.167 175.472 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.456 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.5 t-105 -61.51 -50.62 71.97 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 110.35 -0.241 . . . . 72.31 110.35 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.499 ' HG3' ' O ' ' A' ' 70' ' ' MET . 80.6 mttt -55.38 -45.14 76.58 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.111 0.482 . . . . 75.34 111.151 178.308 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.2 m -66.97 -40.58 87.51 Favored 'General case' 0 N--CA 1.406 -2.658 0 C-N-CA 123.845 0.858 . . . . 74.22 111.495 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.452 ' HZ ' ' CD2' ' A' ' 33' ' ' LEU . 81.9 t80 -61.26 -47.77 84.51 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.876 -0.602 . . . . 75.44 110.903 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.406 HG12 ' O ' ' A' ' 73' ' ' TRP . 49.6 mm -62.7 -33.47 60.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 CA-C-O 121.311 0.577 . . . . 73.43 110.055 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.41 -39.27 94.06 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.376 -0.829 . . . . 64.11 109.184 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -75.33 -42.97 53.14 Favored 'General case' 0 C--O 1.194 -1.817 0 N-CA-C 110.252 -0.277 . . . . 74.34 110.252 178.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -49.86 -53.97 22.39 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 125.495 1.518 . . . . 72.33 109.212 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.464 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 52.7 t -63.31 -35.7 81.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.456 -0.793 . . . . 75.44 111.321 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -76.2 -54.6 6.56 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.183 0.516 . . . . 73.34 111.335 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -71.05 -39.31 72.33 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.539 -0.755 . . . . 73.54 112.627 -172.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 96.4 mt -82.58 -8.4 59.61 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.397 -0.521 . . . . 73.15 109.912 179.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 t70 49.86 68.66 0.71 Allowed 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 125.503 1.521 . . . . 73.12 112.86 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.31 116.86 10.32 Favored Pre-proline 0 C--N 1.296 -1.754 0 N-CA-C 105.967 -1.864 . . . . 73.31 105.967 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -69.49 103.74 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 121.768 1.645 . . . . 75.31 109.638 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.464 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 44.1 mt -81.18 -46.98 14.05 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 120.715 -0.394 . . . . 74.22 110.815 -175.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t70 70.13 -45.14 0.58 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 124.756 1.223 . . . . 74.41 110.961 -173.174 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.419 ' H ' ' C ' ' A' ' 88' ' ' LEU . 25.7 mmt -87.95 40.38 0.94 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 124.453 1.101 . . . . 71.14 110.096 178.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.623 ' O ' HG11 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -69.19 -46.32 67.74 Favored 'General case' 0 C--O 1.191 -2.006 0 C-N-CA 120.437 -0.505 . . . . 75.12 111.356 -177.144 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.538 ' O ' HG21 ' A' ' 95' ' ' VAL . 33.2 mm -64.49 -43.37 71.2 Favored Pre-proline 0 CA--C 1.567 1.6 0 C-N-CA 124.202 1.001 . . . . 74.33 109.632 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.521 ' HA ' ' O ' ' A' ' 13' ' ' LEU . 65.0 Cg_exo -50.22 -37.16 48.66 Favored 'Trans proline' 0 CA--C 1.565 2.03 0 C-N-CA 121.346 1.364 . . . . 74.11 112.167 167.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.417 ' O ' HG22 ' A' ' 97' ' ' ILE . 3.8 mm? -70.82 -40.46 72.46 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.589 -0.278 . . . . 72.23 110.479 173.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.623 HG11 ' O ' ' A' ' 91' ' ' GLU . 4.4 m -65.1 -33.93 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 CA-C-O 122.629 1.204 . . . . 75.04 110.562 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 23.0 t -64.27 -19.8 65.64 Favored 'General case' 0 C--N 1.28 -2.417 0 CA-C-N 113.467 -1.697 . . . . 65.21 112.701 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.463 ' CD1' ' HB2' ' A' ' 19' ' ' TRP . 13.5 tt -68.24 -26.78 34.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 C-N-CA 120.169 -0.612 . . . . 72.02 111.043 -174.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.57 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . 57.5 m95 -118.84 90.14 3.27 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-O 121.796 0.808 . . . . 75.2 110.854 175.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -157.06 -164.16 13.29 Favored Glycine 0 N--CA 1.421 -2.323 0 N-CA-C 109.764 -1.334 . . . . 65.43 109.764 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.59 ' HD3' ' SD ' ' A' ' 70' ' ' MET . 2.9 Cg_endo -82.37 36.78 0.63 Allowed 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.642 2.895 . . . . 65.52 112.92 -178.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . 0.282 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.771 0 C-N-CA 125.172 1.389 . . . . 73.15 114.554 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.697 0 N-CA-C 110.623 -0.991 . . . . 71.23 110.623 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.16 119.34 6.33 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.484 2.123 . . . . 75.41 111.164 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.2 tp -95.37 112.35 24.08 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 120.925 0.393 . . . . 71.32 109.995 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -140.21 168.85 24.98 Favored Glycine 0 N--CA 1.427 -1.942 0 N-CA-C 110.466 -1.054 . . . . 71.13 110.466 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.0 m 64.29 97.48 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.257 1.023 . . . . 64.15 112.069 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.8 tpp -76.71 -10.87 59.69 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-O 122.021 0.915 . . . . 75.21 110.326 -177.35 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -110.99 24.81 12.47 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.034 -0.985 . . . . 73.41 110.203 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -75.79 -12.7 60.23 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.772 1.272 . . . . 73.02 109.128 175.627 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.35 71.42 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 113.191 -1.822 . . . . 72.42 112.347 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 60.0 m -59.29 -47.46 85.3 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 122.464 1.126 . . . . 74.53 110.184 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.511 HD11 ' H ' ' A' ' 11' ' ' ILE . 4.2 mp -72.84 -42.08 61.02 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.237 0 CA-C-N 114.177 -1.374 . . . . 74.54 112.426 -175.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.412 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 29.2 mmt180 -76.69 -34.07 58.21 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.123 0.416 . . . . 73.43 112.123 -178.508 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 12' ' ' ARG . 40.2 mt 67.05 171.72 0.26 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.975 1.31 . . . . 72.5 113.595 -175.505 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -89.23 170.19 10.81 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.568 -0.742 . . . . 73.11 110.079 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.406 ' OD1' ' HB2' ' A' ' 17' ' ' ASN . 22.0 t-20 -159.26 133.59 7.75 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.082 -0.34 . . . . 74.52 110.082 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.49 -32.68 71.71 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.028 0.751 . . . . 74.11 113.028 -176.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . 0.406 ' HB2' ' OD1' ' A' ' 15' ' ' ASN . 16.2 m120 -64.05 -35.45 80.77 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.499 -0.556 . . . . 75.23 109.499 177.84 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.71 -36.12 81.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 74.23 110.226 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -65.45 -45.51 83.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 73.34 110.089 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.66 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 74.4 110.329 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -56.96 -50.18 73.42 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.674 -0.694 . . . . 73.24 110.2 174.422 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -53.15 61.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 124.191 0.932 . . . . 73.21 109.307 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.4 t -55.57 -51.61 56.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 111.922 0.341 . . . . 64.21 111.922 -178.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -71.97 -34.18 68.74 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 112.483 0.549 . . . . 75.23 112.483 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -73.79 -46.47 45.27 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.048 -1.093 . . . . 54.1 108.048 -176.237 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.468 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -65.95 -25.18 67.0 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 123.905 0.882 . . . . 75.13 110.439 -179.207 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.1 m -64.2 -17.61 63.71 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.224 0.535 . . . . 72.24 110.246 174.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.442 ' C ' ' HD3' ' A' ' 30' ' ' PRO . 30.1 mtmt -100.78 0.97 39.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.227 -0.657 . . . . 75.51 109.227 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.468 ' OD1' ' HA ' ' A' ' 26' ' ' LEU . 5.2 m120 -125.19 45.75 1.47 Allowed Pre-proline 0 CA--C 1.547 0.855 0 CA-C-N 115.629 -0.714 . . . . 70.32 110.315 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.446 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 2.8 Cg_endo -71.3 -20.61 27.71 Favored 'Trans proline' 0 C--N 1.355 0.89 0 CA-C-N 121.321 1.508 . . . . 73.32 110.484 -173.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -75.83 -42.53 49.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.264 -1.335 . . . . 74.52 109.247 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.588 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.8 t90 -75.96 -47.75 23.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.735 -0.666 . . . . 72.33 111.1 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -56.71 -49.23 75.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.81 -1.087 . . . . 74.51 111.064 -173.61 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.588 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.5 p -54.44 -49.11 70.79 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 123.56 0.537 . . . . 75.22 111.522 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.47 -45.88 66.3 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.837 1.255 . . . . 73.11 112.501 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.588 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.8 mmmt -71.1 -30.25 66.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.567 0.222 . . . . 72.44 110.595 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 87.4 mt -66.91 -35.62 80.41 Favored 'General case' 0 C--O 1.202 -1.437 0 N-CA-C 109.776 -0.453 . . . . 65.31 109.776 174.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.588 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -60.45 -33.77 73.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.977 0.894 . . . . 64.14 109.825 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 59.6 m -74.32 -50.69 17.77 Favored 'General case' 0 N--CA 1.394 -3.267 0 C-N-CA 125.222 1.409 . . . . 72.53 112.626 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.562 ' CD1' HG22 ' A' ' 72' ' ' THR . 51.9 m-85 -78.43 -44.78 23.87 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.604 0.964 . . . . 71.42 113.604 -177.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.406 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 7.9 mp -85.69 129.03 56.34 Favored Pre-proline 0 C--N 1.301 -1.518 0 C-N-CA 123.578 0.751 . . . . 75.44 112.157 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 10.0 Cg_endo -93.18 -16.15 0.83 Allowed 'Trans proline' 0 CA--C 1.556 1.606 0 C-N-CA 122.372 2.048 . . . . 74.34 110.874 169.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.8 p -114.4 28.61 8.62 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 124.307 1.043 . . . . 64.41 111.535 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.4 mpp? -37.66 110.0 0.11 Allowed 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 126.238 1.815 . . . . 71.41 114.181 -173.498 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -113.31 56.56 0.69 Allowed 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.791 -1.559 . . . . 75.45 106.791 170.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 pp -95.07 -15.96 23.03 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.576 -1.647 . . . . 75.11 110.846 -174.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -85.91 -2.22 58.05 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 122.003 0.906 . . . . 73.11 109.795 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.7 m -81.51 39.25 0.53 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 115.2 -0.909 . . . . 72.02 111.481 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.1 t -87.69 76.81 8.78 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-O 121.901 0.858 . . . . 73.42 108.822 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 122.732 1.253 . . . . 74.23 110.933 176.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -113.53 160.62 30.97 Favored Pre-proline 1 N--CA 1.379 -4.019 0 N-CA-C 105.478 -2.045 . . . . 64.34 105.478 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -69.22 -141.48 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 122.803 2.335 . . . . 54.43 112.353 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -75.78 38.36 0.16 Allowed 'General case' 0 C--N 1.296 -1.721 0 C-N-CA 123.999 0.92 . . . . 74.15 112.88 -175.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.452 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 6.3 m-20 -60.03 143.52 87.98 Favored Pre-proline 0 N--CA 1.427 -1.594 0 C-N-CA 123.997 0.919 . . . . 74.13 109.52 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.08 -40.92 79.57 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.339 2.693 . . . . 75.24 113.704 -175.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.86 -30.28 61.3 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.32 -0.237 . . . . 74.24 110.948 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.469 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 84.0 t -66.46 -44.86 90.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 N-CA-C 108.249 -1.019 . . . . 72.44 108.249 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.45 -49.09 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 114.564 -1.198 . . . . 74.52 109.385 176.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.0 t-160 -56.24 -35.4 67.34 Favored 'General case' 0 C--O 1.206 -1.214 0 CA-C-N 116.281 -0.418 . . . . 75.53 111.123 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.471 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.5 ttt180 -58.93 -44.33 91.31 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.557 0.694 . . . . 74.34 111.206 176.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.469 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 59.0 mt-30 -72.21 -38.42 69.0 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.211 -0.904 . . . . 74.42 110.142 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -72.05 -30.18 64.9 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.891 -1.049 . . . . 72.54 110.439 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.544 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 9.2 t30 -61.64 -32.58 72.74 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 124.648 1.179 . . . . 73.42 109.398 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -67.52 -33.36 74.92 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 115.154 -0.93 . . . . 74.33 111.899 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -72.29 -37.93 68.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 109.11 -0.7 . . . . 64.33 109.11 176.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.544 ' HB3' ' O ' ' A' ' 63' ' ' ASN . 34.9 t80 -52.88 -43.92 66.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.483 -1.235 . . . . 74.0 108.415 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.81 -16.7 60.69 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.975 -1.012 . . . . 73.23 113.345 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 39.0 mm-40 -82.98 -44.3 15.42 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 118.671 0.668 . . . . 64.03 110.571 177.647 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 173.03 143.13 4.08 Favored Glycine 0 CA--C 1.475 -2.433 0 C-N-CA 120.019 -1.086 . . . . 73.32 112.678 -175.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.549 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.4 ptt? -70.47 -27.27 64.1 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 106.684 -1.599 . . . . 75.23 106.684 170.425 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.85 -34.36 57.85 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.391 -1.277 . . . . 75.5 108.16 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.562 HG22 ' CD1' ' A' ' 40' ' ' PHE . 93.3 m -63.6 -36.12 82.76 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.387 -0.824 . . . . 73.45 109.41 174.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -63.12 -50.88 68.72 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.636 -0.505 . . . . 75.11 109.636 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.549 ' HG3' ' O ' ' A' ' 70' ' ' MET . 84.3 mttt -54.75 -42.23 71.4 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.839 -0.619 . . . . 73.2 111.294 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -65.31 -47.68 75.73 Favored 'General case' 0 N--CA 1.411 -2.398 0 C-N-CA 123.256 0.622 . . . . 74.22 111.142 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -59.34 -51.08 71.46 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.332 -0.849 . . . . 75.0 111.104 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.2 mm -64.79 -36.91 78.81 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 O-C-N 123.411 0.444 . . . . 73.3 110.842 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -58.55 -46.31 87.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.05 -0.523 . . . . 74.03 110.083 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.507 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 72.1 m-20 -72.14 -39.33 68.86 Favored 'General case' 0 C--O 1.185 -2.306 0 C-N-CA 120.795 -0.362 . . . . 70.55 110.94 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -49.79 -54.2 20.64 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.963 1.305 . . . . 73.23 110.535 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.411 ' SG ' HD11 ' A' ' 88' ' ' LEU . 59.1 m -63.18 -32.26 73.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.073 -0.967 . . . . 72.11 111.246 -179.266 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -76.2 -52.86 9.18 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.631 -0.713 . . . . 74.44 111.14 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 28.9 mt-10 -66.76 -44.68 80.77 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.846 0.858 . . . . 71.02 112.582 -173.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 79.8 mt -80.28 -10.81 59.76 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 120.164 -0.614 . . . . 74.32 109.456 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.5 t70 55.74 71.15 0.57 Allowed 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.079 -1.418 . . . . 75.2 111.612 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.7 t -124.86 104.95 29.84 Favored Pre-proline 0 C--N 1.303 -1.419 0 CA-C-N 114.701 -1.136 . . . . 72.11 108.52 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -75.98 73.04 5.02 Favored 'Trans proline' 0 N--CA 1.449 -1.101 0 C-N-CA 122.011 1.807 . . . . 74.42 111.092 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.411 HD11 ' SG ' ' A' ' 81' ' ' CYS . 0.3 OUTLIER -95.87 -24.35 16.48 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.024 1.12 . . . . 73.12 114.024 -178.4 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 62.41 17.83 9.8 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 121.977 0.894 . . . . 73.01 111.247 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.515 ' O ' HD22 ' A' ' 94' ' ' LEU . 63.8 mtt -113.12 17.52 18.67 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.794 -1.093 . . . . 72.22 109.969 -177.557 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.63 ' O ' HG11 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -60.9 -56.07 25.49 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.218 -0.446 . . . . 73.54 111.165 -175.7 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.526 ' O ' HG21 ' A' ' 95' ' ' VAL . 35.2 mm -66.64 -42.84 48.1 Favored Pre-proline 0 CA--C 1.571 1.764 0 C-N-CA 123.181 0.592 . . . . 74.33 110.728 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -48.05 -41.85 32.99 Favored 'Trans proline' 0 CA--C 1.557 1.638 0 C-N-CA 121.759 1.64 . . . . 62.3 111.943 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.696 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 4.3 mm? -69.45 -36.2 76.38 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 122.795 0.438 . . . . 75.13 110.804 173.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.63 HG11 ' O ' ' A' ' 91' ' ' GLU . 5.8 m -68.21 -35.02 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-O 121.986 0.898 . . . . 74.21 110.156 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.8 t -59.53 -26.42 65.32 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 125.501 1.52 . . . . 71.2 110.99 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.696 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 2.7 mt -50.09 -47.46 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 C-N-CA 123.883 0.873 . . . . 72.34 110.949 176.071 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.467 ' CD1' ' HA ' ' A' ' 66' ' ' PHE . 7.8 t-105 -124.51 84.28 2.26 Favored 'General case' 0 N--CA 1.409 -2.491 0 CA-C-O 122.813 1.292 . . . . 71.41 110.044 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -122.14 -151.15 8.36 Favored Glycine 0 N--CA 1.411 -2.98 0 CA-C-N 112.96 -1.927 . . . . 74.2 109.066 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -60.61 152.67 67.03 Favored 'Trans proline' 0 C--O 1.251 1.158 0 C-N-CA 122.793 2.329 . . . . 74.13 112.79 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 . . . . . 0 N--CA 1.422 -1.836 0 C-N-CA 125.82 1.648 . . . . 75.33 112.627 178.773 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.541 0 N-CA-C 110.92 -0.872 . . . . 72.31 110.92 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -72.55 97.22 0.86 Allowed 'Trans proline' 0 C--O 1.246 0.923 0 C-N-CA 122.501 2.134 . . . . 75.12 113.046 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 92.1 mt -103.23 136.91 42.13 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 115.363 -0.835 . . . . 75.35 109.204 178.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.06 -16.71 49.96 Favored Glycine 0 C--N 1.306 -1.083 0 N-CA-C 111.302 -0.719 . . . . 70.33 111.302 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.1 m -137.4 161.44 36.31 Favored 'General case' 0 N--CA 1.425 -1.678 0 CA-C-O 121.185 0.517 . . . . 65.42 109.981 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.412 ' SD ' HD13 ' A' ' 92' ' ' ILE . 6.4 tpt -95.86 -12.87 24.54 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.518 -1.289 . . . . 71.4 107.518 177.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.59 25.22 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.089 1.514 . . . . 74.22 115.089 -173.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.26 -17.44 56.67 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.857 1.313 . . . . 74.5 109.129 177.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.82 -31.49 72.75 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 113.408 -1.724 . . . . 75.15 112.925 179.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.427 ' HB2' HD12 ' A' ' 11' ' ' ILE . 51.7 m -61.86 -27.84 69.08 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.672 0.748 . . . . 72.34 110.483 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.427 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.62 -29.74 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.427 -1.26 . . . . 71.35 111.76 -173.302 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.417 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 37.2 mmt180 -85.91 -38.13 18.35 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.9 1.074 . . . . 75.11 113.9 -172.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.15 -51.85 0.27 Allowed 'General case' 0 CA--C 1.552 1.027 0 N-CA-C 117.407 2.373 . . . . 73.41 117.407 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.538 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 42.3 m-80 -126.42 -80.59 0.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.588 1.329 . . . . 73.43 114.588 -173.454 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 67.99 84.67 0.15 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.187 0.995 . . . . 74.31 110.92 -175.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.68 -47.17 55.96 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.379 -0.828 . . . . 72.31 113.086 -177.149 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -61.23 -33.1 72.95 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.126 0.417 . . . . 72.12 112.126 -176.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.403 HD13 HD23 ' A' ' 94' ' ' LEU . 94.3 mt -64.87 -33.95 77.21 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.056 -0.52 . . . . 75.04 111.595 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.488 ' CA ' HD11 ' A' ' 97' ' ' ILE . 65.9 t-105 -63.9 -39.96 95.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.32 -0.4 . . . . 74.31 110.289 177.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.48 -38.95 91.26 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.593 -0.276 . . . . 74.13 110.435 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 76.7 t90 -58.76 -50.38 74.15 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.861 -0.792 . . . . 75.52 108.861 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.16 -52.89 62.94 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 114.893 -1.049 . . . . 74.14 110.773 -176.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 67.2 t -53.16 -51.76 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.124 0.57 . . . . 75.23 112.117 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.43 -0.35 . . . . 74.0 111.533 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -74.44 -47.12 35.59 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 107.695 -1.224 . . . . 63.41 107.695 -176.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.679 ' HA ' ' ND2' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -68.11 -24.74 65.06 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 124.237 1.015 . . . . 73.43 111.211 -178.67 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 48.0 t -63.53 -15.11 57.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.079 -0.711 . . . . 65.21 109.079 174.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -100.39 -4.53 28.84 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-O 121.064 0.459 . . . . 72.24 110.084 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.679 ' ND2' ' HA ' ' A' ' 26' ' ' LEU . 8.4 p30 -133.93 48.36 3.17 Favored Pre-proline 0 N--CA 1.472 0.658 0 N-CA-C 113.362 0.875 . . . . 61.4 113.362 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.479 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.4 Cg_exo -72.36 -22.95 21.11 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.612 1.541 . . . . 75.23 111.154 -175.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -75.6 -51.32 13.13 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.857 -0.794 . . . . 75.34 108.857 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.536 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 60.9 t90 -60.72 -44.14 96.97 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.06 -0.973 . . . . 74.24 109.668 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.534 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -58.08 -43.4 86.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.627 -0.715 . . . . 75.55 109.641 -178.383 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 50.7 m -61.99 -49.44 76.06 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 116.26 -0.427 . . . . 73.25 110.964 177.624 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.14 -39.85 63.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.727 0.811 . . . . 64.32 111.612 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.2 mmmt -74.21 -33.48 63.4 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.979 -0.289 . . . . 73.52 111.306 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.534 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.9 mt -59.1 -34.1 71.62 Favored 'General case' 0 C--O 1.19 -2.05 0 N-CA-C 110.342 -0.244 . . . . 73.21 110.342 174.304 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 90.5 mtt180 -59.33 -39.12 82.14 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.287 0.565 . . . . 75.2 110.51 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -72.26 -38.91 68.76 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 114.907 -1.042 . . . . 44.34 110.396 -176.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.537 ' CD1' HG22 ' A' ' 72' ' ' THR . 69.7 m-85 -89.29 -50.19 6.28 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 113.559 0.948 . . . . 73.02 113.559 -176.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.3 mp -79.65 128.38 74.89 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 123.591 0.756 . . . . 74.44 110.498 -179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -72.85 -22.12 20.48 Favored 'Trans proline' 0 C--N 1.321 -0.914 0 C-N-CA 122.23 1.953 . . . . 74.44 111.761 177.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.5 p -108.62 -30.59 8.14 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 113.871 1.063 . . . . 73.14 113.871 -176.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.29 1.1 ptm 41.32 92.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 116.205 1.928 . . . . 65.44 116.205 -175.927 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -99.12 56.8 1.05 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 123.171 1.463 . . . . 72.42 108.244 177.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 pp -92.18 -17.33 25.03 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.577 -1.647 . . . . 64.04 112.634 -173.128 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -88.74 0.21 56.7 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.025 0.917 . . . . 74.54 110.744 -176.294 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.3 m -81.78 69.46 8.46 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.615 -0.721 . . . . 72.32 109.697 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.3 m -93.15 82.89 4.58 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-O 121.896 0.855 . . . . 73.12 109.582 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.66 -28.28 30.76 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 122.698 1.237 . . . . 73.13 110.333 176.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -134.11 167.53 22.42 Favored Pre-proline 1 N--CA 1.376 -4.158 0 N-CA-C 104.948 -2.241 . . . . 74.41 104.948 176.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -76.83 -149.45 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 121.691 1.594 . . . . 75.44 110.648 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 29.3 p -76.0 38.65 0.17 Allowed 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 123.666 0.786 . . . . 74.1 112.788 -177.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.94 150.98 46.86 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 125.156 1.382 . . . . 72.44 111.591 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -52.87 -43.85 53.1 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 123.529 2.819 . . . . 75.21 113.956 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.4 -28.92 61.3 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 120.977 -0.289 . . . . 73.43 111.37 -178.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.541 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 99.8 t -65.87 -52.54 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.362 -1.347 . . . . 75.11 107.362 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.0 mm -55.48 -47.41 78.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.641 -1.163 . . . . 75.43 110.148 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -54.16 -40.93 67.94 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.337 0.655 . . . . 75.21 111.462 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.442 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.0 ttm180 -68.17 -41.44 81.52 Favored 'General case' 0 C--N 1.297 -1.705 0 C-N-CA 123.412 0.685 . . . . 74.55 111.093 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.541 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 46.0 mt-30 -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.349 -0.841 . . . . 71.12 111.175 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.414 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -77.9 -30.58 50.73 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.452 -0.795 . . . . 72.33 110.678 -178.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.442 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 24.0 t-20 -54.59 -46.01 73.71 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.244 1.017 . . . . 64.24 110.622 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -54.03 -33.83 58.34 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.114 -1.403 . . . . 75.23 112.075 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.9 mt -72.45 -42.92 64.47 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.734 0.302 . . . . 74.21 111.026 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -64.83 -32.51 74.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.815 -0.63 . . . . 74.25 109.581 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.9 -24.8 63.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.287 -0.87 . . . . 72.13 111.624 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -74.29 -37.37 63.69 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 108.615 -0.883 . . . . 73.42 108.615 175.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.49 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . 170.81 138.78 2.59 Favored Glycine 0 N--CA 1.415 -2.737 0 CA-C-N 114.678 -1.146 . . . . 64.23 110.909 -176.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.525 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.48 -26.55 63.67 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 106.864 -1.532 . . . . 72.22 106.864 171.385 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.44 -37.54 65.81 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 113.986 -1.461 . . . . 75.21 108.374 174.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.537 HG22 ' CD1' ' A' ' 40' ' ' PHE . 53.1 m -58.99 -42.47 90.12 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.488 -0.778 . . . . 74.15 109.707 173.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.463 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -61.27 -46.0 92.15 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.03 -0.532 . . . . 72.33 110.639 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' A' ' 70' ' ' MET . 95.2 mttt -53.76 -46.39 70.91 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 122.581 0.352 . . . . 74.42 110.852 175.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.7 m -65.63 -42.28 91.67 Favored 'General case' 0 N--CA 1.407 -2.593 0 C-N-CA 123.033 0.533 . . . . 75.42 111.756 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 94.5 t80 -58.37 -49.22 78.01 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.042 -0.527 . . . . 75.04 111.584 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.3 mm -61.13 -33.92 58.16 Favored 'Isoleucine or valine' 0 C--O 1.244 0.792 0 O-C-N 123.336 0.397 . . . . 73.53 111.177 -177.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.432 ' HA ' ' OE1' ' A' ' 91' ' ' GLU . 5.7 t30 -57.96 -49.02 78.21 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.857 -0.611 . . . . 75.14 110.156 175.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.432 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.6 m-20 -72.85 -40.12 65.97 Favored 'General case' 0 C--O 1.194 -1.846 0 CA-C-N 114.928 -1.033 . . . . 72.22 110.666 -178.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.498 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.5 tm? -50.95 -54.47 24.02 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 125.229 1.412 . . . . 73.15 109.732 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.7 m -65.95 -40.67 91.55 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.151 -0.477 . . . . 62.52 110.281 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -65.38 -49.02 70.89 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 73.43 111.986 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 33.9 mt-10 -81.11 -17.71 49.01 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 112.942 0.719 . . . . 74.04 112.942 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -103.17 -39.39 6.88 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 112.501 0.556 . . . . 75.44 112.501 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -138.3 -151.64 0.39 Allowed 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.871 -1.159 . . . . 71.45 107.871 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.2 m -105.04 166.45 11.43 Favored Pre-proline 0 C--N 1.295 -1.771 0 N-CA-C 107.35 -1.352 . . . . 75.25 107.35 175.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.9 86.69 0.73 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.501 1.467 . . . . 71.44 111.577 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.49 ' CD1' ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -77.48 -13.43 59.92 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-N 115.905 -0.589 . . . . 72.21 112.003 178.058 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.6 t70 53.48 83.63 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 116.1 1.889 . . . . 75.54 116.1 174.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.49 ' HG2' ' CD2' ' A' ' 88' ' ' LEU . 26.2 ptm -156.12 32.25 0.34 Allowed 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.04 -2.578 . . . . 75.03 104.04 168.74 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.588 ' O ' HG11 ' A' ' 95' ' ' VAL . 35.2 tt0 -60.4 -50.84 72.0 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 111.547 -2.569 . . . . 71.43 111.759 -172.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.534 ' O ' HG21 ' A' ' 95' ' ' VAL . 42.4 mm -60.56 -45.4 97.2 Favored Pre-proline 0 CA--C 1.559 1.29 0 C-N-CA 123.011 0.525 . . . . 72.21 111.536 -177.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -47.89 -37.25 28.67 Favored 'Trans proline' 0 CA--C 1.553 1.454 0 C-N-CA 121.911 1.741 . . . . 74.45 111.812 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.403 HD23 HD13 ' A' ' 18' ' ' LEU . 4.4 mm? -76.26 -34.98 59.14 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 122.797 0.439 . . . . 72.35 110.972 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.588 HG11 ' O ' ' A' ' 91' ' ' GLU . 5.2 m -68.53 -30.59 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-O 122.799 1.285 . . . . 75.31 110.748 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.417 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 30.0 t -83.5 2.86 34.81 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 113.635 -1.62 . . . . 74.0 112.39 -178.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.538 ' HA ' ' O ' ' A' ' 14' ' ' ASN . 9.7 tt -62.67 -25.86 39.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 114.143 1.164 . . . . 73.31 114.143 -170.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -101.33 -22.08 14.69 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 121.777 -0.577 . . . . 74.33 111.533 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.06 75.66 1.18 Allowed Glycine 0 C--N 1.305 -1.157 0 N-CA-C 109.236 -1.546 . . . . 63.0 109.236 -173.046 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -66.27 113.54 2.69 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.223 2.615 . . . . 70.04 113.488 -173.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 . . . . . 0 N--CA 1.405 -2.716 0 N-CA-C 106.763 -1.569 . . . . 73.33 106.763 176.484 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.461 0 N-CA-C 110.443 -1.063 . . . . 73.01 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -64.1 -46.92 7.21 Favored 'Trans proline' 0 C--O 1.24 0.617 0 C-N-CA 122.591 2.194 . . . . 73.11 112.335 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.3 tp -70.26 98.96 1.45 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 121.129 0.49 . . . . 74.44 111.039 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.95 -20.78 29.93 Favored Glycine 0 N--CA 1.437 -1.261 0 N-CA-C 111.048 -0.821 . . . . 40.11 111.048 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.3 m -65.67 116.0 6.43 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 122.92 0.488 . . . . 64.01 110.738 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.32 1.42 55.78 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-O 122.048 0.928 . . . . 65.42 111.165 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -106.34 25.68 10.78 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 114.903 -1.044 . . . . 71.22 110.897 177.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.02 -17.25 57.3 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-O 121.396 0.617 . . . . 73.31 109.355 174.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.414 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -53.24 -40.4 64.52 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 126.049 1.74 . . . . 74.42 115.222 -177.315 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 33.5 t -58.35 -41.52 84.88 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 124.457 1.103 . . . . 74.12 110.261 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.509 HD11 ' H ' ' A' ' 11' ' ' ILE . 3.5 mp -87.2 -36.69 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.147 0 CA-C-N 114.711 -1.131 . . . . 71.44 111.648 -176.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.435 ' O ' ' HB2' ' A' ' 13' ' ' LEU . 15.5 mmt180 -72.66 -49.48 31.41 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 114.405 1.261 . . . . 73.32 114.405 -176.47 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.435 ' HB2' ' O ' ' A' ' 12' ' ' ARG . 3.9 mm? 63.1 -168.91 0.19 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.862 0.726 . . . . 71.43 110.054 -171.586 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -138.85 178.59 7.05 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 121.631 -0.668 . . . . 73.24 111.279 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -114.2 145.02 42.25 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.9 -1.148 . . . . 75.21 107.9 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -64.17 -29.38 70.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.096 0.558 . . . . 72.5 110.516 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -39.01 86.03 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 109.082 -0.71 . . . . 72.43 109.082 176.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.7 tt -72.31 -38.4 68.72 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.152 -1.386 . . . . 73.02 109.182 -177.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 66.8 t-105 -60.77 -51.14 70.6 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.312 -0.404 . . . . 73.32 109.968 175.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.49 -38.23 86.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 115.689 -0.687 . . . . 72.34 110.558 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.7 t-105 -61.48 -50.89 70.94 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.302 0.376 . . . . 75.01 111.074 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.85 -50.15 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.529 -0.545 . . . . 74.11 109.529 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -61.16 -46.32 96.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.947 -0.569 . . . . 72.0 111.811 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.402 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 78.3 ttt180 -69.12 -42.48 75.99 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.7 -0.227 . . . . 73.42 111.606 -176.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -67.31 -43.73 80.96 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.446 -0.576 . . . . 71.11 109.446 -176.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.5 mt -70.02 -25.18 63.46 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 122.444 0.298 . . . . 73.32 111.673 177.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -70.2 -12.91 61.92 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.794 -0.817 . . . . 75.24 108.794 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.402 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 7.0 mtmp? -101.17 -5.15 26.0 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.512 -0.551 . . . . 74.35 109.512 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.484 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 92.3 m-20 -136.72 52.06 5.52 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.411 -0.813 . . . . 74.32 111.172 -175.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.484 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 6.1 Cg_exo -71.97 -21.78 23.89 Favored 'Trans proline' 0 C--N 1.358 1.04 0 N-CA-C 108.687 -1.313 . . . . 72.31 108.687 -177.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.49 -36.93 68.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.49 -1.686 . . . . 73.54 109.914 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.579 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 69.2 t90 -75.11 -45.16 42.96 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.571 -0.852 . . . . 75.12 109.098 173.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.461 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 60.3 tp -56.46 -48.82 76.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.367 -1.288 . . . . 63.43 112.346 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.7 m -55.99 -36.74 68.24 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 123.575 0.547 . . . . 72.21 111.641 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.422 ' O ' ' HG2' ' A' ' 38' ' ' ARG . . . -66.81 -38.84 87.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.382 0.611 . . . . 70.31 110.184 179.358 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.579 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.8 mmmt -76.53 -37.25 56.98 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.685 -0.406 . . . . 71.44 111.392 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 88.0 mt -54.37 -49.71 69.19 Favored 'General case' 0 C--O 1.186 -2.251 0 O-C-N 123.574 0.546 . . . . 75.2 110.264 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.477 ' HA ' ' HB3' ' A' ' 44' ' ' MET . 28.4 ptt180 -65.22 -30.49 71.39 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 113.463 0.912 . . . . 74.34 113.463 -178.07 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 72.1 m -69.93 -23.47 63.22 Favored 'General case' 0 N--CA 1.385 -3.709 0 CA-C-N 115.314 -0.857 . . . . 64.22 111.793 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.448 ' CD1' HG21 ' A' ' 72' ' ' THR . 57.7 m-85 -100.66 -44.11 5.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 123.825 0.85 . . . . 65.24 112.639 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.424 HD13 ' O ' ' A' ' 37' ' ' LEU . 9.5 mp -76.59 120.48 81.85 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 124.438 1.095 . . . . 72.43 110.67 178.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -62.98 -34.5 70.64 Favored 'Trans proline' 0 CA--C 1.535 0.575 0 C-N-CA 122.953 2.436 . . . . 74.14 113.533 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.6 p -114.34 -5.37 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.18 0.514 . . . . 74.54 112.062 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.477 ' HB3' ' HA ' ' A' ' 38' ' ' ARG 0.286 6.4 ptt? 41.96 92.12 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 115.532 1.679 . . . . 71.43 115.532 -174.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -100.92 58.22 0.9 Allowed 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 107.908 -1.145 . . . . 62.42 107.908 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 pp -96.17 -5.18 41.17 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.743 -1.117 . . . . 74.21 112.915 -175.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -80.7 -13.34 59.09 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.767 0.794 . . . . 75.42 111.326 -176.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -75.53 91.09 2.78 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.195 -0.911 . . . . 75.4 110.153 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.1 t -141.74 76.53 1.55 Allowed 'General case' 0 N--CA 1.419 -1.975 0 N-CA-C 108.352 -0.981 . . . . 72.43 108.352 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.31 -28.56 69.29 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-N 113.83 -1.532 . . . . 74.03 112.475 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -122.73 169.44 9.8 Favored Pre-proline 0 C--N 1.247 -3.864 0 N-CA-C 106.187 -1.783 . . . . 63.54 106.187 178.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -68.04 -156.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.558 1.685 0 C-N-CA 121.321 1.347 . . . . 71.33 111.517 173.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.0 m -75.72 39.12 0.16 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 124.154 0.982 . . . . 75.04 113.197 -174.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -57.08 149.6 44.83 Favored Pre-proline 0 N--CA 1.432 -1.354 0 C-N-CA 126.186 1.794 . . . . 63.32 111.295 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -46.65 -45.89 18.96 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.35 3.367 . . . . 72.0 114.243 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -74.6 -25.98 59.61 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.178 0.513 . . . . 74.13 110.966 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 95.5 t -73.97 -47.73 41.43 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.572 -0.899 . . . . 64.52 108.572 178.112 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.4 mm -59.02 -41.81 84.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.962 -1.017 . . . . 72.4 109.861 176.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -55.62 -46.58 77.36 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 115.643 -0.708 . . . . 62.4 110.025 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -58.89 -43.34 90.95 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.365 0.603 . . . . 74.15 111.209 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.33 -46.45 76.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.012 -0.995 . . . . 74.53 111.603 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -74.44 -30.59 61.96 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.465 -0.788 . . . . 75.42 111.918 -177.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -63.13 -38.45 91.23 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 123.706 0.802 . . . . 73.3 109.854 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 9.5 tpp85 -59.5 -29.46 67.88 Favored 'General case' 1 N--CA 1.375 -4.181 0 C-N-CA 124.924 1.29 . . . . 75.13 111.877 178.582 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -71.09 -38.07 72.42 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.795 -0.446 . . . . 73.4 109.795 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -69.08 -31.23 69.83 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.899 -0.778 . . . . 71.54 108.899 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.88 -26.72 66.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.436 -0.802 . . . . 74.14 110.944 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 35.8 mm-40 -70.83 -48.56 53.42 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 107.782 -1.192 . . . . 75.24 107.782 174.243 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.428 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -174.92 139.69 4.95 Favored Glycine 0 CA--C 1.474 -2.499 0 CA-C-N 114.635 -1.166 . . . . 55.14 110.739 -176.81 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.609 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -66.08 -29.73 70.12 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 106.211 -1.774 . . . . 75.55 106.211 171.666 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.22 -35.54 59.0 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.789 -1.55 . . . . 63.5 108.718 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.448 HG21 ' CD1' ' A' ' 40' ' ' PHE . 91.1 m -58.75 -41.16 85.87 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.742 -0.663 . . . . 74.11 110.03 175.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.549 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -63.33 -49.37 74.2 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.441 -0.345 . . . . 65.04 110.424 176.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.609 ' HG3' ' O ' ' A' ' 70' ' ' MET . 86.7 mttt -54.7 -35.39 63.57 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.325 0.65 . . . . 74.33 111.545 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.1 m -72.17 -49.94 31.73 Favored 'General case' 0 N--CA 1.409 -2.507 0 N-CA-C 109.69 -0.485 . . . . 72.52 109.69 176.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -50.51 -48.51 56.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 124.125 0.97 . . . . 75.55 112.189 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 41.1 mm -57.4 -37.07 55.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 N-CA-C 112.644 0.609 . . . . 75.3 112.644 -178.671 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -65.92 -34.06 77.26 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.288 0.566 . . . . 74.33 110.169 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.402 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 1.2 m-20 -78.21 -42.77 30.35 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.712 -0.676 . . . . 73.53 110.174 175.171 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -50.19 -54.52 20.29 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.869 1.668 . . . . 74.42 110.542 179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 13.2 p -64.48 -33.36 75.71 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.379 -0.828 . . . . 71.42 111.643 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -75.93 -54.64 6.58 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.063 -0.971 . . . . 72.53 111.778 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.402 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 40.5 mt-10 -70.93 -31.35 67.93 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.504 0.927 . . . . 72.54 113.504 -170.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.5 -49.34 19.05 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 119.993 -0.683 . . . . 71.33 111.857 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -161.69 -97.3 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.13 0.269 . . . . 74.42 110.514 -176.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -140.64 165.02 32.72 Favored Pre-proline 0 C--N 1.3 -1.573 0 N-CA-C 105.445 -2.057 . . . . 74.32 105.445 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -43.5 107.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 122.967 2.444 . . . . 71.22 112.101 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -8.86 59.61 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.835 -1.075 . . . . 74.5 112.823 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -175.12 -161.64 0.1 Allowed 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 103.179 -2.897 . . . . 73.42 103.179 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.496 ' O ' HD22 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -86.59 141.62 28.88 Favored 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 106.926 -1.509 . . . . 74.32 106.926 178.448 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.563 ' O ' HG11 ' A' ' 95' ' ' VAL . 36.2 tt0 -52.78 -52.25 57.44 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 124.977 1.311 . . . . 65.43 112.94 -175.059 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.435 ' O ' HG22 ' A' ' 95' ' ' VAL . 39.3 mm -64.44 -45.6 77.46 Favored Pre-proline 0 C--O 1.169 -3.154 0 CA-C-O 117.534 -1.222 . . . . 71.34 113.136 -172.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -49.38 -35.13 34.71 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 CA-C-N 122.837 2.049 . . . . 74.35 112.097 172.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.496 HD22 ' O ' ' A' ' 90' ' ' MET . 3.4 mm? -72.2 -36.59 69.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.691 -0.686 . . . . 71.54 109.385 175.553 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.563 HG11 ' O ' ' A' ' 91' ' ' GLU . 2.9 m -69.87 -36.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-O 122.385 1.088 . . . . 74.31 109.993 177.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.6 m -70.42 5.24 1.86 Allowed 'General case' 0 C--N 1.293 -1.858 0 C-N-CA 127.694 2.398 . . . . 73.25 113.007 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 10.3 tp -66.61 -28.56 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.088 0.47 . . . . 64.23 111.163 -175.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -164.47 116.82 1.3 Allowed 'General case' 0 N--CA 1.421 -1.887 0 N-CA-C 108.126 -1.064 . . . . 74.1 108.126 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 177.6 70.6 0.06 OUTLIER Glycine 0 C--N 1.277 -2.742 0 N-CA-C 108.027 -2.029 . . . . 75.34 108.027 178.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -67.25 98.46 0.45 Allowed 'Trans proline' 0 C--N 1.358 1.033 0 C-N-CA 123.14 2.56 . . . . 74.41 112.076 -174.265 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 . . . . . 0 N--CA 1.401 -2.903 0 N-CA-C 106.801 -1.555 . . . . 74.04 106.801 -178.679 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.208 0 N-CA-C 109.899 -1.28 . . . . 71.53 109.899 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -57.72 109.0 0.42 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 122.824 2.35 . . . . 75.42 111.922 176.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 93.2 mt -99.3 -30.01 12.48 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.703 -0.68 . . . . 73.3 110.771 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 155.88 -49.12 0.47 Allowed Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 111.893 -0.483 . . . . 70.44 111.893 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.1 m -84.74 122.22 28.79 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.501 -0.926 . . . . 51.45 108.501 177.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 tpt -71.18 -11.58 61.01 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.201 0.524 . . . . 73.02 110.162 -176.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -78.32 25.09 0.24 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.933 0.893 . . . . 70.34 112.205 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.56 -13.27 60.09 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.22 -1.03 . . . . 75.11 108.22 174.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.88 -38.24 84.96 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.376 -1.284 . . . . 72.3 112.142 178.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.447 ' HB2' HD11 ' A' ' 11' ' ' ILE . 68.0 m -54.92 -32.17 60.89 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 124.679 1.192 . . . . 74.33 111.727 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.447 HD11 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -83.88 -25.91 7.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 C-N-CA 124.91 1.284 . . . . 74.31 110.322 -173.499 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -110.16 7.4 23.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.646 -0.707 . . . . 65.23 111.964 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.4 tt -51.35 121.43 6.27 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.576 1.151 . . . . 74.41 112.586 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.404 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 26.4 t-20 -152.42 149.43 28.58 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 105.093 -2.188 . . . . 71.01 105.093 177.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -122.17 -73.77 0.64 Allowed 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 118.815 -1.154 . . . . 74.21 113.122 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.97 -34.34 75.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.958 1.466 . . . . 72.12 114.958 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -70.26 -40.21 74.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 120.259 -0.576 . . . . 73.13 110.966 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.8 mt -74.44 -34.86 63.3 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.242 -0.436 . . . . 74.42 110.241 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 49.0 t-105 -61.15 -50.12 74.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.278 -0.419 . . . . 73.13 110.769 178.182 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.11 85.73 Favored 'General case' 0 C--O 1.243 0.74 0 O-C-N 123.225 0.328 . . . . 74.25 110.902 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 22.2 t-105 -63.88 -51.03 66.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.739 -0.664 . . . . 74.5 110.948 176.004 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.8 tp -60.08 -49.2 78.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.998 -0.546 . . . . 72.44 110.076 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.3 t -57.42 -46.38 85.64 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 CA-C-N 115.681 -0.69 . . . . 73.35 111.446 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.44 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 19.7 tpt180 -68.52 -44.26 75.02 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 116.644 -0.253 . . . . 72.4 110.728 -176.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -67.93 -42.96 80.22 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 109.674 -0.491 . . . . 75.44 109.674 -176.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.3 mt -71.61 -24.53 61.9 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 112.008 0.373 . . . . 74.14 112.008 177.339 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.6 t -67.09 -23.28 65.83 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 107.723 -1.214 . . . . 71.24 107.723 175.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.44 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 31.1 mtmt -90.94 -10.2 43.32 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.66 -0.7 . . . . 71.43 110.084 178.133 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -135.4 52.3 6.86 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 122.883 0.473 . . . . 74.2 111.33 -177.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.01 -17.88 24.6 Favored 'Trans proline' 0 C--N 1.368 1.556 0 N-CA-C 108.759 -1.285 . . . . 72.22 108.759 -178.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -71.55 -38.58 71.0 Favored 'General case' 0 N--CA 1.417 -2.099 0 CA-C-N 113.386 -1.734 . . . . 73.03 109.455 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.433 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.1 t90 -74.67 -47.98 28.75 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.657 -0.817 . . . . 71.35 109.554 176.291 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.542 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 52.8 tp -54.05 -51.48 63.92 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.009 -1.45 . . . . 72.22 112.418 -175.091 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.488 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.9 p -50.34 -51.79 42.63 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 123.878 0.736 . . . . 75.01 112.127 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.73 -43.48 76.63 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 125.083 1.353 . . . . 74.33 112.081 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.488 ' O ' ' HB2' ' A' ' 39' ' ' SER . 31.0 mmmt -74.05 -30.03 62.19 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.325 -0.235 . . . . 73.33 110.436 178.284 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.542 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 98.0 mt -63.77 -35.88 82.03 Favored 'General case' 0 C--O 1.187 -2.205 0 N-CA-C 109.256 -0.646 . . . . 74.23 109.256 173.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.488 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -61.51 -33.56 74.02 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.269 0.557 . . . . 73.35 110.562 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.488 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.3 m -74.56 -41.59 60.28 Favored 'General case' 0 N--CA 1.402 -2.855 0 C-N-CA 124.981 1.312 . . . . 72.03 112.324 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.533 ' CD1' HG21 ' A' ' 72' ' ' THR . 67.1 m-85 -88.99 -48.31 7.52 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 113.091 0.775 . . . . 74.45 113.091 -177.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.473 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 8.4 mp -89.85 139.0 27.57 Favored Pre-proline 0 C--N 1.295 -1.777 0 C-N-CA 124.425 1.09 . . . . 72.22 112.139 -177.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_endo -91.04 -13.0 2.14 Favored 'Trans proline' 0 CA--C 1.551 1.326 0 C-N-CA 122.241 1.96 . . . . 73.43 109.284 166.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.9 p -114.37 26.59 10.13 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 125.668 1.587 . . . . 71.54 111.567 -172.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.257 0.0 OUTLIER -59.11 96.08 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 115.946 1.832 . . . . 75.4 115.946 -173.943 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.42 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 16.4 m-20 -83.72 74.06 10.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.004 -1.48 . . . . 74.41 107.004 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.6 pp -95.81 -27.35 15.26 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-N 115.24 -0.891 . . . . 74.41 111.456 -178.051 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -103.66 6.13 36.85 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 122.265 1.031 . . . . 73.1 109.668 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.42 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 63.6 m -81.72 74.33 8.72 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 122.407 1.099 . . . . 51.31 109.464 177.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.4 t -90.52 83.33 5.84 Favored 'General case' 0 N--CA 1.403 -2.793 0 CA-C-N 114.36 -1.291 . . . . 72.4 110.142 -176.03 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -79.76 -28.79 40.36 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 123.166 1.46 . . . . 75.31 108.696 170.026 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -135.0 161.87 61.11 Favored Pre-proline 1 N--CA 1.373 -4.313 0 CA-C-N 112.03 -2.35 . . . . 63.21 105.191 177.44 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.441 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.2 Cg_exo -67.81 -143.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.846 2.364 . . . . 74.34 111.917 175.931 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.9 m -76.91 37.64 0.19 Allowed 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 124.1 0.96 . . . . 71.44 110.489 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.441 ' H ' ' C ' ' A' ' 52' ' ' PRO . 7.2 m-20 -65.32 152.23 92.39 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 126.795 2.038 . . . . 74.34 113.258 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -54.32 -41.67 74.36 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 123.954 3.103 . . . . 64.45 114.272 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.47 -29.69 61.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.225 0.536 . . . . 75.41 110.478 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.438 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 86.8 t -66.38 -51.65 55.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.207 -1.034 . . . . 72.33 108.207 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.9 mm -59.65 -41.56 85.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.561 -1.199 . . . . 75.43 109.709 177.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -56.42 -42.15 77.55 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.838 0.455 . . . . 74.22 111.251 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.519 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 21.2 ttt180 -61.21 -42.0 97.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.599 0.714 . . . . 75.41 110.953 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.438 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 84.6 mt-30 -71.39 -42.24 68.63 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.942 -1.026 . . . . 75.41 111.764 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -75.51 -31.11 60.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 115.347 -0.842 . . . . 73.01 110.547 -179.786 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.519 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 23.7 t-20 -53.33 -49.77 66.4 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.957 1.303 . . . . 73.31 110.23 173.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 30.0 mmt180 -54.69 -33.6 61.14 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.553 -1.658 . . . . 62.21 113.071 -179.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -67.02 -40.66 87.29 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.641 0.258 . . . . 73.41 110.575 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -67.17 -32.95 74.39 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.812 -0.81 . . . . 74.42 108.812 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.09 -18.96 63.27 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.321 -0.854 . . . . 74.5 111.281 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -79.52 -55.85 4.74 Favored 'General case' 0 N--CA 1.413 -2.277 0 N-CA-C 107.137 -1.431 . . . . 74.42 107.137 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -166.51 140.29 6.25 Favored Glycine 0 N--CA 1.42 -2.372 0 CA-C-N 114.132 -1.395 . . . . 73.1 111.036 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.437 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 45.8 ttm -65.13 -30.88 71.85 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 106.137 -1.801 . . . . 71.24 106.137 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.15 -35.52 59.16 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.641 -1.618 . . . . 72.33 109.123 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.533 HG21 ' CD1' ' A' ' 40' ' ' PHE . 54.9 m -59.96 -36.95 78.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.813 -0.631 . . . . 72.34 110.007 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.497 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 75.1 t-105 -61.94 -53.0 61.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.678 -0.49 . . . . 75.13 109.678 176.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.437 ' HG3' ' O ' ' A' ' 70' ' ' MET . 92.4 mttt -51.28 -46.58 62.5 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.89 0.876 . . . . 75.25 111.727 177.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.66 -44.11 74.79 Favored 'General case' 0 N--CA 1.41 -2.444 0 C-N-CA 123.035 0.534 . . . . 63.12 112.168 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -57.06 -46.02 82.79 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 122.816 0.446 . . . . 74.11 110.382 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.479 HG23 ' HB2' ' A' ' 94' ' ' LEU . 45.4 mm -63.71 -31.35 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.019 0 CA-C-N 115.751 -0.659 . . . . 74.12 111.565 -177.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.22 -40.77 94.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.5 -0.556 . . . . 73.42 109.5 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.461 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 82.7 m-20 -68.44 -42.28 79.06 Favored 'General case' 0 C--O 1.187 -2.221 0 CA-C-N 116.017 -0.538 . . . . 72.23 109.756 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.468 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -50.52 -53.91 26.49 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.085 1.354 . . . . 75.22 109.767 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.4 m -64.24 -35.14 79.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 64.24 111.403 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -76.33 -54.29 6.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.206 0.526 . . . . 73.3 112.105 -178.252 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.461 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 31.0 mt-10 -74.78 -22.57 58.68 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.734 1.013 . . . . 73.04 113.734 -169.353 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 94.6 mt -79.71 -42.13 25.29 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 119.046 -1.061 . . . . 75.42 111.823 179.778 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . 0.25 4.3 p30 -171.19 -90.48 0.01 OUTLIER 'General case' 0 C--O 1.241 0.641 0 N-CA-C 112.677 0.621 . . . . 74.34 112.677 174.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 69.4 t -130.51 148.04 68.37 Favored Pre-proline 0 C--N 1.301 -1.507 0 N-CA-C 106.297 -1.742 . . . . 74.32 106.297 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -39.22 109.0 0.08 OUTLIER 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 123.393 2.729 . . . . 74.45 112.207 173.27 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -74.29 -15.58 60.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.026 -0.988 . . . . 75.11 112.91 -178.297 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.86 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 105.207 -2.146 . . . . 74.13 105.207 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.1 mmt -168.5 163.66 12.51 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 102.886 -3.005 . . . . 74.02 102.886 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.554 ' C ' HG11 ' A' ' 95' ' ' VAL . 0.9 OUTLIER -72.01 -43.66 64.68 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 118.489 0.586 . . . . 75.14 111.105 -179.548 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.5 ' O ' HG22 ' A' ' 95' ' ' VAL . 29.5 mm -50.47 -44.14 81.95 Favored Pre-proline 0 CA--C 1.572 1.796 0 C-N-CA 125.7 1.6 . . . . 75.42 114.132 -171.642 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.03 -43.38 58.75 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.494 1.463 . . . . 65.41 110.793 174.56 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.479 ' HB2' HG23 ' A' ' 77' ' ' ILE . 2.8 mm? -75.15 -31.88 61.17 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.586 -1.188 . . . . 74.03 109.78 -179.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.554 HG11 ' C ' ' A' ' 91' ' ' GLU . 4.1 m -67.74 -31.36 52.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-O 122.176 0.989 . . . . 72.31 110.49 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.4 t -80.79 5.8 14.84 Favored 'General case' 0 C--N 1.281 -2.386 0 CA-C-N 113.708 -1.587 . . . . 72.43 112.408 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 14' ' ' ASN . 15.4 tt -60.46 -27.81 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 CA-C-O 121.478 0.656 . . . . 64.52 110.448 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -160.64 161.87 32.54 Favored 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 106.913 -1.514 . . . . 74.05 106.913 173.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 179.7 -115.21 0.47 Allowed Glycine 0 C--N 1.288 -2.127 0 C-N-CA 120.134 -1.031 . . . . 65.32 111.542 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.11 104.59 0.14 Allowed 'Trans proline' 0 C--O 1.243 0.735 0 C-N-CA 123.612 2.875 . . . . 72.5 111.675 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . 0.379 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.113 0 N-CA-C 115.631 1.715 . . . . 73.03 115.631 -177.783 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.335 0 N-CA-C 109.628 -1.389 . . . . 61.14 109.628 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -90.32 3.2 4.94 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.646 2.231 . . . . 71.12 113.61 -177.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.6 mp -97.91 -18.89 18.42 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.369 0.507 . . . . 74.5 112.369 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 90.82 141.75 9.59 Favored Glycine 0 N--CA 1.444 -0.801 0 N-CA-C 110.06 -1.216 . . . . 51.5 110.06 -177.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.0 m 64.88 -168.86 0.21 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.45 0.7 . . . . 75.15 110.502 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.8 tmm? -122.11 89.71 3.17 Favored 'General case' 0 CA--C 1.487 -1.479 0 N-CA-C 108.369 -0.974 . . . . 75.23 108.369 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -168.19 23.46 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 114.352 -1.294 . . . . 73.4 109.495 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.417 ' HB3' ' HB ' ' A' ' 92' ' ' ILE . . . -77.63 -12.03 59.93 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.765 1.269 . . . . 52.24 108.788 178.197 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.447 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -66.65 -30.57 70.86 Favored 'General case' 0 N--CA 1.415 -2.224 0 CA-C-N 112.917 -1.947 . . . . 71.35 111.892 178.814 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.4 m -67.38 -37.79 83.7 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.638 0.732 . . . . 74.32 111.699 177.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.426 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.1 mp -84.63 -49.26 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.285 0 CA-C-N 115.168 -0.924 . . . . 75.44 112.015 -176.894 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -77.91 -36.16 49.84 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.977 -0.689 . . . . 74.14 112.302 -176.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt 60.09 106.91 0.02 OUTLIER 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.39 1.076 . . . . 72.33 113.856 -177.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -69.12 155.57 40.15 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.762 -0.653 . . . . 65.31 110.872 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -157.22 179.88 8.85 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.855 -0.612 . . . . 75.2 109.829 -174.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 mp0 -61.91 -34.68 76.5 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.441 0.697 . . . . 75.32 112.794 -175.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -59.7 -46.92 87.63 Favored 'General case' 0 CA--C 1.474 -1.978 0 CA-C-O 123.0 1.381 . . . . 75.34 109.513 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.84 -39.51 90.88 Favored 'General case' 0 N--CA 1.407 -2.625 0 CA-C-N 111.667 -2.515 . . . . 64.01 110.361 -174.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.452 ' CE3' HG12 ' A' ' 97' ' ' ILE . 61.3 t-105 -68.72 -45.75 70.74 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.824 0.345 . . . . 72.43 110.366 174.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.39 85.41 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.634 -0.712 . . . . 73.51 111.309 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.59 -47.34 70.22 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.019 0.528 . . . . 74.12 111.406 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -60.9 -49.99 75.24 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.005 -0.543 . . . . 74.11 110.076 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.797 -0.638 . . . . 72.33 111.443 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.473 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 40.1 mmt180 -72.01 -42.92 65.83 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 112.213 0.449 . . . . 75.32 112.213 -175.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.411 ' CD1' HD12 ' A' ' 84' ' ' LEU . 2.6 tm? -67.99 -38.23 82.44 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.407 -0.59 . . . . 73.41 109.407 -177.509 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 mt -71.98 -25.45 61.86 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 112.248 0.462 . . . . 71.43 112.248 176.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 t -69.38 -20.98 63.82 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.054 -1.091 . . . . 72.14 108.054 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.473 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.44 -2.56 51.65 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.584 -0.735 . . . . 72.0 109.956 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.445 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -138.32 52.39 4.69 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 115.686 -0.688 . . . . 73.44 111.682 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.445 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.1 Cg_exo -68.6 -22.36 38.2 Favored 'Trans proline' 0 C--N 1.364 1.346 0 N-CA-C 108.342 -1.446 . . . . 75.12 108.342 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -67.2 -44.62 79.14 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.01 -1.45 . . . . 72.25 110.375 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.456 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 64.3 t90 -74.31 -44.22 53.46 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 119.387 -0.925 . . . . 71.31 109.251 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.582 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.8 tp -57.74 -52.45 65.4 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.082 -1.417 . . . . 72.54 111.799 -175.427 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.0 p -51.52 -48.02 63.11 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 124.014 0.821 . . . . 72.52 111.807 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.36 85.01 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.878 0.871 . . . . 72.02 111.691 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 24.7 mmmt -68.9 -38.47 79.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.71 -0.396 . . . . 72.43 111.638 177.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 99.0 mt -58.61 -30.95 67.64 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 123.335 0.654 . . . . 74.51 111.118 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 51.5 mtm180 -61.87 -30.97 71.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.743 0.417 . . . . 73.12 111.841 -178.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.7 t -84.08 -27.07 28.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.645 0.736 . . . . 62.5 110.185 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.435 ' CD1' HG22 ' A' ' 72' ' ' THR . 65.6 m-85 -89.75 -54.74 3.93 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.631 -0.713 . . . . 75.13 112.518 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.568 HD21 ' SD ' ' A' ' 44' ' ' MET . 9.9 mp -87.49 121.22 71.23 Favored Pre-proline 0 C--N 1.311 -1.088 0 N-CA-C 112.627 0.603 . . . . 74.5 112.627 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -84.14 -15.9 6.43 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 C-N-CA 122.105 1.87 . . . . 74.23 110.49 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 t -115.15 27.83 9.12 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.292 -0.867 . . . . 74.55 110.004 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.623 ' SD ' ' HB3' ' A' ' 37' ' ' LEU . 5.3 tpt -58.2 111.4 1.19 Allowed 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 113.828 1.047 . . . . 73.21 113.828 -174.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -99.6 68.63 1.58 Allowed 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 107.663 -1.236 . . . . 70.52 107.663 174.25 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.441 HD21 ' CG ' ' A' ' 44' ' ' MET . 3.0 pp -95.1 -20.64 19.12 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 114.888 -1.051 . . . . 75.41 111.068 -174.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.51 -17.9 50.16 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.124 -0.944 . . . . 74.52 110.696 -174.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.9 m -93.32 74.87 4.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.771 -1.104 . . . . 61.51 112.06 -175.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 p -89.91 84.73 6.23 Favored 'General case' 0 N--CA 1.412 -2.369 0 CA-C-O 121.944 0.878 . . . . 74.23 110.009 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -28.64 68.72 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 114.713 -1.13 . . . . 73.54 111.563 177.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -123.53 164.34 29.03 Favored Pre-proline 1 N--CA 1.369 -4.481 0 N-CA-C 105.215 -2.142 . . . . 74.12 105.215 177.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.476 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 29.0 Cg_endo -65.68 -155.19 0.03 OUTLIER 'Trans proline' 0 CA--C 1.551 1.345 0 C-N-CA 122.562 2.175 . . . . 74.34 112.592 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.7 m -75.52 37.45 0.14 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.453 0.701 . . . . 72.24 110.739 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.476 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 5.0 m-20 -60.59 147.54 83.31 Favored Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 124.822 1.249 . . . . 74.42 113.227 -176.629 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -43.52 -50.52 6.82 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 124.411 3.407 . . . . 74.54 113.688 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -74.89 -18.96 60.34 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 113.407 0.892 . . . . 72.44 113.407 -178.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.458 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 90.5 t -75.43 -42.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 N-CA-C 107.611 -1.255 . . . . 74.22 107.611 175.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.4 mm -66.2 -42.03 90.35 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-N 115.09 -0.959 . . . . 74.35 108.854 175.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -54.52 -45.74 73.42 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 124.878 1.271 . . . . 75.42 112.854 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.432 ' HG2' ' O ' ' A' ' 57' ' ' VAL . 6.7 ptm180 -64.59 -31.55 72.82 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-N 118.549 0.613 . . . . 75.42 111.792 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.458 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.0 mt-30 -72.52 -44.01 62.79 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.574 0.702 . . . . 75.52 109.435 -177.287 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.11 -33.09 65.37 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.859 -1.064 . . . . 75.3 110.429 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -56.83 -52.4 65.25 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 124.095 0.958 . . . . 75.32 109.854 175.027 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.486 ' CB ' HD22 ' A' ' 41' ' ' LEU . 21.8 mmt180 -56.71 -29.55 62.55 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.36 -1.291 . . . . 74.54 113.474 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 56.2 mt -68.79 -45.07 72.27 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 121.125 -0.23 . . . . 74.51 110.863 176.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -70.3 -25.21 63.22 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 119.807 -0.757 . . . . 71.12 109.62 -179.54 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.19 -30.38 67.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.437 -0.801 . . . . 75.11 110.719 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 42.1 mm-40 -66.35 -38.72 88.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 109.003 -0.74 . . . . 75.41 109.003 177.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -179.59 139.56 3.91 Favored Glycine 0 N--CA 1.404 -3.449 0 CA-C-N 114.575 -1.193 . . . . 53.5 111.29 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.575 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -66.01 -31.47 72.39 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.022 -1.844 . . . . 75.15 106.022 171.166 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.64 -41.84 44.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.059 -1.428 . . . . 63.51 108.975 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.435 HG22 ' CD1' ' A' ' 40' ' ' PHE . 89.6 m -53.35 -41.27 65.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.845 0.458 . . . . 65.15 110.276 175.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.417 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.9 t-105 -62.63 -50.98 69.1 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.693 -0.685 . . . . 74.23 110.358 177.263 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.575 ' HG3' ' O ' ' A' ' 70' ' ' MET . 87.5 mttt -55.42 -42.76 74.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.616 0.366 . . . . 74.22 111.374 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.9 m -66.12 -46.99 75.6 Favored 'General case' 0 N--CA 1.409 -2.5 0 C-N-CA 123.355 0.662 . . . . 75.5 110.674 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -57.14 -50.83 71.59 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.746 -0.661 . . . . 74.31 110.624 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.428 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 32.1 mm -59.76 -32.77 50.31 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.439 -0.8 . . . . 75.54 111.607 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -64.71 -43.53 93.16 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.568 -0.53 . . . . 74.33 109.568 177.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -72.24 -37.9 69.02 Favored 'General case' 0 C--O 1.189 -2.096 0 CA-C-N 116.403 -0.362 . . . . 75.5 110.385 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.456 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.0 tm? -49.53 -54.59 17.16 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 125.402 1.481 . . . . 75.12 110.135 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.8 m -67.82 -35.21 78.21 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 115.942 -0.572 . . . . 73.04 111.09 -178.016 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -75.81 -48.77 20.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.838 -0.619 . . . . 73.31 111.393 -176.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -71.33 -27.06 63.11 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 122.906 0.482 . . . . 75.32 111.755 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.411 HD12 ' CD1' ' A' ' 25' ' ' LEU . 85.8 mt -92.26 -3.54 55.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 116.192 -0.458 . . . . 70.51 109.955 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 t70 59.24 38.72 23.29 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.021 1.328 . . . . 61.31 111.551 174.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 m -120.0 105.44 42.64 Favored Pre-proline 0 C--N 1.304 -1.375 0 CA-C-N 115.245 -0.889 . . . . 73.34 111.241 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.75 102.64 1.34 Allowed 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 121.963 1.776 . . . . 64.42 108.959 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.2 mt -96.79 -14.94 21.6 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.437 0.532 . . . . 74.52 112.437 -173.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.401 ' C ' ' H ' ' A' ' 91' ' ' GLU . 7.7 t70 70.69 -64.84 0.36 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 124.709 1.204 . . . . 72.22 110.572 -178.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.411 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 23.9 ptp -77.31 35.11 0.17 Allowed 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.68 1.592 . . . . 74.22 112.411 -175.435 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.695 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 17.8 tt0 -58.9 -36.12 74.17 Favored 'General case' 0 C--O 1.186 -2.246 0 C-N-CA 125.831 1.652 . . . . 74.4 110.039 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.5 ' O ' HG22 ' A' ' 95' ' ' VAL . 47.1 mm -70.88 -45.29 15.72 Favored Pre-proline 0 C--O 1.176 -2.791 0 O-C-N 121.268 -0.895 . . . . 71.5 109.484 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.447 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 21.4 Cg_exo -47.62 -38.21 28.31 Favored 'Trans proline' 0 CA--C 1.554 1.498 0 CA-C-N 121.2 1.464 . . . . 71.14 111.855 164.83 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.695 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 8.9 mp -59.6 -47.74 84.39 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 108.688 -0.856 . . . . 74.53 108.688 171.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.618 HG11 ' O ' ' A' ' 91' ' ' GLU . 3.7 m -64.91 -35.63 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 CA-C-O 122.267 1.032 . . . . 72.21 111.381 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.0 t -83.94 6.05 23.23 Favored 'General case' 0 C--N 1.276 -2.62 0 C-N-CA 125.715 1.606 . . . . 63.03 111.87 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.452 HG12 ' CE3' ' A' ' 19' ' ' TRP . 3.0 tp -65.47 -18.56 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 108.336 -0.987 . . . . 74.2 108.336 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 75.3 t90 -62.96 104.49 0.56 Allowed 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 125.541 1.536 . . . . 74.54 108.194 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 172.75 -168.09 41.08 Favored Glycine 0 C--N 1.286 -2.233 0 N-CA-C 110.039 -1.224 . . . . 43.1 110.039 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -90.82 38.99 0.34 Allowed 'Trans proline' 0 C--O 1.246 0.885 0 C-N-CA 123.241 2.627 . . . . 75.15 111.544 -178.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 . . . . . 0 N--CA 1.401 -2.882 0 CA-C-N 114.632 -1.167 . . . . 71.1 108.054 -178.109 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.173 0 N-CA-C 110.918 -0.873 . . . . 65.32 110.918 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -78.15 165.7 25.58 Favored 'Trans proline' 0 C--O 1.258 1.478 0 C-N-CA 121.94 1.76 . . . . 73.13 112.181 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.8 mt -92.22 -43.22 9.43 Favored 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 106.439 -1.689 . . . . 71.22 106.439 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.88 -92.04 0.24 Allowed Glycine 0 CA--C 1.499 -0.946 0 CA-C-N 114.897 -1.047 . . . . 73.41 110.644 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.3 m 71.55 -9.0 0.97 Allowed 'General case' 0 C--O 1.239 0.509 0 C-N-CA 124.858 1.263 . . . . 72.54 113.694 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.9 ttm 62.77 34.38 14.65 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 123.305 1.526 . . . . 71.4 107.466 -171.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -157.41 26.08 0.29 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.335 -2.211 . . . . 75.14 108.312 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.544 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -61.81 -13.34 23.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.286 -0.87 . . . . 70.34 112.955 -178.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.63 -37.62 84.63 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.652 0.781 . . . . 75.51 109.745 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.1 m -75.78 -17.66 59.79 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-N 114.051 -1.432 . . . . 70.22 110.541 -174.425 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.544 HG12 ' HA ' ' A' ' 8' ' ' ALA . 6.6 mm -87.6 -44.31 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 CA-C-N 115.412 -0.813 . . . . 74.44 110.247 -174.608 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -104.13 -45.33 4.75 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 114.431 1.271 . . . . 74.45 114.431 -174.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 54.91 83.64 0.08 Allowed 'General case' 0 C--N 1.344 0.368 0 N-CA-C 108.896 -0.779 . . . . 73.33 108.896 -166.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.466 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 5.5 t-20 -120.31 -168.51 1.64 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.122 -0.49 . . . . 72.34 110.109 -170.353 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.674 ' O ' HD13 ' A' ' 18' ' ' LEU . 5.6 t-20 -148.98 -173.05 4.26 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 109.19 -0.671 . . . . 74.35 109.19 -176.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -48.14 -27.48 2.39 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 128.192 2.597 . . . . 73.23 114.099 -171.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -57.98 -28.97 64.86 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 123.09 0.556 . . . . 73.41 110.975 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.674 HD13 ' O ' ' A' ' 15' ' ' ASN . 0.0 OUTLIER -62.17 -33.33 74.32 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.533 -0.758 . . . . 75.05 110.653 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.486 ' N ' HD12 ' A' ' 18' ' ' LEU . 75.9 t-105 -68.43 -32.43 72.46 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-N 115.672 -0.695 . . . . 75.33 110.117 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.95 -31.18 70.73 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.093 0.473 . . . . 74.11 109.971 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.569 ' CZ2' ' HG ' ' A' ' 25' ' ' LEU . 73.4 t90 -63.09 -50.07 71.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.635 -0.876 . . . . 73.51 108.635 173.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.06 -53.23 58.52 Favored 'General case' 0 CA--C 1.516 -0.361 0 O-C-N 124.509 1.13 . . . . 73.43 110.415 -176.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.8 t -53.82 -53.64 25.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 O-C-N 123.8 0.688 . . . . 72.25 112.052 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.425 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 26.6 mmt180 -74.57 -32.01 62.25 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 113.233 0.827 . . . . 75.12 113.233 -176.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.569 ' HG ' ' CZ2' ' A' ' 21' ' ' TRP . 1.8 tm? -70.59 -42.64 70.75 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.699 -0.852 . . . . 71.53 108.699 -178.521 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 1.2 mt -70.76 -24.63 62.64 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.924 -0.58 . . . . 71.11 111.185 177.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 p -69.71 -11.95 61.25 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.907 0.86 . . . . 64.24 108.854 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.9 mtmt -99.56 -9.87 22.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.307 -0.627 . . . . 63.42 109.307 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.448 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.3 m-80 -133.62 53.39 10.2 Favored Pre-proline 0 C--O 1.24 0.578 0 CA-C-N 115.664 -0.698 . . . . 72.53 111.934 -175.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.448 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -70.07 -22.19 31.01 Favored 'Trans proline' 0 C--N 1.363 1.335 0 N-CA-C 108.472 -1.395 . . . . 72.22 108.472 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.11 -41.86 85.49 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 113.325 -1.762 . . . . 72.25 109.929 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.517 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 73.5 t90 -73.83 -43.04 59.95 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 119.646 -0.822 . . . . 73.44 109.47 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.487 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.0 tm? -60.36 -43.26 96.71 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.105 -0.952 . . . . 74.32 110.344 -174.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 m -63.98 -35.16 79.77 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 120.799 0.333 . . . . 71.21 111.625 178.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.26 80.49 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 121.261 0.553 . . . . 74.21 110.172 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.5 mmtt -76.74 -40.61 47.95 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.117 -0.633 . . . . 75.44 112.609 173.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.487 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 78.0 mt -51.56 -41.7 61.32 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.189 0.596 . . . . 75.41 111.938 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.418 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 0.1 OUTLIER -59.54 -28.06 66.76 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.383 1.253 . . . . 74.43 114.383 -177.673 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.4 t -77.06 -40.45 46.22 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 115.745 -0.661 . . . . 72.34 110.133 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -81.84 -47.25 13.04 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 123.655 0.782 . . . . 74.54 112.637 -176.167 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 mp -80.9 124.89 81.17 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 123.379 0.672 . . . . 73.44 109.867 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -72.01 -36.47 5.88 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.045 2.497 . . . . 75.31 114.014 -177.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.5 p -106.12 -5.59 19.26 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.775 0.798 . . . . 71.23 110.316 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.418 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 2.0 mpp? 40.68 92.18 0.01 OUTLIER 'General case' 0 N--CA 1.408 -2.572 0 C-N-CA 127.69 2.396 . . . . 72.03 115.735 -175.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -101.62 70.03 1.25 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 122.733 1.254 . . . . 65.05 108.459 168.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -95.79 -5.13 42.59 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 113.146 -1.843 . . . . 65.3 110.607 -176.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -75.84 47.35 0.42 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.388 1.475 . . . . 71.24 110.436 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.4 m -86.08 -3.47 58.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.629 -0.714 . . . . 74.54 112.715 -176.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 50.7 m -82.95 65.39 8.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.769 0.795 . . . . 63.31 112.733 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.41 -28.22 37.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-O 122.921 1.343 . . . . 75.42 109.931 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.415 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 54.1 mt-10 -116.22 173.39 3.06 Favored Pre-proline 1 N--CA 1.375 -4.185 0 N-CA-C 104.919 -2.252 . . . . 73.44 104.919 175.91 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.415 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 50.8 Cg_endo -66.85 -156.52 0.03 OUTLIER 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 121.296 1.331 . . . . 70.04 112.074 175.115 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.6 m -76.1 38.4 0.17 Allowed 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.194 0.998 . . . . 62.11 112.417 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 -60.08 148.39 77.96 Favored Pre-proline 0 N--CA 1.438 -1.054 0 C-N-CA 125.156 1.382 . . . . 74.52 112.308 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.61 -32.93 97.74 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 123.129 2.553 . . . . 65.11 112.781 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.2 mp0 -68.95 -40.39 78.96 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.591 -0.892 . . . . 62.12 108.591 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 78.1 t -63.59 -48.57 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 CA-C-N 114.191 -1.368 . . . . 74.31 109.234 178.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.446 ' HA ' HE21 ' A' ' 61' ' ' GLN . 46.4 mm -59.81 -46.58 93.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.223 -0.899 . . . . 72.44 110.443 177.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -57.15 -38.8 74.08 Favored 'General case' 0 C--O 1.202 -1.406 0 CA-C-O 119.404 -0.331 . . . . 71.42 111.59 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 46.5 ttt180 -61.39 -40.56 94.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.851 0.834 . . . . 74.34 111.281 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.446 HE21 ' HA ' ' A' ' 58' ' ' ILE . 50.1 mt-30 -67.23 -47.15 71.67 Favored 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.434 -1.257 . . . . 74.31 110.317 -177.676 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.94 -31.04 67.52 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.553 -1.203 . . . . 73.52 111.151 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -54.78 -51.13 66.72 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 124.616 1.166 . . . . 71.42 110.015 176.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -55.14 -31.33 61.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.66 -1.154 . . . . 73.23 113.077 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.8 mt -72.64 -43.73 62.84 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 112.273 0.472 . . . . 64.14 112.273 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -69.96 -25.61 63.72 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.717 -0.846 . . . . 75.55 108.717 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.02 -31.27 68.83 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.338 -0.846 . . . . 73.04 110.832 174.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -68.21 -41.6 81.08 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 109.049 -0.723 . . . . 72.42 109.049 176.078 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.79 142.34 4.79 Favored Glycine 0 N--CA 1.421 -2.328 0 CA-C-N 114.986 -1.006 . . . . 64.24 112.365 -177.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.2 ptm -69.17 -26.57 64.92 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 106.498 -1.667 . . . . 70.21 106.498 170.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.67 -46.9 28.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 113.684 -1.598 . . . . 74.34 108.004 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 84.9 m -53.55 -41.72 66.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.836 0.71 . . . . 75.31 110.339 177.153 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.556 ' O ' HG12 ' A' ' 77' ' ' ILE . 75.9 t-105 -60.17 -49.43 77.67 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.424 -0.807 . . . . 74.23 111.466 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 9.4 ptpt -69.59 -35.02 74.94 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 121.134 0.492 . . . . 74.53 111.479 -174.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.0 m -67.58 -42.45 82.49 Favored 'General case' 0 N--CA 1.405 -2.712 0 CA-C-N 115.632 -0.713 . . . . 71.23 110.361 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.4 -49.62 75.62 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.601 0.761 . . . . 74.44 111.522 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.556 HG12 ' O ' ' A' ' 73' ' ' TRP . 47.2 mm -59.0 -33.87 51.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.466 -0.788 . . . . 74.25 111.852 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.1 -39.02 93.15 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.965 0.412 . . . . 71.32 110.266 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.437 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 2.4 m-20 -74.51 -36.01 63.2 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.942 0.401 . . . . 71.41 110.474 176.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.517 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.0 tm? -54.4 -54.54 39.2 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.715 1.206 . . . . 71.54 110.225 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 29.9 p -66.9 -32.67 74.07 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.81 -0.632 . . . . 75.33 111.394 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -71.27 -54.75 9.79 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.04 -0.982 . . . . 74.24 111.926 -176.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.437 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 19.8 mt-10 -73.31 -22.28 60.37 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 112.52 0.563 . . . . 72.42 112.52 -171.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.9 mt -86.97 -2.26 58.48 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.492 -0.483 . . . . 63.24 111.548 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 t70 72.9 -32.02 0.24 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 114.546 1.313 . . . . 70.52 114.546 174.754 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.439 ' O ' HD22 ' A' ' 88' ' ' LEU . 61.4 t -48.68 124.43 12.24 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 124.367 1.067 . . . . 73.35 111.891 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -80.27 44.01 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.462 2.774 . . . . 75.4 111.696 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.48 HD11 ' CZ3' ' A' ' 21' ' ' TRP . 2.0 pt? -62.88 -48.47 78.83 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.506 -0.315 . . . . 73.31 111.326 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.404 ' N ' ' HG ' ' A' ' 88' ' ' LEU . 48.2 m-20 56.3 31.27 18.25 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.139 0.971 . . . . 65.32 111.856 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.63 ' SD ' ' HB2' ' A' ' 18' ' ' LEU . 50.4 mtt -99.76 13.99 31.78 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.116 -1.068 . . . . 64.13 108.116 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.649 ' O ' HG11 ' A' ' 95' ' ' VAL . 3.3 tt0 -47.14 -60.92 2.15 Favored 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 125.184 1.394 . . . . 73.52 113.35 -174.149 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -64.14 -44.03 75.9 Favored Pre-proline 0 C--O 1.201 -1.48 0 CA-C-N 119.111 0.869 . . . . 74.32 111.717 -178.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -48.37 -35.49 27.98 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 121.476 1.451 . . . . 74.23 111.763 170.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.555 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 3.3 mm? -67.98 -51.97 41.23 Favored 'General case' 0 C--O 1.202 -1.406 0 N-CA-C 109.078 -0.712 . . . . 71.54 109.078 169.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.649 HG11 ' O ' ' A' ' 91' ' ' GLU . 2.7 m -60.44 -37.57 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-O 122.062 0.934 . . . . 73.12 113.204 -171.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.1 t -93.52 6.17 49.11 Favored 'General case' 0 C--N 1.26 -3.312 0 CA-C-N 114.146 -1.388 . . . . 73.33 111.774 -174.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.427 HG22 ' O ' ' A' ' 94' ' ' LEU . 8.3 tt -55.24 -39.73 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 112.833 0.679 . . . . 73.35 112.833 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 43.7 m95 -112.21 163.86 13.86 Favored 'General case' 0 N--CA 1.411 -2.377 0 N-CA-C 107.608 -1.256 . . . . 73.51 107.608 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.51 143.17 10.02 Favored Glycine 0 C--N 1.272 -2.995 0 CA-C-N 115.584 -0.734 . . . . 73.21 111.279 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.31 44.3 1.02 Allowed 'Trans proline' 0 N--CA 1.484 0.944 0 C-N-CA 123.724 2.949 . . . . 73.54 112.495 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 . . . . . 0 N--CA 1.402 -2.835 0 N-CA-C 106.971 -1.492 . . . . 74.04 106.971 -179.673 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.698 0 N-CA-C 111.759 -0.537 . . . . 60.24 111.759 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -57.89 129.11 31.73 Favored 'Trans proline' 0 N--CA 1.479 0.633 0 C-N-CA 123.579 2.852 . . . . 72.4 113.873 -177.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.5 mt -125.62 173.59 8.87 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.935 -0.575 . . . . 73.43 109.89 177.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 78.09 -70.82 2.51 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.931 -0.868 . . . . 73.32 110.931 -176.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 43.3 m -108.86 122.07 46.42 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 107.644 -1.243 . . . . 61.21 107.644 176.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.472 ' O ' ' HG3' ' A' ' 9' ' ' GLU . 2.2 mpt? -118.37 12.38 13.33 Favored 'General case' 0 C--O 1.206 -1.223 0 N-CA-C 111.961 0.356 . . . . 74.23 111.961 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.33 25.33 1.21 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 113.328 0.862 . . . . 73.22 113.328 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.21 -15.7 58.56 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-O 121.821 0.82 . . . . 61.11 108.987 172.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.511 ' CB ' ' HB2' ' A' ' 96' ' ' SER . 0.0 OUTLIER -56.68 -41.36 77.16 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.643 1.177 . . . . 74.24 114.001 -179.251 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.432 ' HB2' HD13 ' A' ' 11' ' ' ILE . 74.7 m -55.06 -36.64 65.81 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 125.058 1.343 . . . . 64.15 110.36 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.472 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -81.73 -29.71 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.969 0 C-N-CA 125.164 1.386 . . . . 75.12 109.672 -175.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -76.6 -64.88 1.02 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.87 -0.604 . . . . 73.53 112.486 -177.243 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -175.42 -75.98 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 110.048 -0.353 . . . . 73.33 110.048 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.6 t30 65.31 109.12 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.377 1.071 . . . . 73.11 111.644 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -172.78 163.4 5.07 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 122.358 -0.214 . . . . 74.23 110.463 -176.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.04 -27.88 35.03 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.519 1.528 . . . . 73.02 111.472 177.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.2 -28.13 62.59 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 112.599 0.592 . . . . 72.41 112.599 177.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.494 HD12 HD22 ' A' ' 94' ' ' LEU . 3.6 mm? -71.1 -34.59 71.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.219 0.533 . . . . 72.1 109.741 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 74.2 t-105 -65.98 -42.34 89.98 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.401 -0.818 . . . . 75.13 110.236 -178.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.72 -42.65 97.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.061 -0.518 . . . . 72.45 110.35 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -59.41 -50.44 73.93 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.103 -0.499 . . . . 74.21 110.531 176.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.421 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -57.3 -53.31 59.61 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.94 0.775 . . . . 75.43 109.551 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.36 -46.96 94.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 112.849 0.685 . . . . 62.55 112.849 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -72.3 -36.79 69.03 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 112.301 0.482 . . . . 72.1 112.301 -174.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.67 -40.8 63.41 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.943 -0.762 . . . . 74.05 108.943 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 3.6 mt -71.36 -24.14 62.04 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 112.656 0.613 . . . . 73.2 112.656 178.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.0 t -62.81 -20.96 65.54 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.275 -1.009 . . . . 73.22 108.275 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -97.46 -0.05 46.8 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.061 0.458 . . . . 75.11 110.218 177.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.426 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.2 m-80 -139.36 54.66 6.22 Favored Pre-proline 0 C--O 1.245 0.825 0 C-N-CA 122.886 0.474 . . . . 73.51 111.352 -177.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.426 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -71.22 -21.66 26.67 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.247 1.298 . . . . 74.3 108.808 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -71.71 -36.61 70.59 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 113.625 -1.625 . . . . 74.42 110.437 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.484 ' CZ2' ' HA ' ' A' ' 80' ' ' LEU . 82.0 t90 -75.0 -48.09 25.85 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 119.518 -0.873 . . . . 73.1 110.016 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.551 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -56.76 -45.65 81.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.822 -1.081 . . . . 70.54 111.172 -172.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.432 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 10.6 p -57.81 -44.93 86.71 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.126 -0.488 . . . . 74.11 112.21 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.87 -44.35 78.03 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 124.106 0.963 . . . . 64.11 111.598 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.51 ' O ' ' HB2' ' A' ' 39' ' ' SER . 70.7 mmtt -71.38 -29.67 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.933 -0.307 . . . . 74.25 111.548 176.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.6 mt -62.7 -36.07 81.74 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 110.263 -0.273 . . . . 73.43 110.263 174.474 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.432 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -63.39 -35.22 79.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.63 0.729 . . . . 75.25 109.769 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.51 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.8 m -71.91 -47.47 52.33 Favored 'General case' 0 N--CA 1.392 -3.374 0 C-N-CA 124.883 1.273 . . . . 71.13 111.902 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.54 ' CD1' HG21 ' A' ' 72' ' ' THR . 52.8 m-85 -84.61 -46.48 11.48 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 114.059 1.133 . . . . 73.14 114.059 -174.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.54 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.9 mm? -95.85 112.83 60.61 Favored Pre-proline 0 N--CA 1.424 -1.739 0 C-N-CA 122.317 0.247 . . . . 74.51 110.423 -175.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.83 -37.9 18.97 Favored 'Trans proline' 0 C--O 1.217 -0.542 0 C-N-CA 122.303 2.002 . . . . 72.44 111.193 178.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.8 t -103.95 30.15 5.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.613 -0.722 . . . . 73.3 110.787 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.464 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -43.61 131.78 5.06 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 115.294 1.59 . . . . 73.0 115.294 178.343 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -124.81 59.77 1.2 Allowed 'General case' 0 C--N 1.276 -2.598 0 CA-C-N 114.499 -1.228 . . . . 73.22 109.198 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.2 pp -84.55 -16.53 41.93 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.336 -1.302 . . . . 74.14 110.079 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.35 -18.14 62.39 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 114.927 -1.033 . . . . 75.51 110.124 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.9 m -80.69 84.4 6.25 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 114.511 -1.222 . . . . 52.21 108.87 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 m -117.19 78.41 1.22 Allowed 'General case' 0 N--CA 1.424 -1.769 0 CA-C-O 121.915 0.864 . . . . 74.04 109.792 -177.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -63.89 1.14 Allowed 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 113.543 -1.662 . . . . 72.32 111.334 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -99.78 162.02 22.49 Favored Pre-proline 1 C--N 1.237 -4.313 0 CA-C-N 113.823 -1.535 . . . . 74.52 109.372 -179.492 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.49 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 17.8 Cg_endo -62.66 -150.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.561 1.84 0 C-N-CA 124.085 3.19 . . . . 73.34 113.154 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.425 ' H ' ' HB2' ' A' ' 52' ' ' PRO . 16.5 m -75.34 37.79 0.13 Allowed 'General case' 0 CA--C 1.572 1.795 0 C-N-CA 123.655 0.782 . . . . 74.42 112.365 -175.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.49 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 6.0 m-20 -65.54 150.25 96.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 C-N-CA 125.926 1.69 . . . . 73.45 112.687 -178.162 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.3 -47.48 27.19 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.717 2.944 . . . . 71.1 113.382 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 70.8 mm-40 -71.76 -25.73 62.15 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 112.971 0.73 . . . . 72.44 112.971 -179.785 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.518 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 95.7 t -66.21 -42.97 92.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.196 0 N-CA-C 108.485 -0.932 . . . . 75.33 108.485 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.422 ' O ' HD22 ' A' ' 62' ' ' LEU . 49.4 mm -67.14 -46.01 85.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.051 -0.977 . . . . 64.0 109.215 175.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -54.22 -40.1 67.34 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.114 0.966 . . . . 72.44 110.981 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -54.98 -55.69 27.99 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.768 0.794 . . . . 73.13 110.712 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.518 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 60.4 mt-30 -62.26 -34.69 77.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.256 -1.338 . . . . 74.45 110.932 -176.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.422 HD22 ' O ' ' A' ' 58' ' ' ILE . 4.3 mm? -77.04 -35.6 56.76 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-N 114.903 -1.044 . . . . 73.5 111.926 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.416 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 0.2 OUTLIER -57.46 -35.88 70.72 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.227 1.011 . . . . 71.03 108.695 177.321 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.54 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 12.5 mmt180 -55.37 -42.72 74.33 Favored 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.486 -1.233 . . . . 72.52 111.534 175.764 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.6 mt -72.22 -33.7 67.77 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.026 0.441 . . . . 73.44 110.085 -179.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.506 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 90.5 t80 -58.34 -31.17 67.33 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.839 -1.073 . . . . 71.41 109.482 174.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.59 -34.19 53.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.445 -0.798 . . . . 73.34 111.54 177.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -67.39 -56.7 8.63 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.116 0.413 . . . . 74.31 112.116 -178.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.67 143.46 5.26 Favored Glycine 0 CA--C 1.474 -2.519 0 C-N-CA 120.005 -1.093 . . . . 71.22 113.299 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.514 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.6 ptt? -70.61 -28.48 64.88 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 107.106 -1.442 . . . . 72.01 107.106 169.794 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.73 -35.78 65.1 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 114.41 -1.268 . . . . 74.23 107.949 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.54 HG21 ' CD1' ' A' ' 40' ' ' PHE . 98.9 m -65.8 -38.9 90.21 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.616 -1.175 . . . . 75.32 109.747 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.45 ' O ' HG12 ' A' ' 77' ' ' ILE . 36.9 t-105 -64.37 -42.11 96.36 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 108.921 -0.77 . . . . 75.41 108.921 177.923 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.534 ' HG2' HG21 ' A' ' 95' ' ' VAL . 93.5 mttt -55.76 -51.78 66.21 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.583 0.353 . . . . 74.22 110.87 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.4 m -61.89 -39.75 93.06 Favored 'General case' 0 N--CA 1.408 -2.539 0 C-N-CA 123.761 0.824 . . . . 70.14 110.719 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -62.8 -52.96 61.15 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.826 -1.079 . . . . 74.24 111.618 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 73' ' ' TRP . 27.0 mm -69.13 -32.07 52.59 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 119.843 -0.743 . . . . 75.24 110.352 -175.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -57.04 -52.15 66.4 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.893 -1.049 . . . . 72.44 108.807 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.441 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 4.7 m-20 -67.42 -38.44 84.6 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 115.312 -0.858 . . . . 70.12 111.648 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.484 ' HA ' ' CZ2' ' A' ' 32' ' ' TRP . 2.6 tm? -51.16 -55.62 16.94 Favored 'General case' 0 C--N 1.311 -1.096 0 C-N-CA 124.711 1.204 . . . . 75.45 110.502 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.553 ' SG ' ' HB3' ' A' ' 91' ' ' GLU . 56.1 m -68.54 -32.93 73.21 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.872 -0.603 . . . . 64.41 111.204 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -70.98 -46.27 62.61 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.557 -0.747 . . . . 75.22 112.048 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.441 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 15.1 mt-10 -83.8 -19.62 34.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 113.175 0.806 . . . . 74.43 113.175 -173.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 72.7 mt -79.93 33.32 0.27 Allowed 'General case' 0 C--O 1.243 0.728 0 N-CA-C 113.145 0.794 . . . . 75.22 113.145 -177.128 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 76.32 -27.12 0.18 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.906 1.682 . . . . 72.11 114.27 171.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.8 p -136.93 105.8 8.85 Favored Pre-proline 0 C--N 1.296 -1.75 0 CA-C-O 120.953 0.406 . . . . 73.2 111.503 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.8 83.7 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.014 1.809 . . . . 70.32 109.675 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.17 -6.96 54.93 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.627 1.343 . . . . 73.23 114.627 -175.853 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.9 t70 54.46 81.19 0.11 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.983 1.475 . . . . 74.14 114.983 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 24.1 ptm -153.11 22.37 0.56 Allowed 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 105.546 -2.02 . . . . 71.11 105.546 172.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.553 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 9.2 pt-20 -70.54 -36.32 73.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 112.77 -2.014 . . . . 64.11 111.512 -173.439 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.531 ' HA ' HG13 ' A' ' 95' ' ' VAL . 47.2 mm -69.39 -49.13 23.98 Favored Pre-proline 0 C--N 1.277 -2.567 0 CA-C-N 115.977 -0.556 . . . . 73.4 110.793 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -50.72 -44.47 40.61 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.091 1.861 . . . . 73.13 111.54 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.494 HD22 HD12 ' A' ' 18' ' ' LEU . 4.2 mm? -62.76 -39.19 93.4 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.642 0.608 . . . . 72.25 112.642 175.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.534 HG21 ' HG2' ' A' ' 74' ' ' LYS . 5.7 p -75.5 -32.64 25.52 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.122 0 CA-C-O 122.131 0.967 . . . . 73.13 113.105 -177.989 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.511 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . 21.9 t -58.67 -20.21 46.19 Favored 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 114.075 -1.42 . . . . 71.15 111.521 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 3.6 tt -67.58 -16.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 116.183 -0.462 . . . . 75.31 111.664 -175.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.506 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 61.4 t90 -60.98 105.5 0.48 Allowed 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.311 -0.626 . . . . 73.51 109.311 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 126.56 89.57 0.72 Allowed Glycine 0 N--CA 1.416 -2.694 0 N-CA-C 110.654 -0.978 . . . . 71.52 110.654 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.72 85.45 1.73 Allowed 'Trans proline' 0 N--CA 1.437 -1.85 0 C-N-CA 122.366 2.044 . . . . 71.14 110.151 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 3.9 ppt_? . . . . . 0 N--CA 1.424 -1.77 0 CA-C-N 114.857 -1.065 . . . . 73.21 110.349 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.467 0 N-CA-C 110.199 -1.16 . . . . 75.23 110.199 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -67.18 151.47 81.21 Favored 'Trans proline' 0 C--O 1.246 0.885 0 C-N-CA 122.911 2.408 . . . . 74.14 111.7 177.192 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.82 101.44 12.82 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.05 0.452 . . . . 75.32 111.093 -176.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.86 -85.01 1.29 Allowed Glycine 0 N--CA 1.436 -1.302 0 C-N-CA 121.04 -0.6 . . . . 75.43 112.364 178.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.2 m -75.74 94.9 3.34 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-O 121.69 0.757 . . . . 72.32 110.39 -178.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.6 ptp -119.91 -6.96 10.02 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 114.587 -1.188 . . . . 74.03 109.135 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.65 71.99 1.43 Allowed 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 126.208 1.803 . . . . 74.34 112.749 -171.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.24 -34.41 49.18 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 114.422 -1.263 . . . . 73.11 110.188 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.508 ' CD ' ' HB3' ' A' ' 96' ' ' SER . 0.0 OUTLIER -57.53 -31.46 66.1 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 124.079 0.951 . . . . 74.4 111.288 -178.036 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.6 m -60.29 -30.14 69.29 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 125.043 1.337 . . . . 73.35 111.089 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.1 mp -87.36 -20.43 7.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 114.512 -1.222 . . . . 74.41 109.824 -176.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.558 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.6 mmm180 -107.38 -66.69 1.01 Allowed 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 112.706 0.632 . . . . 74.52 112.706 -177.005 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 12' ' ' ARG . 11.4 mt 170.63 173.84 0.07 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.089 1.756 . . . . 75.34 110.562 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.7 p30 -160.19 170.29 21.47 Favored 'General case' 0 C--O 1.252 1.231 0 N-CA-C 107.208 -1.404 . . . . 75.02 107.208 172.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -160.45 167.86 26.37 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 118.096 0.407 . . . . 73.42 110.839 -176.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.59 -28.07 12.99 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 126.073 1.749 . . . . 72.45 112.717 178.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -57.03 -29.33 63.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.588 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -65.33 -43.15 91.87 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.185 0.517 . . . . 62.23 110.362 177.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -69.22 -46.44 67.38 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.305 -0.861 . . . . 75.2 110.706 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.79 97.97 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 71.01 111.443 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 -56.48 -49.31 75.03 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.025 -0.534 . . . . 71.43 110.537 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.8 -53.29 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 123.834 0.709 . . . . 74.45 110.211 -178.398 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.14 -50.3 78.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 112.612 0.597 . . . . 75.44 112.612 -176.521 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 5.1 tpm_? -72.65 -33.73 66.8 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.973 -0.291 . . . . 75.42 110.54 -175.044 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.81 -44.88 69.12 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.548 -0.908 . . . . 64.33 108.548 -179.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.425 HD11 HD22 ' A' ' 33' ' ' LEU . 3.6 mt -71.44 -24.48 62.03 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.604 -0.725 . . . . 55.55 112.118 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 p -67.81 -15.67 63.74 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 108.766 -0.827 . . . . 75.35 108.766 177.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 34.6 mtmt -97.39 -4.1 39.02 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 121.729 0.776 . . . . 75.22 109.39 179.154 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.452 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.1 m-80 -138.78 54.92 7.12 Favored Pre-proline 0 C--O 1.243 0.73 0 CA-C-N 115.128 -0.942 . . . . 65.23 110.638 -176.077 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.452 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 9.2 Cg_exo -72.29 -21.22 23.49 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 121.437 1.425 . . . . 64.15 108.698 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -71.68 -39.76 70.04 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 114.224 -1.353 . . . . 70.35 109.944 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.597 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 72.2 t90 -74.2 -42.7 59.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.242 -0.983 . . . . 74.01 109.823 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.458 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.2 tm? -62.93 -44.57 95.7 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.074 -0.966 . . . . 75.01 110.654 -174.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.535 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 15.8 p -57.89 -47.68 82.07 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.652 0.263 . . . . 73.3 111.524 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.63 67.98 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 124.315 1.046 . . . . 71.0 111.468 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.597 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 32.8 mmmt -72.09 -32.82 67.37 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 120.642 -0.423 . . . . 73.12 111.058 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.458 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.3 mt -61.88 -32.9 73.3 Favored 'General case' 0 C--O 1.191 -1.976 0 N-CA-C 109.894 -0.41 . . . . 72.22 109.894 174.366 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.535 ' HG3' ' O ' ' A' ' 34' ' ' SER . 39.8 mtt180 -64.67 -28.64 69.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.08 0.467 . . . . 75.25 110.885 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.6 t -84.72 -41.38 16.28 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.463 -0.79 . . . . 74.34 110.563 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.525 ' CD1' HG21 ' A' ' 72' ' ' THR . 66.7 m-85 -82.22 -46.24 13.99 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.781 0.66 . . . . 75.04 112.781 -177.711 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.426 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 7.0 mp -88.6 120.49 70.26 Favored Pre-proline 0 C--N 1.305 -1.345 0 C-N-CA 124.02 0.928 . . . . 75.14 110.107 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.14 -24.39 12.64 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 121.914 1.743 . . . . 75.32 111.113 177.308 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.4 p -114.97 28.51 8.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 123.809 0.844 . . . . 71.42 110.945 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.46 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.4 98.81 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.693 1.368 . . . . 73.22 114.693 -174.95 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -103.33 72.87 1.18 Allowed 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.899 1.333 . . . . 65.03 107.44 176.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 pp -96.14 -12.5 24.64 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 113.375 -1.738 . . . . 62.05 113.538 -173.129 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -83.4 -11.15 57.91 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.468 0.651 . . . . 74.24 111.131 -174.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.6 t -72.78 106.75 4.87 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 115.023 -0.989 . . . . 71.24 109.216 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.8 p -139.23 87.13 2.17 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.913 0.863 . . . . 70.3 112.001 -177.217 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.32 -25.85 60.81 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.645 -1.161 . . . . 71.42 112.116 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -129.63 161.86 56.64 Favored Pre-proline 0 N--CA 1.381 -3.889 0 CA-C-N 113.629 -1.623 . . . . 62.54 107.446 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -68.37 -148.85 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.928 2.419 . . . . 74.33 111.617 173.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.1 m -75.27 37.86 0.13 Allowed 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 124.419 1.088 . . . . 60.21 112.705 -175.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.406 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 7.3 m-20 -58.05 147.04 66.72 Favored Pre-proline 0 N--CA 1.436 -1.166 0 C-N-CA 125.025 1.33 . . . . 73.02 111.27 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -53.35 -34.9 72.82 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 123.892 3.062 . . . . 74.41 112.377 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -73.23 -39.95 65.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.79 -0.641 . . . . 75.33 109.341 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.406 ' CG2' ' HB2' ' A' ' 54' ' ' ASN . 96.3 t -67.46 -44.69 86.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.618 -1.174 . . . . 75.11 109.248 -178.598 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.417 ' O ' HD22 ' A' ' 62' ' ' LEU . 46.3 mm -63.44 -43.45 98.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.457 -0.792 . . . . 73.34 109.669 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.416 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 12.8 t-160 -58.13 -37.28 74.32 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 116.229 -0.442 . . . . 75.31 111.128 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.94 -44.84 96.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.315 0.578 . . . . 74.33 111.109 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.4 ' OE1' HD12 ' A' ' 33' ' ' LEU . 70.3 mt-30 -64.52 -47.08 80.2 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.144 -0.935 . . . . 63.43 110.115 -178.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.417 HD22 ' O ' ' A' ' 58' ' ' ILE . 4.3 mm? -68.83 -30.77 69.39 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.326 -1.306 . . . . 63.53 111.656 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.416 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 4.7 t30 -61.26 -37.39 82.96 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 123.853 0.861 . . . . 74.21 109.62 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -59.37 -31.36 69.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.868 -1.06 . . . . 75.53 112.041 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.18 -43.73 64.11 Favored 'General case' 0 CA--C 1.501 -0.916 0 N-CA-C 109.635 -0.506 . . . . 73.52 109.635 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -61.04 -39.54 90.2 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.409 -0.96 . . . . 74.22 108.409 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.42 66.12 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.918 -1.037 . . . . 74.42 111.957 177.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.1 mm-40 -81.45 -50.24 9.67 Favored 'General case' 0 N--CA 1.415 -2.175 0 N-CA-C 108.605 -0.887 . . . . 73.01 108.605 173.819 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.421 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -179.02 143.23 5.69 Favored Glycine 0 CA--C 1.477 -2.29 0 CA-C-N 115.508 -0.769 . . . . 75.22 112.563 -175.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -26.77 64.01 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 106.772 -1.566 . . . . 74.41 106.772 170.256 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.39 -36.96 68.8 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.121 -1.4 . . . . 72.34 108.201 174.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.525 HG21 ' CD1' ' A' ' 40' ' ' PHE . 53.0 m -62.39 -33.94 75.74 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.916 -1.038 . . . . 73.31 110.733 177.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -66.48 -38.58 87.62 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.323 -0.621 . . . . 74.4 109.323 178.152 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.618 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 8.8 mtmt -68.31 -32.23 72.21 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 113.205 0.817 . . . . 73.23 113.205 176.64 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.3 m -68.33 -38.15 81.26 Favored 'General case' 0 N--CA 1.402 -2.837 0 CA-C-O 121.953 0.882 . . . . 74.43 109.063 171.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -65.52 -53.84 36.66 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 114.365 -1.289 . . . . 62.23 112.966 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -64.04 -32.14 56.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.993 0 CA-C-N 118.611 0.642 . . . . 74.23 111.245 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.15 -42.39 99.21 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.4 -0.818 . . . . 72.11 109.331 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.474 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 83.1 m-20 -74.94 -41.19 60.12 Favored 'General case' 0 C--O 1.193 -1.878 0 CA-C-N 115.959 -0.564 . . . . 75.43 111.175 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.427 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.4 tm? -50.12 -53.98 23.71 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 125.454 1.502 . . . . 72.0 110.505 -179.204 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.402 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 50.8 t -66.76 -34.43 77.82 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.207 -0.906 . . . . 64.5 110.702 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -75.75 -50.19 15.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.333 -0.849 . . . . 74.03 112.381 -175.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.474 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 36.1 mt-10 -75.32 -28.36 59.62 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 112.196 0.443 . . . . 71.01 112.196 -173.039 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.8 mt -85.16 -13.64 49.48 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.261 -0.644 . . . . 72.04 109.261 176.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.7 t70 54.01 57.84 5.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.261 1.424 . . . . 74.12 110.743 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 6.0 m -134.52 108.09 11.05 Favored Pre-proline 0 C--N 1.301 -1.529 0 CA-C-N 114.012 -1.449 . . . . 61.55 109.392 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -63.43 111.0 1.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.279 1.986 . . . . 74.12 109.66 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.402 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 41.2 mt -82.91 -39.8 21.02 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.852 -0.739 . . . . 74.14 109.272 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 62.19 12.25 4.98 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.228 1.011 . . . . 74.51 110.688 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 18.8 ttt -157.25 34.26 0.28 Allowed 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 106.949 -1.5 . . . . 75.05 106.949 -176.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.97 -34.5 71.48 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-N 114.458 -1.246 . . . . 74.01 109.632 -179.041 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.512 ' HA ' HG12 ' A' ' 95' ' ' VAL . 49.0 mm -63.35 -50.5 73.93 Favored Pre-proline 0 C--N 1.288 -2.074 0 CA-C-N 115.319 -0.855 . . . . 60.53 111.989 -177.304 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.464 ' HA ' ' OE1' ' A' ' 9' ' ' GLU . 50.4 Cg_exo -58.7 -24.38 70.7 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 121.782 1.654 . . . . 70.44 111.756 172.303 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -74.4 -31.95 62.52 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.898 -1.149 . . . . 75.43 107.898 177.409 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.618 ' CG2' ' HA ' ' A' ' 74' ' ' LYS . 9.0 p -88.2 -46.72 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.949 0 N-CA-C 113.949 1.092 . . . . 75.01 113.949 -178.361 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.508 ' HB3' ' CD ' ' A' ' 9' ' ' GLU . 4.0 t -78.73 3.44 16.56 Favored 'General case' 0 C--N 1.27 -2.871 0 CA-C-N 115.627 -0.715 . . . . 65.42 110.846 -175.439 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.427 HG22 ' CD1' ' A' ' 98' ' ' TRP . 17.2 tt -56.81 -40.01 68.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.347 0.659 . . . . 75.24 109.952 176.765 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.427 ' CD1' HG22 ' A' ' 97' ' ' ILE . 46.6 m95 -127.49 14.11 7.08 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.924 -0.769 . . . . 75.41 108.924 178.208 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -92.71 -134.69 6.87 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.695 -0.684 . . . . 71.33 112.341 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -71.71 153.2 59.41 Favored 'Trans proline' 0 C--N 1.328 -0.509 0 C-N-CA 122.87 2.38 . . . . 75.53 111.835 177.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 . . . . . 0 N--CA 1.426 -1.633 0 N-CA-C 108.063 -1.088 . . . . 74.21 108.063 178.018 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.444 0 N-CA-C 110.593 -1.003 . . . . 65.02 110.593 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -86.0 1.5 7.9 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.383 2.055 . . . . 74.31 113.458 -178.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.6 mp 65.34 93.05 0.07 Allowed 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.155 0.982 . . . . 74.41 111.509 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.57 -46.1 4.72 Favored Glycine 0 N--CA 1.436 -1.301 0 N-CA-C 110.902 -0.879 . . . . 74.22 110.902 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.4 m -85.14 91.14 8.04 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.881 -0.785 . . . . 61.42 108.881 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 53.1 tpp -89.68 -13.48 36.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.785 0.803 . . . . 75.13 110.639 -174.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.08 24.99 12.34 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.729 -0.669 . . . . 62.11 109.674 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.49 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.64 -9.54 59.42 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 114.966 -1.015 . . . . 61.33 109.768 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.22 -44.34 95.25 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.4 1.08 . . . . 72.31 112.173 -179.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 75.2 m -54.48 -31.73 56.4 Favored 'General case' 0 C--N 1.288 -2.108 0 C-N-CA 125.354 1.462 . . . . 72.21 111.302 174.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.49 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -85.13 -38.2 12.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 C-N-CA 125.026 1.331 . . . . 75.04 110.367 -174.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.74 -38.41 28.76 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.996 0.739 . . . . 73.22 112.996 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.5 mt 61.51 -175.27 0.13 Allowed 'General case' 0 C--O 1.242 0.679 0 C-N-CA 124.38 1.072 . . . . 71.34 113.221 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.492 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 9.7 p30 -125.02 -177.79 3.97 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.84 -0.537 . . . . 73.13 111.562 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.529 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.7 t30 -154.39 153.11 31.05 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.382 -0.97 . . . . 74.14 108.382 -174.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -69.79 -34.53 73.87 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.146 0.43 . . . . 72.21 112.002 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -62.05 -35.95 80.14 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 122.122 0.963 . . . . 75.43 109.041 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.529 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 7.3 tt -65.84 -39.06 90.45 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.34 -1.755 . . . . 74.43 110.062 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 20.8 t-105 -71.42 -46.71 59.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.78 0.324 . . . . 65.42 110.245 174.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.01 -40.86 74.03 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-N 115.857 -0.611 . . . . 74.4 110.884 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -53.04 -50.44 64.3 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 124.134 0.896 . . . . 73.05 110.847 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mt -66.49 -45.15 80.61 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 112.741 0.645 . . . . 63.42 112.741 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -51.71 -53.73 15.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 123.738 0.649 . . . . 70.31 111.467 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -73.13 -33.7 65.67 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 112.13 0.418 . . . . 75.5 112.13 -176.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -73.67 -46.5 46.13 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 73.32 109.598 -177.229 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.415 HD22 ' N ' ' A' ' 26' ' ' LEU . 0.7 OUTLIER -66.24 -25.36 66.86 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 123.679 0.792 . . . . 74.33 110.553 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.437 ' OG ' ' HB3' ' A' ' 53' ' ' SER . 57.7 m -72.58 -10.17 59.47 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.256 0.55 . . . . 72.13 110.838 176.879 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 70.9 mttt -98.44 -11.43 22.36 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 108.31 -0.996 . . . . 74.33 108.31 177.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.469 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 47.5 m-80 -132.44 51.35 7.03 Favored Pre-proline 0 N--CA 1.436 -1.169 0 CA-C-N 114.499 -1.228 . . . . 55.15 110.822 -175.088 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.469 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 2.8 Cg_exo -72.75 -19.37 24.09 Favored 'Trans proline' 0 C--N 1.361 1.191 0 N-CA-C 108.65 -1.327 . . . . 70.24 108.65 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -74.89 -37.23 62.18 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 114.189 -1.369 . . . . 72.11 109.641 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -73.21 -42.97 62.03 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.467 -0.893 . . . . 75.3 109.002 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -59.32 -47.16 86.45 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.616 -1.175 . . . . 74.24 110.226 -176.25 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.1 p -62.27 -38.44 89.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.686 0.279 . . . . 70.1 111.478 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.49 96.75 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.045 0.538 . . . . 72.44 111.272 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 42.9 mmtt -74.52 -52.41 11.99 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 112.6 0.592 . . . . 73.32 112.6 177.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.7 mp -53.41 -31.22 44.1 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 113.999 1.111 . . . . 73.11 113.999 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.582 ' HB2' ' SD ' ' A' ' 44' ' ' MET . 31.5 ptt180 -66.69 -30.84 71.18 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.394 0.887 . . . . 74.05 113.394 179.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 t -72.88 -31.99 65.07 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.495 0.664 . . . . 70.41 109.704 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.537 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.2 m-85 -83.11 -58.61 2.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.706 -0.679 . . . . 75.35 111.497 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mp -72.52 121.69 85.52 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 123.977 0.911 . . . . 75.32 110.439 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.56 -33.73 21.57 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 122.562 2.174 . . . . 75.42 112.617 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 p -94.07 -5.48 47.29 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.206 -0.452 . . . . 65.25 110.609 -178.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.582 ' SD ' ' HB2' ' A' ' 38' ' ' ARG . 8.9 mtt 36.48 91.51 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 127.643 2.377 . . . . 75.42 112.309 -175.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -101.92 72.87 1.37 Allowed 'General case' 0 C--N 1.287 -2.116 0 CA-C-O 122.485 1.136 . . . . 74.31 108.852 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.7 mt -92.55 -40.32 10.86 Favored 'General case' 0 CA--C 1.487 -1.464 0 CA-C-N 112.945 -1.934 . . . . 73.42 107.633 -175.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.14 3.35 10.77 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 112.948 -1.933 . . . . 75.43 110.994 -176.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.04 -15.29 63.63 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 125.039 1.336 . . . . 71.12 111.429 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.8 m -75.85 69.28 2.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.657 0.741 . . . . 74.45 111.895 -179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.47 -9.05 57.03 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.128 0.965 . . . . 73.51 111.609 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.63 ' OE2' HG23 ' A' ' 57' ' ' VAL . 2.6 pt-20 -111.09 160.23 29.76 Favored Pre-proline 0 C--N 1.28 -2.42 0 CA-C-N 114.323 -1.308 . . . . 75.43 109.075 175.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -62.37 -170.74 0.09 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.874 2.382 . . . . 74.31 113.696 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.437 ' HB3' ' OG ' ' A' ' 27' ' ' SER . 13.2 m -76.46 36.91 0.16 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 115.169 -0.923 . . . . 74.23 112.005 -175.06 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.41 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 5.1 m-20 -68.39 147.55 98.18 Favored Pre-proline 0 N--CA 1.434 -1.275 0 O-C-N 122.253 -0.28 . . . . 75.54 110.955 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -56.51 -40.1 86.84 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.206 2.604 . . . . 74.34 113.275 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -74.92 -24.08 58.45 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.114 0.483 . . . . 65.55 110.731 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.63 HG23 ' OE2' ' A' ' 51' ' ' GLU . 89.8 t -69.96 -47.68 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 107.871 -1.159 . . . . 72.31 107.871 175.894 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -61.03 -45.36 98.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 114.23 -1.35 . . . . 71.13 109.725 177.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -55.2 -39.73 69.95 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.823 0.849 . . . . 73.45 111.633 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.35 -41.52 97.19 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.728 0.811 . . . . 72.54 111.365 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -71.81 -43.87 64.89 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.145 -0.934 . . . . 63.51 110.374 -176.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.406 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -72.41 -29.91 64.15 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.827 -1.079 . . . . 75.11 111.47 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -53.27 -42.17 66.26 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 75.45 110.335 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.2 mmt85 -55.04 -32.87 62.21 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.653 -1.158 . . . . 75.4 112.707 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.3 mt -72.35 -39.24 68.24 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 120.604 0.24 . . . . 65.2 110.81 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -64.38 -37.67 88.34 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.636 -0.876 . . . . 73.42 108.636 174.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.01 -28.25 69.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.668 -1.151 . . . . 74.41 111.439 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 9.7 mm-40 -74.56 -57.49 3.9 Favored 'General case' 0 N--CA 1.409 -2.491 0 N-CA-C 107.772 -1.196 . . . . 72.32 107.772 174.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . 0.443 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -170.5 142.42 7.14 Favored Glycine 0 CA--C 1.466 -3.005 0 CA-C-N 114.917 -1.038 . . . . 54.32 112.369 -175.302 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.584 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.6 tpp -67.14 -33.11 74.73 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.378 -1.712 . . . . 64.34 106.378 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.95 -37.31 84.05 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 114.594 -1.184 . . . . 52.31 108.483 176.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.537 HG23 ' CD1' ' A' ' 40' ' ' PHE . 99.2 m -61.9 -42.63 99.3 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.677 -1.147 . . . . 72.44 110.442 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.487 ' NE1' ' HA ' ' A' ' 95' ' ' VAL . 70.0 t-105 -67.32 -41.23 85.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 110.345 -0.243 . . . . 75.02 110.345 179.067 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 70' ' ' MET . 73.5 mttt -56.99 -39.52 74.81 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.391 0.615 . . . . 74.22 111.278 175.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.7 m -70.95 -44.15 66.67 Favored 'General case' 0 N--CA 1.4 -2.936 0 CA-C-N 115.663 -0.698 . . . . 74.24 110.015 177.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.31 -46.12 89.45 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 123.868 0.867 . . . . 52.3 112.475 -178.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.578 HG22 ' O ' ' A' ' 91' ' ' GLU . 43.7 mm -66.34 -31.17 52.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.155 0 C-N-CA 119.223 -0.991 . . . . 72.11 111.611 -176.472 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -64.76 -40.78 95.85 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.514 -0.55 . . . . 75.01 109.514 174.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -65.19 -42.16 93.85 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 116.459 -0.337 . . . . 73.15 110.322 175.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.455 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -51.97 -55.02 23.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.839 1.256 . . . . 74.05 109.585 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 26.0 p -67.89 -40.46 83.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.279 0.474 . . . . 71.03 112.279 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -63.56 -54.33 37.78 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 123.389 0.676 . . . . 71.44 110.504 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -72.84 -37.12 67.55 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 113.915 1.08 . . . . 74.32 113.915 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 89.3 mt -85.2 -31.92 22.94 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.976 -0.69 . . . . 72.32 111.985 -177.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -146.36 -100.55 0.09 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.268 -0.973 . . . . 71.22 111.924 -178.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.404 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 76.3 t -141.16 151.44 61.84 Favored Pre-proline 0 C--N 1.307 -1.279 0 N-CA-C 106.853 -1.536 . . . . 74.33 106.853 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -51.31 108.05 0.21 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 121.846 1.697 . . . . 74.45 108.93 168.016 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.404 ' HG ' ' O ' ' A' ' 86' ' ' VAL . 86.7 mt -90.95 -22.89 20.63 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 113.973 1.101 . . . . 74.55 113.973 -168.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.98 17.2 9.58 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 123.665 1.698 . . . . 72.23 108.82 -172.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.452 ' O ' HD21 ' A' ' 94' ' ' LEU . 63.8 mtt -120.13 12.92 11.98 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 113.434 -1.712 . . . . 75.32 107.479 175.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.578 ' O ' HG22 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -71.41 -36.14 71.25 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.313 -0.858 . . . . 74.32 111.002 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.583 ' HA ' HG12 ' A' ' 95' ' ' VAL . 35.7 mm -61.18 -46.46 95.81 Favored Pre-proline 0 C--N 1.287 -2.137 0 CA-C-N 115.648 -0.706 . . . . 71.51 112.275 -178.345 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.438 ' HD2' ' C ' ' A' ' 90' ' ' MET . 76.3 Cg_exo -51.49 -38.57 64.37 Favored 'Trans proline' 0 C--N 1.359 1.113 0 C-N-CA 122.232 1.955 . . . . 63.35 112.134 170.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.452 HD21 ' O ' ' A' ' 90' ' ' MET . 4.5 mm? -72.04 -33.28 67.88 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.809 -0.632 . . . . 74.22 111.564 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.583 HG12 ' HA ' ' A' ' 92' ' ' ILE . 3.3 p -78.25 -29.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 122.395 1.093 . . . . 75.12 112.147 177.623 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.6 t -73.24 4.28 4.73 Favored 'General case' 0 C--N 1.259 -3.336 0 CA-C-N 113.899 -1.5 . . . . 74.33 111.665 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.492 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 14.5 tt -64.33 -28.85 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 75.15 111.197 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -92.7 94.88 9.24 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 105.054 -2.202 . . . . 74.52 105.054 171.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -37.17 107.8 0.06 OUTLIER Glycine 0 N--CA 1.461 0.3 0 O-C-N 125.176 1.548 . . . . 71.04 116.399 -171.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -99.99 36.43 0.08 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.382 0 C-N-CA 123.592 2.861 . . . . 73.15 110.033 175.254 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 . . . . . 0 N--CA 1.419 -1.994 0 CA-C-N 114.513 -1.221 . . . . 75.14 108.609 -177.898 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.34 0 N-CA-C 110.544 -1.023 . . . . 54.21 110.544 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -64.32 -37.65 39.0 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.338 2.692 . . . . 74.24 114.417 -176.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 pp -87.92 139.14 30.82 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 113.389 0.885 . . . . 74.44 113.389 -175.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -136.32 -79.06 0.09 OUTLIER Glycine 0 N--CA 1.434 -1.443 0 CA-C-N 115.977 -0.556 . . . . 62.41 112.02 -178.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.527 ' O ' HG13 ' A' ' 92' ' ' ILE . 49.2 m 61.57 84.47 0.13 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-O 122.128 0.966 . . . . 64.34 110.441 -177.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -79.56 4.13 16.76 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 114.073 1.138 . . . . 70.54 114.073 -170.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -110.14 23.79 13.85 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.297 -0.961 . . . . 75.43 111.131 177.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.99 -14.56 59.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.8 0.81 . . . . 64.33 109.776 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.427 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.5 OUTLIER -65.13 -33.01 74.99 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.033 -0.985 . . . . 74.22 113.175 -178.588 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.9 t -61.78 -37.31 83.88 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.949 0.881 . . . . 73.14 109.897 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.444 ' H ' HD12 ' A' ' 11' ' ' ILE . 2.9 mp -87.5 -43.77 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 114.625 -1.171 . . . . 73.23 112.415 -177.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.5 mmt180 -81.94 -30.78 31.59 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.028 0.751 . . . . 72.51 113.028 -175.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 64.82 133.39 0.02 OUTLIER 'General case' 0 C--O 1.247 0.952 0 C-N-CA 125.976 1.711 . . . . 75.4 115.374 -178.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -72.89 156.3 39.02 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 115.495 -0.775 . . . . 73.2 108.938 175.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -157.76 143.39 17.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.092 -1.077 . . . . 74.44 108.092 -174.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -52.84 -28.51 23.19 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.304 1.041 . . . . 74.32 111.442 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -56.63 -39.6 73.92 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.124 0.969 . . . . 63.44 110.158 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 34.1 mt -70.67 -36.71 73.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.779 -1.101 . . . . 72.45 110.551 -175.264 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -69.44 -42.22 75.23 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.408 -0.59 . . . . 75.15 109.408 177.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.04 -48.19 82.93 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.503 -0.317 . . . . 71.05 110.222 177.746 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 2.3 t-105 -54.5 -50.28 68.18 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.782 -0.645 . . . . 75.4 110.77 175.246 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.47 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -59.79 -53.05 62.5 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 123.74 0.65 . . . . 62.35 109.286 -177.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.4 t -56.48 -50.57 72.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 116.233 -0.439 . . . . 75.02 112.131 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.49 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 97.3 mtt180 -69.63 -41.56 75.48 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.285 0.476 . . . . 73.42 112.285 -174.067 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.57 -42.91 86.34 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.262 -0.644 . . . . 75.33 109.262 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.531 HD22 ' N ' ' A' ' 26' ' ' LEU . 0.4 OUTLIER -70.34 -25.1 63.13 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.961 -0.563 . . . . 71.0 110.437 -179.255 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.9 m -71.56 -18.9 62.22 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.287 -0.634 . . . . 73.05 109.287 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.49 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 40.3 mtmt -91.84 1.37 57.22 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.814 0.816 . . . . 75.45 109.188 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -141.03 55.64 5.65 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 114.81 -1.086 . . . . 73.24 110.267 -178.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -67.98 -26.01 37.86 Favored 'Trans proline' 0 C--N 1.363 1.34 0 C-N-CA 121.389 1.393 . . . . 63.45 108.986 -176.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -66.85 -42.07 86.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-N 113.55 -1.659 . . . . 72.32 110.131 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.581 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 80.1 t90 -74.57 -45.47 45.13 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 119.809 -0.757 . . . . 74.12 109.664 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.628 ' O ' HD12 ' A' ' 37' ' ' LEU . 2.9 tm? -57.4 -52.52 65.02 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.392 -1.276 . . . . 73.23 110.537 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.409 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 12.9 p -54.28 -42.59 70.21 Favored 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 112.371 0.508 . . . . 65.21 112.371 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.65 86.91 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 124.254 1.021 . . . . 73.22 112.447 177.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.581 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.2 mmmt -72.13 -31.26 65.83 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.891 0.377 . . . . 75.43 110.394 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.628 HD12 ' O ' ' A' ' 33' ' ' LEU . 5.2 mp -61.49 -31.08 71.05 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 122.679 0.392 . . . . 73.51 111.701 173.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 34' ' ' SER . 28.6 mtm180 -66.23 -35.4 80.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.986 0.898 . . . . 71.03 109.537 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 50.2 m -75.47 -36.07 60.74 Favored 'General case' 0 N--CA 1.399 -3.0 0 C-N-CA 125.734 1.614 . . . . 73.35 112.648 -178.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.576 ' CD1' HG22 ' A' ' 72' ' ' THR . 66.1 m-85 -94.51 -47.43 6.55 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 113.192 0.812 . . . . 74.03 113.192 -178.555 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.601 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.0 OUTLIER -101.0 115.92 64.66 Favored Pre-proline 0 N--CA 1.436 -1.157 0 O-C-N 122.315 -0.241 . . . . 70.43 110.699 -176.146 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.14 -25.61 9.97 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.823 1.682 . . . . 71.21 111.248 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . 0.491 HG23 ' O ' ' A' ' 43' ' ' THR . 15.5 m -99.12 23.89 8.53 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.511 1.148 . . . . 75.51 110.875 -174.227 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.484 ' HE2' ' HA ' ' A' ' 44' ' ' MET . 4.0 tpt -74.95 104.19 5.45 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 113.846 1.054 . . . . 70.3 113.846 -176.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -94.01 77.02 4.12 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 106.369 -1.715 . . . . 74.44 106.369 170.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 pp -89.22 -17.49 28.96 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.165 -1.38 . . . . 74.31 112.305 -174.358 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -72.39 -18.43 61.73 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.532 0.682 . . . . 74.53 111.73 -175.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.7 m -100.74 95.03 6.38 Favored 'General case' 0 C--N 1.276 -2.595 0 CA-C-N 115.649 -0.705 . . . . 75.1 110.625 -176.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.8 m -91.76 95.39 9.84 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.547 0.689 . . . . 75.31 109.669 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.21 -48.44 81.48 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.864 -1.062 . . . . 75.2 110.939 176.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -116.97 164.62 18.02 Favored Pre-proline 0 C--N 1.245 -3.936 0 CA-C-N 113.281 -1.781 . . . . 72.22 106.877 176.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.8 -150.87 0.04 OUTLIER 'Trans proline' 0 CA--C 1.553 1.453 0 C-N-CA 122.221 1.948 . . . . 75.23 110.812 174.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -75.47 38.08 0.14 Allowed 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 124.189 0.996 . . . . 72.44 112.334 -176.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.17 146.81 91.91 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 123.637 0.775 . . . . 74.42 111.019 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.21 -27.92 78.89 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.724 2.283 . . . . 64.5 111.933 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -68.74 -40.28 79.94 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.533 -0.914 . . . . 75.24 108.533 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.486 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 58.4 t -66.47 -50.36 67.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.717 -1.129 . . . . 73.3 109.042 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.451 ' O ' HD22 ' A' ' 62' ' ' LEU . 47.3 mm -55.15 -39.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-N 114.792 -1.094 . . . . 72.42 109.776 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.569 ' CE1' ' HG3' ' A' ' 100' ' ' PRO . 57.0 t-80 -61.89 -28.98 69.9 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.604 -0.725 . . . . 63.32 111.461 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -74.22 -40.75 62.24 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 122.317 1.056 . . . . 74.43 108.251 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.486 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 41.1 mt-30 -70.25 -43.88 69.61 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 113.555 -1.657 . . . . 73.25 110.534 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.451 HD22 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -73.42 -30.5 63.27 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.875 -1.057 . . . . 73.15 111.232 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.494 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 0.2 OUTLIER -56.42 -43.37 79.34 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.467 1.107 . . . . 71.35 108.858 175.449 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.601 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 34.0 mmt180 -58.48 -37.01 74.63 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.758 -1.11 . . . . 74.33 112.343 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 88.5 mt -71.82 -44.68 63.48 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 116.552 -0.295 . . . . 73.41 111.571 -177.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -67.38 -27.77 67.38 Favored 'General case' 0 C--O 1.245 0.851 0 N-CA-C 108.851 -0.796 . . . . 73.11 108.851 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.24 81.0 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.245 -0.889 . . . . 73.53 110.709 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.484 HE21 HD12 ' A' ' 41' ' ' LEU . 48.9 mm-40 -60.4 -47.94 83.89 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.054 -0.721 . . . . 73.12 109.054 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.81 141.02 5.43 Favored Glycine 0 N--CA 1.403 -3.539 0 CA-C-N 114.772 -1.104 . . . . 72.23 111.143 -178.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.615 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 21.7 ptp -69.67 -26.61 64.47 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.025 -1.843 . . . . 72.14 106.025 169.662 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.5 67.01 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.37 -1.286 . . . . 74.12 108.262 173.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.576 HG22 ' CD1' ' A' ' 40' ' ' PHE . 81.2 m -55.39 -40.82 71.85 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 123.399 0.68 . . . . 72.33 110.129 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.434 ' CZ3' HD11 ' A' ' 62' ' ' LEU . 73.5 t-105 -61.26 -49.29 77.68 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 115.765 -0.652 . . . . 72.22 110.247 176.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.615 ' HG3' ' O ' ' A' ' 70' ' ' MET . 91.5 mttt -55.82 -42.48 75.75 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.959 0.409 . . . . 71.44 110.754 176.525 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 42.3 m -65.88 -44.93 83.88 Favored 'General case' 0 N--CA 1.406 -2.636 0 C-N-CA 123.334 0.654 . . . . 75.11 110.773 179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -58.33 -49.52 76.9 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.718 -0.673 . . . . 74.13 111.006 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.49 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 49.5 mm -64.47 -38.31 82.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 O-C-N 123.349 0.406 . . . . 74.44 110.738 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -69.67 -32.93 71.85 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.198 0.523 . . . . 74.34 110.781 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 67.9 m-20 -74.01 -39.61 63.48 Favored 'General case' 0 C--O 1.193 -1.875 0 C-N-CA 119.867 -0.733 . . . . 70.25 110.163 171.983 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.49 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.8 tm? -50.76 -53.96 27.38 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.924 1.29 . . . . 70.24 111.073 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 25.3 p -63.29 -33.7 76.08 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.623 -0.717 . . . . 75.43 111.662 -178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -73.47 -54.35 8.46 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 123.554 0.742 . . . . 74.43 111.129 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 42.3 mt-10 -68.61 -36.73 79.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.396 -0.82 . . . . 62.35 112.814 -172.047 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.6 -10.24 44.06 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.936 -0.706 . . . . 73.23 110.032 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.5 t70 55.95 69.48 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.194 0.998 . . . . 63.01 110.219 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -132.88 129.08 21.01 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 115.082 -0.963 . . . . 74.12 110.666 -177.524 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -75.89 109.55 2.91 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.115 1.877 . . . . 74.43 110.076 176.412 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 65.9 mt -86.05 -31.1 22.14 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 120.175 -0.61 . . . . 71.22 109.634 -179.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.7 t70 71.31 -49.68 0.68 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.854 1.261 . . . . 65.41 111.559 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.467 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . 20.6 ptp -116.43 68.56 0.73 Allowed 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.098 0.951 . . . . 74.11 108.55 175.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.534 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 36.2 tt0 -70.36 -46.04 64.9 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.354 -1.293 . . . . 72.45 112.13 -172.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.575 ' O ' HG23 ' A' ' 95' ' ' VAL . 44.4 mm -64.43 -42.8 68.88 Favored Pre-proline 0 C--O 1.175 -2.852 0 C-N-CA 123.358 0.663 . . . . 72.2 111.034 -178.04 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.467 ' HG2' ' HB2' ' A' ' 90' ' ' MET . 3.1 Cg_exo -48.37 -33.33 22.35 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.937 1.758 . . . . 72.21 112.89 167.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.534 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 4.5 mm? -68.32 -44.06 76.23 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 108.952 -0.759 . . . . 64.55 108.952 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.575 HG23 ' O ' ' A' ' 92' ' ' ILE . 2.8 m -63.77 -34.47 68.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.278 0 CA-C-O 123.051 1.405 . . . . 72.31 110.712 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.3 m -89.21 7.23 36.45 Favored 'General case' 0 C--N 1.274 -2.713 0 C-N-CA 127.667 2.387 . . . . 53.25 113.453 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.5 tp -60.91 -24.95 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.078 0.551 . . . . 74.05 111.598 -176.081 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 23.9 m0 52.83 85.45 0.05 OUTLIER 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 124.961 1.304 . . . . 75.13 112.278 -174.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -85.29 -174.05 49.98 Favored Glycine 0 N--CA 1.432 -1.579 0 CA-C-N 115.361 -0.836 . . . . 72.01 111.277 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.569 ' HG3' ' CE1' ' A' ' 59' ' ' HIS . 92.9 Cg_endo -79.65 159.11 25.16 Favored 'Trans proline' 0 C--N 1.319 -0.974 0 C-N-CA 122.311 2.008 . . . . 75.4 111.8 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 . . . . . 0 N--CA 1.412 -2.34 0 N-CA-C 108.758 -0.83 . . . . 71.52 108.758 178.674 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.516 0 N-CA-C 110.85 -0.9 . . . . 72.2 110.85 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -71.79 112.5 3.4 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.962 2.441 . . . . 71.15 113.01 -178.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.1 mt -117.27 -4.66 11.36 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.727 -0.67 . . . . 75.12 109.843 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 94.63 85.08 1.65 Allowed Glycine 0 N--CA 1.428 -1.842 0 N-CA-C 108.676 -1.769 . . . . 75.01 108.676 -175.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . 0.262 44.4 p 66.7 123.1 0.02 OUTLIER 'General case' 0 C--O 1.249 1.044 0 C-N-CA 126.558 1.943 . . . . 73.11 113.335 -174.924 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 28.5 ttt -79.49 80.95 5.81 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 122.913 1.34 . . . . 73.35 109.531 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.52 ' O ' HD12 ' A' ' 11' ' ' ILE . 28.7 t70 -161.85 25.12 0.12 Allowed 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 112.119 -2.31 . . . . 73.14 108.175 -177.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.94 -31.94 64.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.9 1.333 . . . . 61.02 107.468 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.8 pm0 -55.93 -38.88 70.89 Favored 'General case' 0 N--CA 1.422 -1.858 0 CA-C-N 112.768 -2.014 . . . . 73.51 112.216 175.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -66.92 -26.74 67.0 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.779 0.799 . . . . 73.34 111.19 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.52 HD12 ' O ' ' A' ' 7' ' ' ASP . 1.0 OUTLIER -83.51 -24.91 7.85 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.836 0 CA-C-N 115.143 -0.935 . . . . 75.02 110.453 -175.296 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.47 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 38.2 mmt180 -84.68 -65.03 1.06 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.373 -0.376 . . . . 73.23 110.19 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 41.5 mt 50.83 166.08 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 117.196 2.295 . . . . 71.24 117.196 -179.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.6 t30 51.46 87.61 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.907 1.683 . . . . 53.45 113.231 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.477 ' HB3' HD22 ' A' ' 18' ' ' LEU . 46.7 m-80 -125.32 89.86 3.12 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.893 -0.594 . . . . 74.41 110.942 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.82 -39.24 69.94 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.251 -0.431 . . . . 74.21 111.63 -177.719 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.02 -34.07 76.78 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.274 0.559 . . . . 74.43 110.127 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.477 HD22 ' HB3' ' A' ' 15' ' ' ASN . 4.6 mm? -67.12 -37.99 84.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.167 -0.924 . . . . 72.34 110.914 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.4 t-105 -66.24 -46.76 76.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.348 -0.387 . . . . 74.31 110.307 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.77 -32.54 74.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.005 -0.543 . . . . 64.24 111.133 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -67.74 -50.17 58.66 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.347 -0.612 . . . . 74.34 109.347 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.1 -52.77 63.1 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.727 0.811 . . . . 63.45 110.077 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.3 t -57.51 -48.62 82.6 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 C-N-CA 122.898 0.479 . . . . 75.44 111.575 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -72.3 -31.68 65.92 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.271 -0.422 . . . . 71.34 111.483 -175.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -72.98 -43.97 61.62 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 107.964 -1.124 . . . . 61.24 107.964 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.8 mt -73.43 -24.23 60.22 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 113.304 0.853 . . . . 74.11 113.304 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . 0.45 ' HA ' ' HB3' ' A' ' 53' ' ' SER . 53.2 p -59.15 -22.04 60.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.515 0.674 . . . . 73.11 109.792 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.6 mtmt -92.43 -15.2 27.48 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.483 -0.781 . . . . 73.22 109.522 -178.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -133.96 51.5 6.6 Favored Pre-proline 0 C--O 1.242 0.701 0 CA-C-N 114.902 -1.044 . . . . 61.23 111.849 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.38 -22.31 29.42 Favored 'Trans proline' 0 C--N 1.366 1.49 0 N-CA-C 108.939 -1.216 . . . . 75.22 108.939 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -66.71 -39.62 88.1 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-N 113.352 -1.749 . . . . 73.13 110.09 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.564 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 70.6 t90 -74.34 -45.49 46.9 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 119.605 -0.838 . . . . 73.43 109.378 178.272 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.587 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 3.1 tm? -59.05 -49.52 77.57 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.61 -1.177 . . . . 73.54 110.947 -174.269 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.455 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 21.1 p -58.94 -45.27 90.85 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.029 0.381 . . . . 63.2 112.029 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.95 70.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.109 0.964 . . . . 62.0 111.416 176.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.51 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 26.3 mmmt -72.56 -35.8 68.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.99 -0.284 . . . . 75.52 110.668 178.794 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.587 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.4 mt -59.41 -31.13 68.98 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.969 -0.56 . . . . 74.24 110.855 177.084 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.455 ' HG3' ' O ' ' A' ' 34' ' ' SER . 59.7 mtp180 -61.5 -34.82 76.14 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.04 -0.527 . . . . 72.33 112.234 -176.707 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -87.58 -38.97 15.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.273 -0.421 . . . . 65.41 110.476 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.443 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 76.4 m-85 -73.85 -47.89 35.1 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.066 0.765 . . . . 74.45 113.066 -178.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.515 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.5 mm? -102.43 112.54 65.65 Favored Pre-proline 0 N--CA 1.432 -1.34 0 CA-C-O 120.758 0.313 . . . . 73.25 110.957 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -81.15 3.06 8.11 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.511 2.141 . . . . 74.03 111.373 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 27.6 p -111.53 -2.0 15.64 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.061 -0.972 . . . . 75.43 111.193 -177.295 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.492 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 36.9 tpp -65.22 110.07 2.44 Favored 'General case' 0 N--CA 1.413 -2.315 0 N-CA-C 115.489 1.663 . . . . 74.32 115.489 -174.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -108.79 82.92 1.68 Allowed 'General case' 0 N--CA 1.428 -1.532 0 N-CA-C 105.243 -2.132 . . . . 73.41 105.243 165.307 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.492 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 4.6 pp -81.75 5.01 19.88 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-N 114.58 -1.191 . . . . 74.41 111.486 -173.158 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -80.34 -9.35 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.999 -1.0 . . . . 63.45 111.452 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.3 p -89.35 77.59 7.36 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.966 0.889 . . . . 74.04 111.931 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.5 m -95.02 83.07 3.87 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.315 -0.857 . . . . 72.53 109.217 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -22.96 57.84 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.74 1.257 . . . . 74.14 111.846 178.441 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -137.03 161.6 60.48 Favored Pre-proline 1 N--CA 1.374 -4.273 0 N-CA-C 105.678 -1.971 . . . . 72.35 105.678 178.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.423 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.1 Cg_exo -69.57 -143.47 0.02 OUTLIER 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 122.975 2.45 . . . . 73.25 110.923 175.102 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . 0.45 ' HB3' ' HA ' ' A' ' 27' ' ' SER . 13.0 m -80.59 38.33 0.43 Allowed 'General case' 0 C--N 1.293 -1.853 0 CA-C-O 122.18 0.99 . . . . 65.01 110.66 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.423 ' H ' ' C ' ' A' ' 52' ' ' PRO . 6.7 m-20 -62.35 151.41 82.41 Favored Pre-proline 0 C--N 1.317 -0.823 0 C-N-CA 126.298 1.839 . . . . 75.13 112.802 -178.169 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -54.07 -43.45 58.17 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 124.011 3.141 . . . . 71.22 114.158 -175.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -73.86 -31.52 63.21 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-O 120.65 0.262 . . . . 75.35 110.372 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -63.7 -52.1 61.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.356 -0.979 . . . . 73.13 108.356 176.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.469 ' O ' HD22 ' A' ' 62' ' ' LEU . 46.0 mm -56.97 -41.44 77.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.708 -1.133 . . . . 75.4 109.259 176.727 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.492 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 48.7 t-80 -58.92 -36.46 74.76 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-N 115.74 -0.664 . . . . 74.22 112.092 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -64.21 -44.42 92.01 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 108.118 -1.067 . . . . 73.32 108.118 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -67.39 -47.47 70.22 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.208 -1.814 . . . . 74.43 110.885 -172.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.469 HD22 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -74.17 -32.04 62.94 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 114.321 -1.309 . . . . 74.33 111.453 -177.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 67.1 t30 -63.16 -44.62 94.95 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.95 0.881 . . . . 72.34 109.847 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.515 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 19.0 mmt180 -57.56 -29.82 64.72 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.193 -1.367 . . . . 72.52 112.943 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.46 -39.18 85.3 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.658 0.266 . . . . 71.25 110.981 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.522 ' CG ' ' HD2' ' A' ' 100' ' ' PRO . 37.9 t80 -70.96 -29.8 65.91 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.566 -0.901 . . . . 74.43 108.566 178.442 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -19.94 65.1 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.738 -0.664 . . . . 71.42 110.529 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -79.84 -49.09 12.47 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 108.517 -0.92 . . . . 71.25 108.517 173.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.44 141.61 6.52 Favored Glycine 0 CA--C 1.479 -2.179 0 CA-C-N 115.001 -0.999 . . . . 71.02 111.526 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.512 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 59.5 ttp -67.74 -29.5 68.74 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.15 -1.796 . . . . 74.35 106.15 171.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.92 -32.95 34.48 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 113.707 -1.588 . . . . 72.11 109.026 177.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.414 HG23 ' CD1' ' A' ' 40' ' ' PHE . 98.7 m -60.4 -38.56 84.35 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.254 -0.647 . . . . 72.32 109.254 175.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.582 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.2 t-105 -61.57 -54.2 46.24 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 123.609 0.568 . . . . 75.54 109.739 175.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 70' ' ' MET . 85.9 mttt -53.97 -45.25 71.31 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.146 0.578 . . . . 72.33 111.935 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -65.34 -45.74 83.0 Favored 'General case' 0 N--CA 1.408 -2.558 0 C-N-CA 123.095 0.558 . . . . 74.44 111.104 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.446 ' HZ ' ' CD2' ' A' ' 33' ' ' LEU . 81.0 t80 -57.49 -45.36 84.99 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.555 -0.748 . . . . 75.43 110.739 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.545 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 49.2 mm -63.5 -33.11 59.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 116.103 -0.499 . . . . 72.12 111.347 -178.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -66.16 -42.61 88.75 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.627 -0.829 . . . . 73.51 109.368 175.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -64.12 -38.23 90.3 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 120.731 0.3 . . . . 64.42 110.427 175.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.564 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.6 tm? -53.66 -55.56 24.96 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 124.66 1.184 . . . . 74.03 109.863 177.985 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 87' ' ' PRO . 26.8 p -68.53 -40.24 80.84 Favored 'General case' 0 N--CA 1.42 -1.948 0 CA-C-N 116.15 -0.477 . . . . 72.21 111.674 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -65.86 -48.04 72.89 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.856 -0.611 . . . . 73.54 112.558 -174.668 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -80.69 -26.89 37.24 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.126 -0.63 . . . . 73.33 112.06 -174.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.3 mt -85.97 -37.39 19.05 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 120.442 -0.503 . . . . 74.55 111.098 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -148.82 -100.3 0.08 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 121.042 -0.263 . . . . 72.32 110.969 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -141.19 164.21 37.07 Favored Pre-proline 0 C--N 1.314 -0.962 0 N-CA-C 108.108 -1.071 . . . . 73.32 108.108 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.482 ' HA ' ' SG ' ' A' ' 81' ' ' CYS . 50.1 Cg_exo -57.8 114.89 2.16 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.898 1.732 . . . . 72.5 108.18 170.96 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.62 -19.09 29.84 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 113.304 0.853 . . . . 73.34 113.304 -169.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 78.7 -0.1 2.47 Favored 'General case' 0 N--CA 1.506 2.339 0 CA-C-O 123.542 1.639 . . . . 73.42 108.401 -173.149 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.443 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 27.8 ttt -105.75 6.26 31.65 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 113.157 -1.838 . . . . 75.44 108.071 -179.372 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.646 ' O ' HG11 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -66.73 -46.53 75.18 Favored 'General case' 0 C--O 1.199 -1.601 0 CA-C-N 116.128 -0.487 . . . . 74.24 111.884 -178.808 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.453 ' O ' HG21 ' A' ' 95' ' ' VAL . 39.9 mm -59.09 -44.57 98.88 Favored Pre-proline 0 C--O 1.185 -2.332 0 CA-C-O 118.646 -0.693 . . . . 75.41 110.081 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.443 ' HD2' ' C ' ' A' ' 90' ' ' MET . 52.5 Cg_exo -47.63 -42.41 29.64 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 121.994 1.796 . . . . 73.33 112.342 169.539 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.435 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 4.4 mm? -67.01 -39.84 87.15 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.976 0.417 . . . . 73.11 110.616 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.646 HG11 ' O ' ' A' ' 91' ' ' GLU . 2.9 m -68.19 -29.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 122.824 1.297 . . . . 73.43 110.895 -178.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.47 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 24.5 t -82.92 5.13 22.93 Favored 'General case' 0 C--N 1.276 -2.629 0 C-N-CA 127.274 2.23 . . . . 75.44 111.68 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.435 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 17.3 tt -50.21 -48.16 24.54 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 113.439 0.903 . . . . 74.42 113.439 -173.207 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 4.1 p90 175.52 173.88 0.28 Allowed 'General case' 0 CA--C 1.499 -0.981 0 C-N-CA 126.339 1.856 . . . . 74.44 107.031 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -130.29 103.62 0.58 Allowed Glycine 0 N--CA 1.418 -2.543 0 C-N-CA 120.029 -1.081 . . . . 63.24 111.991 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.522 ' HD2' ' CG ' ' A' ' 66' ' ' PHE . 26.0 Cg_exo -69.65 50.86 0.82 Allowed 'Trans proline' 0 CA--C 1.554 1.481 0 C-N-CA 123.739 2.959 . . . . 74.44 111.72 174.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 . . . . . 0 N--CA 1.412 -2.335 0 N-CA-C 107.583 -1.265 . . . . 71.41 107.583 -179.683 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.647 0 N-CA-C 109.692 -1.363 . . . . 75.04 109.692 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -66.58 129.61 21.62 Favored 'Trans proline' 0 C--O 1.244 0.79 0 C-N-CA 122.118 1.879 . . . . 73.43 109.833 176.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.9 tp -142.0 166.04 25.79 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 108.392 -0.966 . . . . 74.44 108.392 -177.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.74 34.77 4.22 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.72 -0.752 . . . . 72.13 111.641 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.5 m -149.82 165.15 33.37 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.335 -0.987 . . . . 55.45 108.335 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -112.32 38.0 2.85 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.493 -0.929 . . . . 74.03 108.493 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.413 ' O ' HD13 ' A' ' 11' ' ' ILE . 3.2 m-20 -105.12 25.71 10.23 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.266 0.839 . . . . 64.33 113.266 -174.572 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.2 -9.18 58.62 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 122.482 1.134 . . . . 72.12 109.778 175.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.469 ' HB3' ' OG ' ' A' ' 96' ' ' SER . 0.0 OUTLIER -69.19 -30.42 68.6 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.005 -1.452 . . . . 73.12 112.267 179.178 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.455 ' HB2' HD11 ' A' ' 11' ' ' ILE . 70.6 m -66.78 -32.45 73.75 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 122.271 1.034 . . . . 64.44 109.443 177.722 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.455 HD11 ' HB2' ' A' ' 10' ' ' SER . 1.0 OUTLIER -84.38 -51.45 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.364 0 CA-C-N 113.888 -1.506 . . . . 73.32 110.918 -173.538 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -112.72 -6.92 13.84 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 115.003 1.483 . . . . 71.43 115.003 -173.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 53.29 -92.62 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.062 0.945 . . . . 75.44 113.18 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.454 ' OD1' ' HA ' ' A' ' 100' ' ' PRO . 7.8 p30 -170.37 170.55 7.03 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 124.513 1.125 . . . . 73.52 108.053 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 46.8 t30 -152.67 152.58 31.91 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.08 -38.79 92.58 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 123.752 0.821 . . . . 75.4 111.076 -177.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -61.3 -29.28 69.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.29 -0.414 . . . . 72.41 111.811 -178.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.558 HD23 ' SD ' ' A' ' 90' ' ' MET . 83.4 mt -65.81 -44.93 84.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.491 -0.559 . . . . 72.35 109.491 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 61.3 t-105 -69.48 -36.88 76.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.48 -0.782 . . . . 74.54 109.842 179.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.35 -44.09 88.8 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 116.215 -0.448 . . . . 54.52 111.249 178.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.528 ' CH2' ' HG ' ' A' ' 25' ' ' LEU . 70.1 t90 -60.76 -48.13 83.18 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.684 -0.858 . . . . 71.13 108.684 176.806 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.42 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -54.4 -53.22 56.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.93 -1.032 . . . . 73.42 109.294 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.0 t -60.13 -44.66 95.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 112.407 0.521 . . . . 75.44 112.407 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.427 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 42.2 ttm180 -69.95 -45.28 67.78 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 120.596 -0.441 . . . . 75.33 111.029 -176.754 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.528 ' HG ' ' CH2' ' A' ' 21' ' ' TRP . 2.7 tm? -67.82 -40.32 83.8 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.917 -0.401 . . . . 75.4 109.917 -175.645 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.42 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 6.8 mt -71.0 -25.59 62.75 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 120.957 0.408 . . . . 73.04 111.804 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.0 t -68.93 -17.35 63.94 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.606 -0.887 . . . . 73.23 108.606 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 30.1 mtmt -101.66 -2.63 29.91 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.733 -0.667 . . . . 74.44 110.02 177.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -135.53 57.62 20.66 Favored Pre-proline 0 C--O 1.243 0.756 0 CA-C-N 116.139 -0.482 . . . . 71.43 111.185 -178.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -67.98 -28.47 35.37 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 121.307 1.338 . . . . 74.44 108.774 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.88 -44.27 96.55 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-N 113.16 -1.836 . . . . 75.42 110.624 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.506 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 78.2 t90 -74.85 -45.84 40.4 Favored 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 119.92 -0.712 . . . . 75.02 110.055 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.459 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.6 tm? -60.32 -47.14 87.3 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.536 -1.211 . . . . 72.04 111.104 -173.903 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.576 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 50.1 m -57.43 -48.77 78.24 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 123.191 0.307 . . . . 75.42 111.222 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.02 -39.56 69.24 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.19 0.996 . . . . 71.22 111.854 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.7 mmmt -73.0 -33.25 65.68 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.784 -0.366 . . . . 70.33 111.091 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.459 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.2 mt -62.01 -32.46 72.94 Favored 'General case' 0 C--O 1.183 -2.401 0 N-CA-C 109.986 -0.375 . . . . 74.42 109.986 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 34' ' ' SER . 67.6 mtt180 -63.21 -30.47 71.61 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.13 0.491 . . . . 74.33 111.482 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 t -87.47 -35.72 18.07 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 115.48 -0.782 . . . . 73.55 110.536 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.694 ' CD1' HG22 ' A' ' 72' ' ' THR . 56.9 m-85 -86.64 -49.14 7.73 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 113.009 0.744 . . . . 73.32 113.009 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.6 mp -88.99 114.08 58.7 Favored Pre-proline 0 C--N 1.3 -1.561 0 C-N-CA 123.834 0.854 . . . . 73.31 109.228 179.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.97 -32.38 13.66 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.678 1.585 . . . . 74.43 110.333 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.4 m -105.59 29.13 6.81 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 115.22 -0.9 . . . . 70.21 109.472 -177.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.437 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -44.89 101.49 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.965 1.306 . . . . 71.2 114.311 -174.497 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.45 72.8 6.05 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.333 1.063 . . . . 75.12 108.775 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 pp -96.52 -16.12 21.28 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.327 -1.306 . . . . 74.41 112.192 -178.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -87.12 -1.88 58.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.797 0.808 . . . . 75.53 111.796 -173.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.02 73.59 1.25 Allowed 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.461 -0.495 . . . . 73.34 110.656 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.1 m -101.32 83.97 2.55 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-O 121.595 0.712 . . . . 72.32 109.666 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -30.41 70.66 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 114.715 -1.129 . . . . 73.04 112.172 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -120.74 169.5 8.7 Favored Pre-proline 1 N--CA 1.377 -4.078 0 N-CA-C 106.337 -1.727 . . . . 62.32 106.337 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -81.12 -151.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.804 1.669 . . . . 74.31 110.869 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.5 m -76.47 38.74 0.19 Allowed 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 124.29 1.036 . . . . 74.55 112.607 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -65.88 151.62 94.76 Favored Pre-proline 0 N--CA 1.447 -0.599 0 C-N-CA 123.472 0.709 . . . . 72.24 112.152 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.9 -42.01 60.19 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 123.866 3.044 . . . . 73.35 114.369 -176.795 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -74.35 -27.9 60.89 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 120.792 0.33 . . . . 74.1 110.9 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 95.0 t -69.84 -47.19 71.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 107.937 -1.134 . . . . 74.2 107.937 177.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.459 ' O ' HD21 ' A' ' 62' ' ' LEU . 45.9 mm -58.91 -47.66 88.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.557 -1.202 . . . . 74.52 109.507 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.427 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 13.1 t-80 -54.89 -37.54 66.43 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.548 -0.751 . . . . 74.22 111.594 -179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -60.61 -48.1 83.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.607 0.718 . . . . 71.23 110.887 177.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -66.21 -45.05 82.09 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.675 -1.148 . . . . 74.34 110.712 -176.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.459 HD21 ' O ' ' A' ' 58' ' ' ILE . 3.8 mm? -74.18 -31.17 62.57 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.385 -1.28 . . . . 74.02 111.454 -176.506 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.427 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 52.6 t30 -60.51 -42.42 96.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.716 0.769 . . . . 70.33 109.693 177.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -60.03 -31.02 69.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.605 -1.18 . . . . 73.24 112.69 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.23 -44.54 71.8 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 110.011 -0.366 . . . . 73.32 110.011 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.745 -0.661 . . . . 74.31 109.307 176.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.12 -29.73 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.436 -0.802 . . . . 75.2 111.651 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.402 ' HB2' HG21 ' A' ' 72' ' ' THR . 35.2 mm-40 -68.86 -45.71 70.35 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 121.437 0.637 . . . . 63.33 109.366 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -174.42 142.1 6.23 Favored Glycine 0 N--CA 1.408 -3.185 0 CA-C-N 115.051 -0.977 . . . . 73.23 111.643 -175.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.451 ' O ' ' HZ3' ' A' ' 98' ' ' TRP . 0.0 OUTLIER -67.5 -30.18 69.8 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 105.843 -1.91 . . . . 62.34 105.843 170.396 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.93 -35.33 64.59 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.866 -1.515 . . . . 73.34 108.824 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.694 HG22 ' CD1' ' A' ' 40' ' ' PHE . 54.1 m -59.18 -45.52 90.82 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 115.434 -0.803 . . . . 70.01 110.654 175.577 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.498 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 66.2 t-105 -66.47 -38.61 87.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 121.095 -0.242 . . . . 73.21 110.457 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.54 ' HG2' HG21 ' A' ' 95' ' ' VAL . 89.1 mttt -56.7 -48.76 76.97 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.264 0.554 . . . . 75.04 110.603 174.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 47.2 m -62.79 -42.27 99.63 Favored 'General case' 0 N--CA 1.4 -2.969 0 CA-C-N 114.771 -1.104 . . . . 74.11 110.455 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.81 -47.98 82.64 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 115.012 -0.994 . . . . 73.23 111.69 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.4 HG23 ' O ' ' A' ' 91' ' ' GLU . 49.7 mm -65.55 -34.75 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 119.551 -0.86 . . . . 75.12 110.903 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -63.95 -37.7 88.37 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.022 -0.535 . . . . 73.33 110.272 177.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.495 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 84.2 m-20 -74.37 -42.62 59.04 Favored 'General case' 0 C--O 1.192 -1.96 0 CA-C-N 116.517 -0.31 . . . . 71.52 110.731 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -50.13 -53.99 23.75 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.518 1.527 . . . . 64.42 109.947 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 45.0 t -66.59 -32.12 73.26 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.693 -0.685 . . . . 71.11 110.958 -179.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -76.19 -55.13 5.86 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.892 -0.595 . . . . 74.15 111.631 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.495 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 21.4 mt-10 -75.33 -25.26 57.66 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 113.132 0.79 . . . . 71.21 113.132 -170.078 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.421 HD12 HD12 ' A' ' 25' ' ' LEU . 94.4 mt -88.0 12.14 14.13 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.857 0.688 . . . . 73.2 112.857 -176.721 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.8 t70 72.58 -54.75 0.69 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.675 1.19 . . . . 65.13 113.428 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.62 116.34 39.6 Favored Pre-proline 0 C--N 1.308 -1.197 0 C-N-CA 123.129 0.572 . . . . 73.33 111.302 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -82.96 80.76 2.57 Favored 'Trans proline' 0 N--CA 1.43 -2.242 0 C-N-CA 121.674 1.583 . . . . 74.01 110.786 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.483 HD23 ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -67.57 -25.65 65.9 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.653 -0.703 . . . . 73.1 111.864 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.483 ' O ' HD23 ' A' ' 88' ' ' LEU . 9.4 t70 63.06 -164.14 0.26 Allowed 'General case' 0 CA--C 1.551 0.993 0 O-C-N 124.303 1.002 . . . . 74.14 109.13 175.013 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.558 ' SD ' HD23 ' A' ' 18' ' ' LEU . 41.3 ttm 60.4 34.01 20.65 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 123.085 1.422 . . . . 74.1 108.363 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.4 ' O ' HG23 ' A' ' 77' ' ' ILE . 35.2 tt0 -53.75 -44.99 70.44 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.46 2.304 . . . . 64.41 112.703 -174.409 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.552 ' HA ' ' CG1' ' A' ' 95' ' ' VAL . 41.5 mm -71.33 -50.33 11.12 Favored Pre-proline 0 C--O 1.197 -1.658 0 CA-C-O 118.701 -0.666 . . . . 71.02 111.774 -177.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.423 ' HB2' ' HG2' ' A' ' 90' ' ' MET . 47.3 Cg_exo -51.8 -34.21 53.8 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 121.524 1.482 . . . . 71.23 112.147 169.267 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.438 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 3.6 mm? -65.14 -42.66 93.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.743 0.306 . . . . 74.22 110.897 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.552 ' CG1' ' HA ' ' A' ' 92' ' ' ILE . 2.5 p -70.51 -36.5 66.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 122.39 1.09 . . . . 73.42 111.54 176.017 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.469 ' OG ' ' HB3' ' A' ' 9' ' ' GLU . 69.7 m -71.21 5.91 1.94 Allowed 'General case' 0 C--N 1.251 -3.709 0 CA-C-N 114.26 -1.336 . . . . 71.22 113.61 176.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.438 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 4.0 tp -67.83 -18.95 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 123.95 0.9 . . . . 74.45 109.288 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.451 ' HZ3' ' O ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -56.35 -18.04 9.67 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.617 1.167 . . . . 73.24 113.833 -176.627 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -136.38 80.36 0.3 Allowed Glycine 0 N--CA 1.427 -1.912 0 N-CA-C 109.782 -1.327 . . . . 71.11 109.782 175.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.454 ' HA ' ' OD1' ' A' ' 14' ' ' ASN . 94.7 Cg_endo -85.47 40.83 0.83 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.225 2.617 . . . . 74.53 110.442 -177.213 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 . . . . . 0 C--N 1.288 -2.103 0 CA-C-N 114.323 -1.308 . . . . 74.41 108.403 -176.778 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.494 -1.262 0 N-CA-C 110.697 -0.961 . . . . 71.53 110.697 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -68.85 112.1 2.81 Favored 'Trans proline' 0 C--O 1.238 0.498 0 C-N-CA 122.874 2.382 . . . . 73.12 111.74 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -92.22 -26.22 18.28 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 109.547 -0.538 . . . . 71.12 109.547 178.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 120.52 100.91 1.81 Allowed Glycine 0 N--CA 1.431 -1.668 0 N-CA-C 111.077 -0.809 . . . . 71.41 111.077 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.5 m 69.11 178.51 0.25 Allowed 'General case' 0 C--O 1.247 0.942 0 C-N-CA 124.358 1.063 . . . . 71.0 112.344 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 31.5 tpp -84.48 -16.86 40.98 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-O 121.531 0.682 . . . . 72.24 109.26 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -87.84 23.7 1.96 Allowed 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.773 -0.649 . . . . 71.34 111.433 -176.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -79.24 -21.24 46.46 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 122.066 0.936 . . . . 73.01 109.21 174.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.422 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.8 OUTLIER -60.85 -30.53 70.18 Favored 'General case' 0 C--O 1.202 -1.407 0 CA-C-N 114.232 -1.349 . . . . 74.21 112.955 -179.26 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.456 ' HB2' HD13 ' A' ' 11' ' ' ILE . 65.9 m -58.22 -38.68 77.28 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 122.186 0.993 . . . . 71.51 110.141 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.456 HD13 ' HB2' ' A' ' 10' ' ' SER . 1.2 mp -79.74 -37.21 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.855 0 CA-C-N 113.413 -1.721 . . . . 72.55 109.94 -175.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -89.84 -4.56 57.52 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.979 -0.555 . . . . 63.53 111.201 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.4 mt 65.88 140.41 0.03 OUTLIER 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.532 1.933 . . . . 73.33 115.207 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -83.64 81.76 8.61 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.597 -2.371 . . . . 75.01 104.597 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 25.5 t-20 -103.95 154.7 19.35 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-N 115.568 -0.742 . . . . 74.33 111.998 -171.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -52.85 -29.04 25.75 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.917 1.687 . . . . 62.44 111.607 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -57.7 -42.51 83.87 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.738 0.815 . . . . 74.25 110.365 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.41 ' HB2' HD11 ' A' ' 97' ' ' ILE . 3.0 mm? -67.01 -40.09 87.21 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.882 -0.599 . . . . 64.41 109.835 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -66.86 -47.51 71.67 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.287 -0.87 . . . . 75.3 109.731 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.14 -37.18 86.53 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.25 -0.432 . . . . 75.41 111.543 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -64.1 -50.45 68.24 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 110.27 -0.271 . . . . 74.2 110.27 175.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.445 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 40.7 tp -60.31 -53.01 62.7 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.721 -0.672 . . . . 73.23 110.166 -178.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.0 t -58.93 -42.17 85.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 C-N-CA 123.299 0.64 . . . . 72.04 112.592 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.42 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 52.5 ttt180 -70.98 -45.36 64.17 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.019 -0.672 . . . . 74.41 110.73 -176.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -66.25 -39.65 89.65 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.181 -0.674 . . . . 75.52 109.181 -177.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.445 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 7.9 mt -72.14 -25.48 61.73 Favored 'General case' 0 C--N 1.307 -1.283 0 N-CA-C 112.817 0.673 . . . . 73.35 112.817 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -68.13 -21.67 64.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.245 -1.02 . . . . 73.25 108.245 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.42 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 29.5 mtmt -92.26 -5.72 51.83 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.531 0.681 . . . . 74.11 109.948 178.361 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.442 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.4 m-80 -135.65 53.81 9.14 Favored Pre-proline 0 C--O 1.242 0.693 0 CA-C-N 115.403 -0.817 . . . . 61.43 112.06 -177.202 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.7 Cg_exo -68.96 -22.28 36.05 Favored 'Trans proline' 0 C--N 1.36 1.165 0 N-CA-C 108.881 -1.238 . . . . 73.34 108.881 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -67.55 -44.87 77.23 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 113.717 -1.583 . . . . 72.33 110.006 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.438 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 66.3 t90 -74.9 -44.9 46.24 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 119.708 -0.797 . . . . 75.52 110.062 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.551 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -58.01 -48.02 81.3 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.464 -1.244 . . . . 70.15 111.452 -173.175 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.657 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 19.6 p -54.5 -53.44 54.39 Favored 'General case' 0 C--O 1.21 -1.009 0 O-C-N 123.673 0.608 . . . . 75.24 111.791 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.61 -40.9 63.18 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.528 1.131 . . . . 72.12 112.687 176.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 39' ' ' SER . 31.3 mmmt -74.07 -30.51 62.41 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 120.288 -0.565 . . . . 75.41 111.543 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.635 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 95.4 mt -62.32 -37.95 87.56 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 108.836 -0.801 . . . . 74.33 108.836 172.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.657 ' HG3' ' O ' ' A' ' 34' ' ' SER . 74.7 mtp180 -62.54 -31.34 72.1 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.41 0.624 . . . . 72.43 111.199 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.49 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 39.4 m -73.07 -33.92 65.94 Favored 'General case' 0 N--CA 1.401 -2.897 0 C-N-CA 125.014 1.326 . . . . 72.43 111.814 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.613 ' CD1' HG22 ' A' ' 72' ' ' THR . 60.7 m-85 -95.93 -51.38 4.48 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.661 -0.7 . . . . 74.22 112.589 -176.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.525 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -96.71 111.26 56.78 Favored Pre-proline 0 N--CA 1.429 -1.522 0 N-CA-C 108.581 -0.896 . . . . 71.22 108.581 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.61 -11.93 16.9 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.582 2.188 . . . . 72.53 112.615 -177.219 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.5 p -114.34 29.52 7.96 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 123.619 0.768 . . . . 73.14 112.161 -176.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.657 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -47.51 111.51 0.43 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 115.222 1.564 . . . . 75.55 115.222 -175.624 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.48 65.83 0.69 Allowed 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 104.758 -2.312 . . . . 73.31 104.758 170.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.657 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.9 pp -91.96 -17.28 25.38 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.628 -1.624 . . . . 71.12 111.341 -171.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.0 -9.08 54.01 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.352 -0.84 . . . . 73.34 112.112 -174.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.0 m -80.15 89.13 5.42 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 115.484 -0.78 . . . . 71.24 112.17 -177.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -111.82 82.87 1.69 Allowed 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.6 -0.889 . . . . 74.4 108.6 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.86 -46.2 90.45 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 122.449 1.118 . . . . 65.44 111.708 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.475 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 53.9 mm-40 -101.26 168.92 8.43 Favored Pre-proline 0 C--N 1.244 -3.996 0 N-CA-C 105.469 -2.049 . . . . 64.24 105.469 175.135 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.422 ' C ' ' H ' ' A' ' 54' ' ' ASN . 23.4 Cg_exo -67.51 -144.33 0.02 OUTLIER 'Trans proline' 0 CA--C 1.551 1.354 0 C-N-CA 122.616 2.211 . . . . 75.24 112.826 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -76.12 36.87 0.15 Allowed 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.079 0.952 . . . . 73.43 111.409 -177.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.466 ' O ' HG12 ' A' ' 58' ' ' ILE . 5.2 m-20 -67.45 149.06 98.56 Favored Pre-proline 0 N--CA 1.432 -1.33 0 C-N-CA 126.162 1.785 . . . . 74.03 112.419 -175.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.54 ' HG2' ' OE2' ' A' ' 56' ' ' GLU . 16.1 Cg_endo -61.99 -28.24 80.43 Favored 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.016 2.477 . . . . 63.1 111.598 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.54 ' OE2' ' HG2' ' A' ' 55' ' ' PRO . 3.4 mp0 -67.53 -37.9 83.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.526 -0.916 . . . . 73.35 108.526 177.05 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.475 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 84.9 t -74.29 -36.64 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 114.4 -1.273 . . . . 74.22 109.574 -178.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 54' ' ' ASN . 48.6 mm -64.72 -44.78 96.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.527 -0.76 . . . . 75.03 109.147 174.64 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.475 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 59.8 t-80 -56.79 -40.84 76.64 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 123.254 0.621 . . . . 71.12 110.437 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.472 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 3.2 tpt180 -53.66 -48.19 69.66 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 125.16 1.384 . . . . 75.41 110.954 177.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.475 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 62.8 mt-30 -70.72 -50.97 30.6 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.869 -1.06 . . . . 65.3 110.756 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.422 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.2 mm? -66.78 -30.42 70.62 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 114.562 -1.199 . . . . 74.0 112.695 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.475 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 56.9 t30 -52.95 -40.39 63.62 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 125.132 1.373 . . . . 72.12 110.717 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.525 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 29.3 mmt180 -60.43 -30.76 69.83 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 72.13 112.976 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.03 -38.14 72.58 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.347 . . . . 73.23 110.886 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -71.71 -27.83 63.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.283 -0.636 . . . . 73.34 109.283 177.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.71 -31.94 72.23 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 115.189 -0.914 . . . . 72.34 109.665 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.404 ' HG2' ' CD1' ' A' ' 41' ' ' LEU . 8.7 mm-40 -70.84 -54.44 11.56 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 109.273 -0.64 . . . . 71.21 109.273 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -177.96 146.56 7.6 Favored Glycine 0 N--CA 1.417 -2.614 0 C-N-CA 120.447 -0.882 . . . . 75.42 113.111 -175.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -69.73 -26.76 64.48 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 106.056 -1.831 . . . . 73.44 106.056 169.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.83 -31.61 63.3 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 113.658 -1.61 . . . . 72.22 108.189 175.132 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.613 HG22 ' CD1' ' A' ' 40' ' ' PHE . 51.6 m -71.25 -39.67 71.48 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 115.538 -0.756 . . . . 73.33 111.07 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.498 ' HD1' ' O ' ' A' ' 95' ' ' VAL . 47.3 t-105 -63.9 -35.01 79.24 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 107.696 -1.224 . . . . 72.43 107.696 174.131 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.921 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 78.5 tttt -62.23 -45.85 91.5 Favored 'General case' 1 N--CA 1.366 -4.671 0 N-CA-C 114.832 1.419 . . . . 73.32 114.832 173.292 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.2 m -62.75 -34.95 78.26 Favored 'General case' 0 N--CA 1.41 -2.425 0 CA-C-O 122.081 0.943 . . . . 71.12 109.342 175.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . 0.409 ' HB3' ' O ' ' A' ' 73' ' ' TRP . 73.2 t80 -62.26 -52.44 63.72 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 113.835 -1.529 . . . . 73.11 112.623 -178.708 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.56 HG13 ' HA ' ' A' ' 95' ' ' VAL . 50.2 mm -68.04 -29.13 43.65 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 C-N-CA 119.022 -1.071 . . . . 74.21 111.094 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -63.76 -41.22 98.02 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.188 -0.46 . . . . 73.23 110.93 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -76.12 -37.04 58.57 Favored 'General case' 0 C--O 1.21 -1.015 0 C-N-CA 120.412 -0.515 . . . . 73.2 110.307 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.49 -54.21 24.03 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.989 1.315 . . . . 74.21 109.388 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.448 ' SG ' HD11 ' A' ' 88' ' ' LEU . 60.1 m -64.16 -38.36 90.77 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.405 -0.816 . . . . 73.51 111.654 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -75.57 -48.18 23.46 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.067 -0.515 . . . . 75.0 111.404 -175.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -76.48 -33.66 58.68 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 114.918 1.451 . . . . 74.2 114.918 -175.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.6 mt -83.14 -21.63 33.54 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.661 -0.815 . . . . 74.03 111.324 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 70.89 -9.06 0.87 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.321 1.048 . . . . 62.31 112.935 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.02 137.56 94.65 Favored Pre-proline 0 N--CA 1.437 -1.11 0 N-CA-C 109.092 -0.707 . . . . 75.13 109.092 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -84.41 102.81 0.9 Allowed 'Trans proline' 0 N--CA 1.436 -1.854 0 C-N-CA 121.755 1.637 . . . . 65.24 112.978 -177.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.448 HD11 ' SG ' ' A' ' 81' ' ' CYS . 4.5 mp -90.96 -41.07 11.33 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 107.936 -1.135 . . . . 61.44 107.936 173.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.9 t70 68.71 -54.33 0.55 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.531 1.532 . . . . 74.43 112.923 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 64.4 mtt -96.94 82.3 3.22 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.593 -0.892 . . . . 53.35 108.593 175.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.461 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -71.3 -34.31 70.5 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 125.735 1.614 . . . . 73.14 112.257 -176.093 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.498 ' HB ' ' HD3' ' A' ' 93' ' ' PRO . 50.1 mm -49.66 -52.07 54.04 Favored Pre-proline 0 CA--C 1.572 1.792 0 C-N-CA 125.004 1.322 . . . . 72.52 113.475 -173.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 13.8 Cg_exo -58.84 -37.94 91.12 Favored 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 121.526 1.484 . . . . 75.42 111.649 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.605 ' O ' HG21 ' A' ' 97' ' ' ILE . 4.2 mm? -64.04 -37.46 87.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.567 0.747 . . . . 65.41 111.286 176.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.921 ' CG2' ' HA ' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -85.69 -27.64 6.32 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.179 0 CA-C-O 121.877 0.846 . . . . 74.5 112.712 -171.234 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 0.414 ' CB ' ' HG2' ' A' ' 9' ' ' GLU . 9.4 t -101.66 5.3 41.43 Favored 'General case' 0 C--N 1.256 -3.485 0 C-N-CA 119.245 -0.982 . . . . 72.33 111.279 -177.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.605 HG21 ' O ' ' A' ' 94' ' ' LEU . 15.5 tt -77.14 -49.62 22.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 112.643 0.609 . . . . 75.33 112.643 -177.589 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.2 m0 66.19 -31.52 0.16 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 126.23 1.812 . . . . 74.42 113.124 -176.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . 0.438 ' H ' ' C ' ' A' ' 97' ' ' ILE . . . 105.3 -174.19 21.06 Favored Glycine 0 N--CA 1.429 -1.78 0 N-CA-C 110.822 -0.911 . . . . 63.23 110.822 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.46 109.66 0.78 Allowed 'Trans proline' 0 C--O 1.25 1.1 0 C-N-CA 122.501 2.134 . . . . 72.23 110.59 176.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 . . . . . 0 N--CA 1.42 -1.94 0 N-CA-C 108.48 -0.933 . . . . 71.4 108.48 -179.768 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.307 0 N-CA-C 110.779 -0.928 . . . . 71.22 110.779 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -64.86 -24.09 61.51 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 122.75 2.3 . . . . 73.55 114.012 -177.538 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.8 mp -108.76 155.23 21.0 Favored 'General case' 0 C--O 1.245 0.867 0 O-C-N 122.254 -0.279 . . . . 75.22 110.382 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.88 -95.11 0.1 OUTLIER Glycine 0 N--CA 1.438 -1.195 0 N-CA-C 110.833 -0.907 . . . . 73.34 110.833 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 49.5 m -139.72 120.32 14.19 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.98 -0.748 . . . . 65.51 108.98 179.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.528 ' SD ' ' HB3' ' A' ' 74' ' ' LYS . 34.6 tpp -81.03 -12.28 59.38 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-O 121.621 0.724 . . . . 75.33 110.53 -176.982 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -109.03 24.96 12.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.743 -0.662 . . . . 75.32 110.606 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.453 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -79.46 -7.43 58.41 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.111 0.958 . . . . 72.0 109.721 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.85 -30.05 67.44 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.937 1.295 . . . . 75.3 111.791 -178.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.499 ' HB2' HD12 ' A' ' 11' ' ' ILE . 49.6 m -57.39 -29.32 63.99 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 125.418 1.487 . . . . 73.33 110.348 174.236 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.499 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -88.13 -34.28 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.218 0 CA-C-N 114.126 -1.397 . . . . 74.31 111.666 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -75.22 -66.63 0.74 Allowed 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.223 1.564 . . . . 74.34 115.223 -167.02 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 54.9 177.09 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 115.31 1.596 . . . . 73.13 115.31 -178.562 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 38.7 t30 68.92 126.66 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 125.317 1.447 . . . . 74.2 110.472 -176.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.471 ' HB2' HG13 ' A' ' 97' ' ' ILE . 9.1 p30 -150.84 28.21 0.69 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 114.315 1.228 . . . . 74.45 114.315 -173.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.48 -49.97 67.07 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.294 -0.963 . . . . 64.03 113.288 -176.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -75.52 -33.03 60.69 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.246 -1.02 . . . . 73.45 108.246 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.476 HD21 ' HA ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -55.76 -46.61 77.83 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 113.73 -1.577 . . . . 74.11 111.262 178.865 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -59.57 -48.15 82.8 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.431 -0.804 . . . . 74.51 110.986 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.71 65.91 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.2 -0.455 . . . . 74.55 111.362 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 42.1 t-105 -71.1 -51.4 25.33 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 110.269 -0.271 . . . . 74.54 110.269 175.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.91 -51.17 67.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.023 -0.535 . . . . 75.12 110.473 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.5 t -60.11 -45.14 96.15 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-N 115.602 -0.727 . . . . 75.3 112.73 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 75.7 ttt180 -71.82 -41.93 67.61 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.483 -0.487 . . . . 74.2 110.864 -177.44 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.408 HD12 HD12 ' A' ' 84' ' ' LEU . 1.9 tm? -65.66 -41.91 91.96 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.255 0.55 . . . . 73.43 109.864 -177.15 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.411 HD11 HD22 ' A' ' 33' ' ' LEU . 4.3 mt -72.17 -24.96 61.52 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.342 0.497 . . . . 74.14 112.342 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.8 t -67.04 -24.65 66.02 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 108.4 -0.963 . . . . 71.14 108.4 177.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 59.5 mttt -87.02 -12.95 45.85 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.612 -0.722 . . . . 63.24 109.66 178.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.424 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.6 m-80 -129.97 54.06 13.43 Favored Pre-proline 0 N--CA 1.444 -0.747 0 CA-C-N 115.353 -0.84 . . . . 64.24 113.208 -173.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.424 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.0 Cg_exo -69.48 -22.2 33.72 Favored 'Trans proline' 0 C--N 1.357 1.003 0 N-CA-C 108.24 -1.485 . . . . 74.51 108.24 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.83 -41.8 91.32 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.593 -1.639 . . . . 74.34 109.893 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.478 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 76.5 t90 -75.3 -43.64 49.9 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.518 -0.873 . . . . 74.45 109.934 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.425 HD11 ' HG ' ' A' ' 37' ' ' LEU . 1.9 tm? -60.69 -40.16 91.16 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.38 -1.282 . . . . 73.42 111.191 -173.335 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.501 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 51.0 p -53.46 -53.52 50.26 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.196 0.31 . . . . 74.1 111.21 176.915 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.427 ' HA ' ' NE ' ' A' ' 38' ' ' ARG . . . -52.1 -48.62 64.65 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.519 1.528 . . . . 74.43 112.192 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.478 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 69.0 mmtt -69.27 -32.03 70.95 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 120.424 -0.51 . . . . 62.31 111.921 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.47 HD12 HD23 ' A' ' 46' ' ' LEU . 37.4 mt -67.15 -31.05 71.22 Favored 'General case' 0 C--O 1.187 -2.212 0 C-N-CA 120.127 -0.629 . . . . 74.43 110.367 173.701 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.501 ' HG3' ' O ' ' A' ' 34' ' ' SER . 24.6 mtm180 -61.79 -33.61 74.42 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.792 0.806 . . . . 74.22 109.589 177.253 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.446 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 75.3 m -78.4 -29.66 47.34 Favored 'General case' 0 N--CA 1.398 -3.073 0 C-N-CA 125.126 1.37 . . . . 64.33 113.174 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.566 ' CD1' HG21 ' A' ' 72' ' ' THR . 52.5 m-85 -102.16 -46.63 4.78 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 112.863 0.69 . . . . 74.31 112.863 -178.243 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.407 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 8.7 mp -91.29 135.59 28.03 Favored Pre-proline 0 C--N 1.294 -1.84 0 C-N-CA 124.491 1.116 . . . . 71.32 110.701 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -90.86 -14.44 1.89 Allowed 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.343 2.029 . . . . 60.02 110.453 169.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.2 p -114.01 28.2 8.94 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 124.44 1.096 . . . . 71.31 111.531 -175.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.407 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -68.43 113.2 5.78 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.664 -1.153 . . . . 74.41 112.733 -177.295 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -147.14 75.55 1.38 Allowed 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 114.364 -1.289 . . . . 75.02 109.008 173.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.47 HD23 HD12 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -92.81 -12.29 31.55 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.126 -1.397 . . . . 65.44 108.744 -179.268 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.98 -16.66 63.79 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.264 -1.335 . . . . 72.45 111.538 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 51.8 t -79.72 92.95 5.47 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 106.98 -1.489 . . . . 64.43 106.98 173.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.5 m -91.32 86.34 6.09 Favored 'General case' 0 N--CA 1.411 -2.378 0 CA-C-O 121.783 0.802 . . . . 72.02 111.733 -176.094 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -41.57 82.05 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.867 1.318 . . . . 74.12 108.597 173.035 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.579 ' HG3' ' CG2' ' A' ' 57' ' ' VAL . 2.5 pt-20 -137.34 163.37 49.38 Favored Pre-proline 0 C--N 1.258 -3.386 0 CA-C-N 112.216 -2.265 . . . . 63.14 108.097 170.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -69.42 -156.43 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.814 2.343 . . . . 72.04 113.057 -177.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 m -75.59 38.75 0.15 Allowed 'General case' 0 C--O 1.251 1.157 0 C-N-CA 124.616 1.166 . . . . 71.3 112.571 -176.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.456 ' ND2' ' HB2' ' A' ' 51' ' ' GLU . 95.8 m-20 -58.47 152.06 46.65 Favored Pre-proline 0 N--CA 1.436 -1.17 0 C-N-CA 125.5 1.52 . . . . 73.44 111.025 177.607 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.73 -39.11 90.95 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.514 2.809 . . . . 75.45 112.732 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -72.75 -31.96 65.31 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.683 -0.69 . . . . 72.43 110.05 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.579 ' CG2' ' HG3' ' A' ' 51' ' ' GLU . 67.5 t -69.66 -46.33 75.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.298 -0.864 . . . . 74.23 108.89 178.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.442 ' O ' HD21 ' A' ' 62' ' ' LEU . 46.5 mm -59.45 -46.92 92.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.037 -0.983 . . . . 75.54 109.338 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -55.93 -39.68 72.04 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.791 0.436 . . . . 73.35 111.483 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -64.07 -39.82 94.92 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.349 0.595 . . . . 71.45 111.2 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 78.2 mt-30 -70.81 -45.49 64.51 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.019 -0.992 . . . . 74.13 110.395 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.442 HD21 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -66.14 -31.08 71.71 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.254 -1.339 . . . . 74.32 111.509 -178.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -52.75 -43.06 65.51 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.869 1.268 . . . . 74.13 110.57 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.88 -30.09 63.55 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.305 -1.316 . . . . 73.52 113.076 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 90.9 mt -72.34 -42.29 65.51 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-O 120.623 0.249 . . . . 70.31 111.431 -177.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -70.55 -28.14 64.68 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.367 -0.975 . . . . 75.34 108.367 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.56 -41.07 96.54 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.079 -0.964 . . . . 64.2 109.841 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 43.5 mm-40 -63.96 -47.19 81.4 Favored 'General case' 0 N--CA 1.426 -1.666 0 N-CA-C 109.641 -0.503 . . . . 74.44 109.641 176.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -176.92 143.44 6.31 Favored Glycine 0 N--CA 1.407 -3.261 0 C-N-CA 120.356 -0.926 . . . . 73.34 113.841 -176.111 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -69.87 -27.11 64.55 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 106.565 -1.643 . . . . 74.44 106.565 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.05 -37.66 58.03 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.407 -1.269 . . . . 73.24 108.473 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.566 HG21 ' CD1' ' A' ' 40' ' ' PHE . 94.0 m -59.6 -35.66 74.76 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.093 -0.958 . . . . 75.24 110.754 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 58.5 t-105 -63.88 -42.69 97.44 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 109.668 -0.493 . . . . 75.23 109.668 178.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.528 ' HB3' ' SD ' ' A' ' 6' ' ' MET . 50.3 mttt -62.84 -47.09 84.9 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.198 0.599 . . . . 75.55 110.887 177.278 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.7 m -61.32 -40.8 95.55 Favored 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 115.914 -0.584 . . . . 71.12 110.882 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -60.64 -50.65 72.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.363 -0.835 . . . . 71.14 111.016 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.455 HG13 ' HA ' ' A' ' 95' ' ' VAL . 32.4 mm -66.88 -33.38 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 120.482 -0.487 . . . . 63.42 111.528 -175.954 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -60.63 -43.16 97.85 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.862 -0.422 . . . . 73.53 109.862 176.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.466 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.3 m-20 -71.66 -42.11 67.92 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.98 -0.554 . . . . 75.52 111.274 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.463 ' HA ' ' CZ2' ' A' ' 32' ' ' TRP . 2.4 tm? -50.45 -54.62 20.7 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.346 1.458 . . . . 75.3 109.774 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.432 ' SG ' ' HB2' ' A' ' 88' ' ' LEU . 46.9 t -67.55 -32.21 72.83 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.806 -1.088 . . . . 74.21 111.24 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -72.85 -44.58 61.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.448 -0.796 . . . . 74.3 111.65 -176.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 9.8 mt-10 -89.24 -19.67 25.09 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 113.98 1.104 . . . . 73.22 113.98 -171.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.408 HD12 HD12 ' A' ' 25' ' ' LEU 0.255 85.3 mt -82.16 49.13 1.35 Allowed 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 115.658 1.725 . . . . 70.23 115.658 -174.579 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.455 ' OD2' HG23 ' A' ' 86' ' ' VAL . 26.6 t70 71.73 -73.11 0.1 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.684 1.364 . . . . 64.34 114.684 173.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.455 HG23 ' OD2' ' A' ' 85' ' ' ASP . 71.3 t -99.77 124.46 43.94 Favored Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 122.385 -0.197 . . . . 73.44 110.917 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.28 107.06 0.76 Allowed 'Trans proline' 0 C--O 1.252 1.202 0 C-N-CA 122.845 2.363 . . . . 74.12 111.481 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.432 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 4.8 mp -64.45 -38.87 92.55 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.312 -0.858 . . . . 73.35 109.606 179.459 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.9 t70 65.38 9.94 6.13 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-O 122.818 1.294 . . . . 73.03 111.333 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.456 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 25.5 ptm -124.43 39.95 3.85 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 107.657 -1.238 . . . . 74.2 107.657 177.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -40.13 95.05 Favored 'General case' 0 C--O 1.203 -1.386 0 CA-C-N 114.021 -1.445 . . . . 75.42 111.003 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.556 ' HA ' HG13 ' A' ' 95' ' ' VAL . 31.1 mm -64.53 -48.33 74.76 Favored Pre-proline 0 C--N 1.29 -2.003 0 CA-C-O 119.088 -0.482 . . . . 70.41 111.518 179.433 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.456 ' HD2' ' C ' ' A' ' 90' ' ' MET . 84.6 Cg_exo -51.23 -38.44 61.4 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 121.507 1.471 . . . . 75.23 111.01 170.077 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.476 ' HA ' HD21 ' A' ' 18' ' ' LEU . 3.2 mm? -63.48 -46.47 86.0 Favored 'General case' 0 C--O 1.188 -2.178 0 O-C-N 123.371 0.42 . . . . 74.12 112.076 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.556 HG13 ' HA ' ' A' ' 92' ' ' ILE . 5.7 p -68.79 -31.53 51.12 Favored 'Isoleucine or valine' 0 C--O 1.251 1.18 0 CA-C-O 122.377 1.084 . . . . 73.11 112.817 -178.822 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.5 t -62.36 -6.86 3.59 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 113.329 -1.759 . . . . 71.45 111.621 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.471 HG13 ' HB2' ' A' ' 15' ' ' ASN . 15.3 tt -61.21 -28.58 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 124.333 1.053 . . . . 75.35 111.869 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . 0.472 ' O ' ' HD3' ' A' ' 100' ' ' PRO . 34.0 t-105 -151.73 -20.44 0.19 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 120.539 -0.465 . . . . 72.13 111.478 -174.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -114.3 88.53 0.48 Allowed Glycine 0 N--CA 1.435 -1.409 0 C-N-CA 119.874 -1.155 . . . . 73.14 111.972 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . 0.472 ' HD3' ' O ' ' A' ' 98' ' ' TRP . 19.4 Cg_endo -99.01 105.62 0.06 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.541 0 C-N-CA 123.079 2.519 . . . . 75.43 111.734 175.594 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 . . . . . 0 N--CA 1.428 -1.561 0 C-N-CA 126.932 2.093 . . . . 73.34 112.036 178.386 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.855 0 N-CA-C 109.948 -1.261 . . . . 65.14 109.948 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -71.82 -32.1 11.94 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.638 2.225 . . . . 74.31 112.581 -178.21 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mp -93.49 119.63 32.8 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 120.786 0.326 . . . . 73.21 110.389 -178.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.14 112.83 1.93 Allowed Glycine 0 N--CA 1.426 -1.998 0 C-N-CA 120.448 -0.882 . . . . 72.04 111.538 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.4 t 74.61 -64.02 0.4 Allowed 'General case' 0 C--O 1.242 0.667 0 C-N-CA 124.998 1.319 . . . . 72.41 111.393 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.431 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 2.1 mpt? 61.29 19.1 9.84 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 124.404 1.081 . . . . 74.23 111.343 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -81.16 24.58 0.52 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 113.055 0.761 . . . . 74.41 113.055 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . 0.403 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.46 -17.66 56.0 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.425 -0.583 . . . . 74.31 109.425 174.116 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 6' ' ' MET . 0.3 OUTLIER -54.18 -43.63 70.85 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.078 0.951 . . . . 74.45 111.527 178.973 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -55.83 -31.54 62.81 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 124.743 1.217 . . . . 72.42 111.224 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.403 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.2 mp -87.6 -34.84 7.65 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 C-N-CA 124.825 1.25 . . . . 71.34 111.521 -176.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -91.63 -44.27 9.14 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 115.436 1.643 . . . . 75.33 115.436 -171.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 64.44 171.01 0.19 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.778 0.831 . . . . 75.22 112.989 -174.532 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . 0.402 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 4.4 p-10 -108.56 -176.97 3.19 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 112.724 0.638 . . . . 72.4 112.724 -175.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.493 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 45.2 t-20 -155.26 142.95 19.78 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.557 -0.905 . . . . 74.34 108.557 -176.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.83 -29.83 67.19 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.779 0.659 . . . . 71.53 112.779 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -68.41 -32.85 73.18 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 122.405 1.098 . . . . 73.43 108.959 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.493 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 7.0 tt -69.92 -35.11 74.31 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 113.158 -1.837 . . . . 74.34 109.568 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 59.2 t-105 -63.63 -44.97 92.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.596 -0.52 . . . . 75.43 109.596 175.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.46 -40.99 93.18 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.033 -0.531 . . . . 74.3 110.308 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -57.49 -50.57 72.64 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.643 -0.708 . . . . 73.4 110.704 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.454 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 57.4 tp -59.53 -51.32 70.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.059 -0.519 . . . . 74.23 110.609 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.54 -51.4 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.095 -0.502 . . . . 75.13 111.984 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 31.3 mmt180 -70.27 -38.46 75.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.964 0.357 . . . . 75.33 111.964 -174.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -66.47 -41.52 88.89 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.881 -0.785 . . . . 75.3 108.881 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.454 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 5.4 mt -70.71 -24.89 62.73 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.412 0.523 . . . . 71.32 112.412 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.1 m -68.46 -20.91 64.65 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.024 -0.732 . . . . 75.32 109.024 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.1 mtmt -92.06 -3.56 55.61 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.799 -0.637 . . . . 63.31 109.31 177.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.445 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 54.1 m-80 -137.53 54.08 7.48 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 115.641 -0.709 . . . . 74.43 111.945 -177.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.445 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 13.4 Cg_exo -70.41 -19.86 32.5 Favored 'Trans proline' 0 C--N 1.358 1.044 0 N-CA-C 108.643 -1.329 . . . . 71.53 108.643 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -69.56 -43.93 71.9 Favored 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.06 -1.427 . . . . 75.33 109.731 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.0 t90 -74.77 -43.05 56.87 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 120.133 -0.627 . . . . 75.13 110.196 177.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.498 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.4 tm? -59.77 -45.78 91.2 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.178 -0.919 . . . . 72.33 111.016 -173.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.1 p -62.54 -35.37 79.23 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 112.025 0.38 . . . . 62.45 112.025 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.53 99.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.469 0.652 . . . . 65.24 110.391 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.422 ' O ' ' HB2' ' A' ' 39' ' ' SER . 53.9 mmtt -72.48 -31.7 65.61 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 120.234 -0.586 . . . . 73.02 111.714 175.931 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.498 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 73.0 mt -58.43 -50.84 72.25 Favored 'General case' 0 C--O 1.201 -1.462 0 CA-C-O 119.864 -0.112 . . . . 73.21 111.229 176.79 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.503 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 8.1 ppt_? -60.4 -30.49 69.63 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.232 0.826 . . . . 74.52 113.232 -178.436 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.422 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 52.4 m -72.38 -50.13 28.83 Favored 'General case' 1 N--CA 1.375 -4.214 0 CA-C-N 114.55 -1.204 . . . . 74.14 112.078 176.61 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.438 ' CD1' HG22 ' A' ' 72' ' ' THR . 55.5 m-85 -80.8 -43.89 19.37 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.507 0.929 . . . . 75.34 113.507 -175.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.591 ' HG ' ' OE1' ' A' ' 68' ' ' GLN . 6.5 mp -79.43 124.78 83.89 Favored Pre-proline 0 C--N 1.287 -2.116 0 C-N-CA 124.125 0.97 . . . . 74.31 111.605 -176.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -82.08 -10.33 11.45 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.875 1.716 . . . . 72.43 107.957 168.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 p -111.48 29.33 7.92 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 127.29 2.236 . . . . 75.44 109.987 -178.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.503 ' HG2' ' HA ' ' A' ' 38' ' ' ARG 0.314 0.0 OUTLIER -54.0 92.41 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 116.502 2.038 . . . . 75.14 116.502 -179.401 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . 0.63 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 8.7 m-20 -118.44 81.65 1.72 Allowed 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.607 -1.627 . . . . 75.51 106.607 174.557 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 pp -95.51 -6.52 40.37 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.161 -1.381 . . . . 72.31 111.52 -176.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.78 4.0 49.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.391 -0.822 . . . . 75.34 110.375 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . 0.63 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 64.3 m -88.32 30.46 0.88 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.414 0.626 . . . . 74.53 111.57 -177.173 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -80.2 89.51 5.46 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 109.236 -0.653 . . . . 70.41 109.236 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.37 -25.51 65.11 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.049 -0.978 . . . . 72.52 112.584 178.288 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -132.58 167.75 21.15 Favored Pre-proline 1 N--CA 1.378 -4.039 0 CA-C-N 113.925 -1.489 . . . . 65.44 107.176 178.098 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . 0.401 ' C ' ' H ' ' A' ' 54' ' ' ASN . 43.4 Cg_exo -63.79 -141.06 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.388 2.725 . . . . 72.03 113.285 176.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -76.21 37.65 0.16 Allowed 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.773 0.829 . . . . 75.1 111.963 -177.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . 0.401 ' H ' ' C ' ' A' ' 52' ' ' PRO . 6.4 m120 -67.64 145.78 98.3 Favored Pre-proline 0 C--N 1.301 -1.519 0 C-N-CA 124.497 1.119 . . . . 71.41 111.491 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.1 -38.2 92.57 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.413 2.742 . . . . 71.2 113.187 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.08 -28.69 60.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.741 0.305 . . . . 62.41 110.359 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -66.04 -50.9 66.04 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.511 0 N-CA-C 107.835 -1.172 . . . . 75.03 107.835 176.362 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.4 mm -59.67 -42.7 89.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.329 -1.305 . . . . 74.33 109.873 177.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -58.44 -36.29 73.42 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.978 -0.556 . . . . 70.12 111.592 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.41 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 31.7 ttm-85 -63.16 -41.79 99.3 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.951 0.882 . . . . 74.15 110.731 177.247 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -67.23 -39.65 86.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.547 -1.206 . . . . 74.4 110.313 -177.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.461 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.3 mm? -74.09 -31.05 62.65 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.8 -1.091 . . . . 72.04 110.676 177.138 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.41 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 8.6 t30 -61.87 -35.51 78.51 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 124.247 1.019 . . . . 73.55 109.364 178.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -58.26 -55.84 29.85 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 114.98 -1.009 . . . . 75.3 110.257 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . 0.5 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 79.6 mt -57.27 -33.83 68.02 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.929 0.491 . . . . 74.32 111.327 -177.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -57.15 -45.86 83.21 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.554 -0.748 . . . . 72.13 109.561 176.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.4 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 61.51 110.811 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.591 ' OE1' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -60.25 -47.68 84.98 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 123.842 0.857 . . . . 73.4 111.067 177.046 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 166.47 138.46 2.44 Favored Glycine 0 N--CA 1.411 -3.03 0 C-N-CA 119.867 -1.159 . . . . 61.2 112.695 -178.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.422 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -70.29 -27.07 64.11 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 105.913 -1.884 . . . . 75.41 105.913 170.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.4 67.59 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.111 -1.404 . . . . 73.35 108.044 175.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.438 HG22 ' CD1' ' A' ' 40' ' ' PHE . 98.7 m -64.93 -34.43 78.38 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.356 -0.838 . . . . 73.44 110.087 177.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.461 ' CH2' HD12 ' A' ' 62' ' ' LEU . 33.1 t-105 -66.56 -39.52 88.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.503 -0.554 . . . . 73.43 109.503 179.062 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.529 ' HG2' HG21 ' A' ' 95' ' ' VAL . 84.3 mttt -57.17 -52.0 67.06 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 122.874 0.469 . . . . 74.41 111.084 174.245 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.6 m -58.09 -41.82 84.31 Favored 'General case' 0 N--CA 1.411 -2.383 0 CA-C-O 121.791 0.805 . . . . 74.33 110.13 178.17 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -61.12 -49.96 75.16 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 114.497 -1.229 . . . . 74.12 111.567 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.585 HG23 ' O ' ' A' ' 91' ' ' GLU . 49.1 mm -68.15 -31.38 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 119.676 -0.809 . . . . 74.21 112.01 -175.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -62.04 -37.47 85.04 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.195 0.521 . . . . 73.21 109.745 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.21 -35.92 47.9 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.426 -0.51 . . . . 75.51 111.733 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -53.02 -54.88 28.77 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 124.657 1.183 . . . . 75.1 109.004 178.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 14.8 p -68.34 -36.82 79.82 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.839 -0.618 . . . . 63.2 112.605 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.66 -54.43 7.44 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.932 -0.576 . . . . 72.13 112.029 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -76.31 -21.31 56.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.93 1.085 . . . . 75.13 113.93 -172.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.33 19.21 2.83 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 112.21 0.448 . . . . 72.12 112.21 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 72.94 -63.33 0.44 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.478 1.511 . . . . 75.25 112.65 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.5 m -72.63 120.69 82.04 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-O 121.115 0.483 . . . . 74.34 112.087 -176.163 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -72.1 117.38 5.11 Favored 'Trans proline' 0 N--CA 1.44 -1.652 0 C-N-CA 121.813 1.675 . . . . 74.33 109.719 177.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.401 ' C ' ' H ' ' A' ' 90' ' ' MET . 80.5 mt -79.97 -28.94 39.5 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 116.231 -0.44 . . . . 75.2 110.231 -178.202 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.9 t70 71.66 -44.47 0.59 Allowed 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 126.116 1.766 . . . . 74.3 111.301 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.479 ' O ' HD23 ' A' ' 94' ' ' LEU . 67.8 mtt -84.22 47.92 1.41 Allowed 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 125.192 1.397 . . . . 74.32 110.273 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.585 ' O ' HG23 ' A' ' 77' ' ' ILE . 10.7 pt-20 -70.68 -35.63 72.91 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.254 0.55 . . . . 74.42 111.147 -178.933 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.549 ' HA ' HG12 ' A' ' 95' ' ' VAL . 24.4 mm -63.96 -47.8 79.61 Favored Pre-proline 0 C--O 1.184 -2.354 0 CA-C-O 118.292 -0.861 . . . . 74.32 111.028 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.462 ' HD2' ' C ' ' A' ' 90' ' ' MET . 25.4 Cg_exo -48.76 -37.41 35.44 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 122.098 1.865 . . . . 73.13 112.176 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.486 ' HA ' HD21 ' A' ' 18' ' ' LEU . 4.5 mm? -67.51 -36.42 81.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.193 0.597 . . . . 75.42 111.287 175.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.549 HG12 ' HA ' ' A' ' 92' ' ' ILE . 7.5 p -84.58 -32.69 7.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-O 122.178 0.99 . . . . 72.15 113.026 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.5 t -63.13 -6.5 4.28 Favored 'General case' 0 C--N 1.271 -2.845 0 CA-C-N 113.935 -1.484 . . . . 73.55 112.427 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.402 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 13.8 tt -71.63 -17.36 19.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-O 121.829 0.823 . . . . 74.33 109.654 177.493 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.43 29.64 5.29 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 104.899 -2.26 . . . . 73.24 104.899 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -104.77 -171.61 24.51 Favored Glycine 0 N--CA 1.424 -2.121 0 CA-C-N 113.575 -1.648 . . . . 71.24 111.348 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -74.85 115.83 4.41 Favored 'Trans proline' 0 N--CA 1.444 -1.431 0 C-N-CA 123.296 2.664 . . . . 73.42 112.427 -174.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 . . . . . 0 C--N 1.295 -1.781 0 CA-C-N 115.43 -0.805 . . . . 75.41 108.878 176.481 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.606 0 N-CA-C 110.701 -0.96 . . . . 71.22 110.701 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -80.56 -178.37 4.4 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.795 2.33 . . . . 73.12 111.172 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.6 mt -61.15 107.18 0.7 Allowed 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.256 0.551 . . . . 75.32 109.587 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.36 -45.21 1.08 Allowed Glycine 0 N--CA 1.428 -1.877 0 N-CA-C 110.475 -1.05 . . . . 70.23 110.475 -175.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.5 m -72.31 127.27 32.05 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.28 -1.008 . . . . 72.32 108.28 176.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' MET . . . . . 0.532 ' SD ' HD13 ' A' ' 92' ' ' ILE . 47.8 tpp 72.21 4.24 4.95 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 122.57 1.176 . . . . 74.41 110.005 -176.698 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.421 ' O ' HD12 ' A' ' 11' ' ' ILE . 52.4 m-20 -118.88 24.76 10.65 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-N 114.157 -1.383 . . . . 75.02 108.524 177.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.52 -19.74 52.26 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.935 -0.765 . . . . 71.32 108.935 175.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.465 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -53.66 -45.5 70.28 Favored 'General case' 0 C--O 1.207 -1.148 0 N-CA-C 114.735 1.383 . . . . 75.41 114.735 -177.248 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' SER . . . . . 0.422 ' HB2' HD13 ' A' ' 11' ' ' ILE . 73.0 m -65.24 -35.91 82.51 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-O 121.74 0.781 . . . . 72.44 111.895 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . 0.422 HD13 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.4 -41.06 14.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 C-N-CA 124.383 1.073 . . . . 75.14 111.852 -172.202 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmm180 -103.18 7.89 38.59 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.846 0.858 . . . . 72.43 112.008 -172.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -43.78 126.43 4.65 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.571 1.322 . . . . 74.14 114.571 -173.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -152.36 132.07 13.17 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 103.642 -2.725 . . . . 70.35 103.642 174.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -118.84 -61.37 1.66 Allowed 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.667 -0.813 . . . . 64.41 112.841 -174.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -71.11 -48.4 52.43 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.349 0.499 . . . . 75.32 112.349 -171.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -66.1 -35.83 81.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.871 0.844 . . . . 73.53 109.557 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -70.43 -42.32 71.72 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 114.304 -1.316 . . . . 74.12 110.051 -178.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -60.0 -51.37 69.95 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.575 -0.528 . . . . 72.32 109.575 175.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.433 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -57.71 -48.54 79.28 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.79 -0.641 . . . . 73.11 111.119 -178.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.687 ' CH2' ' HB2' ' A' ' 25' ' ' LEU . 7.7 t-105 -56.25 -50.91 69.98 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 123.252 0.345 . . . . 73.13 111.276 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.89 -42.73 94.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 110.358 -0.238 . . . . 72.2 110.358 -176.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.41 -46.04 97.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.248 -0.433 . . . . 72.23 110.787 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.511 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 67.0 mtt180 -62.85 -48.17 80.18 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 109.786 -0.45 . . . . 73.02 109.786 178.49 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.687 ' HB2' ' CH2' ' A' ' 21' ' ' TRP . 30.1 tp -55.45 -48.56 74.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.693 1.197 . . . . 74.42 111.705 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 9.8 mt -73.65 -23.98 59.93 Favored 'General case' 0 C--N 1.281 -2.393 0 CA-C-N 115.475 -0.784 . . . . 63.42 112.73 -179.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.6 t -75.22 -16.93 60.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 107.735 -1.209 . . . . 62.2 107.735 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.511 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 39.1 mtmt -90.61 -13.81 33.65 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.361 -0.607 . . . . 74.11 109.361 174.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.491 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.0 m-80 -137.34 49.48 2.84 Favored Pre-proline 0 C--O 1.241 0.657 0 CA-C-N 115.489 -0.778 . . . . 71.42 112.187 -175.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.491 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.1 Cg_exo -71.33 -20.79 27.41 Favored 'Trans proline' 0 C--N 1.362 1.265 0 N-CA-C 108.522 -1.376 . . . . 65.15 108.522 -178.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.14 -39.45 78.83 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 113.851 -1.522 . . . . 75.02 109.839 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.585 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 61.4 t90 -74.08 -40.13 62.97 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 118.872 -1.131 . . . . 74.02 109.136 178.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.467 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 1.4 tm? -62.84 -39.86 95.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 114.674 -1.148 . . . . 75.5 109.783 -175.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 65.9 m -53.28 -49.53 66.75 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 123.468 0.48 . . . . 74.33 111.024 175.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.46 -46.09 73.25 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.332 1.053 . . . . 64.52 112.002 177.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.436 ' O ' ' HB2' ' A' ' 39' ' ' SER . 67.5 mmtt -68.6 -35.33 77.18 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 121.054 -0.258 . . . . 75.15 111.433 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.9 mt -60.24 -34.31 73.51 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 122.333 -0.229 . . . . 75.43 110.523 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . 0.459 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -61.75 -35.93 79.54 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.635 0.731 . . . . 73.11 110.264 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' SER . . . . . 0.436 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 69.1 m -78.69 -28.52 45.23 Favored 'General case' 0 N--CA 1.402 -2.856 0 C-N-CA 125.362 1.465 . . . . 74.52 113.055 -177.965 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.593 ' CD1' HG22 ' A' ' 72' ' ' THR . 61.4 m-85 -102.44 -45.8 4.97 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.75 1.019 . . . . 73.11 113.75 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.0 125.53 70.28 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 114.359 1.244 . . . . 74.34 114.359 -173.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.64 -0.3 5.83 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 122.555 2.17 . . . . 73.43 108.396 166.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 p -106.89 17.48 23.06 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 126.297 1.839 . . . . 75.15 109.902 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.24 92.07 0.04 OUTLIER 'General case' 0 N--CA 1.41 -2.459 0 CA-C-N 114.168 -1.378 . . . . 73.24 111.269 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -129.47 56.6 1.7 Allowed 'General case' 0 CA--C 1.484 -1.588 0 N-CA-C 102.811 -3.033 . . . . 72.1 102.811 169.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 pp -90.2 -18.4 25.8 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.484 -1.689 . . . . 74.32 110.051 -171.802 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.94 -19.88 64.19 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 114.729 -1.123 . . . . 55.33 109.833 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 49.2 t -100.85 107.78 19.4 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.504 -1.225 . . . . 74.33 107.762 177.55 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.4 m -133.28 117.39 17.31 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.677 0.751 . . . . 73.34 110.799 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.97 -15.04 62.98 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.5 -1.227 . . . . 73.13 114.028 -178.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -137.0 165.86 31.62 Favored Pre-proline 0 N--CA 1.382 -3.848 0 N-CA-C 107.423 -1.325 . . . . 64.42 107.423 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.67 -149.51 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.241 1.961 . . . . 73.43 110.737 175.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.2 m -76.2 37.9 0.17 Allowed 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.019 0.928 . . . . 75.33 112.61 -176.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 80.3 m-20 -63.69 153.01 84.96 Favored Pre-proline 0 N--CA 1.448 -0.562 0 C-N-CA 123.968 0.907 . . . . 74.51 112.196 -177.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.79 -44.56 43.98 Favored 'Trans proline' 0 C--N 1.363 1.301 0 C-N-CA 123.828 3.019 . . . . 72.12 113.341 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -73.92 -23.1 59.49 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 112.301 0.482 . . . . 71.44 112.301 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.634 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 91.6 t -75.59 -36.87 35.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.093 -1.077 . . . . 71.4 108.093 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 mm -64.53 -45.59 95.16 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.036 -1.098 . . . . 72.21 108.036 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -54.16 -42.7 69.89 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.011 0.924 . . . . 74.4 110.462 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.634 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 36.2 ttt180 -54.5 -49.11 70.93 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.583 1.553 . . . . 74.34 110.831 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 90.4 mt-30 -64.58 -48.71 73.96 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.298 -0.865 . . . . 74.23 111.173 -177.407 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.493 HD11 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -72.13 -30.55 65.17 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.86 -1.064 . . . . 72.05 111.546 -175.202 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -53.35 -50.5 64.9 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 124.382 1.073 . . . . 71.43 111.01 175.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -54.92 -32.28 61.05 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.007 -1.451 . . . . 62.43 112.831 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.7 mt -72.18 -43.46 64.51 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.559 -0.291 . . . . 61.12 111.019 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . 0.511 ' CE1' ' HG2' ' A' ' 70' ' ' MET . 78.1 t80 -68.04 -30.21 69.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.768 -0.827 . . . . 70.04 108.768 177.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.56 68.73 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.038 -0.983 . . . . 51.51 110.777 176.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 10.3 mm-40 -70.93 -55.43 8.4 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 108.748 -0.834 . . . . 72.34 108.748 174.983 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.63 145.97 9.13 Favored Glycine 0 CA--C 1.476 -2.364 0 CA-C-N 115.147 -0.933 . . . . 64.25 112.016 -175.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.511 ' HG2' ' CE1' ' A' ' 66' ' ' PHE . 66.3 mtm -70.52 -27.97 64.58 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 105.51 -2.033 . . . . 72.12 105.51 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . 0.475 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . . . -74.13 -39.4 63.35 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.342 -1.754 . . . . 72.54 108.719 175.895 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.593 HG22 ' CD1' ' A' ' 40' ' ' PHE . 66.8 m -58.87 -42.05 88.53 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.693 -0.685 . . . . 75.11 109.286 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.495 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 70.4 t-105 -65.88 -40.51 91.65 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 116.307 -0.406 . . . . 73.35 111.556 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.63 ' CB ' HG23 ' A' ' 95' ' ' VAL . 14.7 ptpt -67.93 -41.89 81.86 Favored 'General case' 0 CA--C 1.506 -0.72 0 O-C-N 121.518 -0.739 . . . . 74.43 112.22 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.3 m -63.69 -37.15 86.27 Favored 'General case' 0 N--CA 1.406 -2.674 0 CA-C-N 115.332 -0.849 . . . . 74.04 110.171 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.41 -50.72 71.7 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.174 -0.921 . . . . 75.43 111.557 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.522 HG23 ' O ' ' A' ' 91' ' ' GLU . 47.3 mm -62.55 -32.12 54.29 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.407 0.622 . . . . 75.5 111.013 -176.046 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -57.61 -45.75 84.94 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.826 -1.079 . . . . 73.24 110.151 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . 0.486 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 10.5 m-20 -78.19 -38.42 43.37 Favored 'General case' 0 C--O 1.21 -0.974 0 CA-C-N 116.407 -0.36 . . . . 72.54 111.408 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.585 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.2 tm? -50.07 -55.01 16.57 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 125.492 1.517 . . . . 74.22 110.552 -178.698 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . 0.459 ' SG ' ' HG3' ' A' ' 91' ' ' GLU . 51.3 m -67.83 -32.68 73.39 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.893 -0.594 . . . . 73.44 111.701 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -70.73 -51.51 26.82 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.61 -0.723 . . . . 73.32 111.163 -177.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.486 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 13.4 mt-10 -79.23 -17.43 54.8 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 112.98 0.733 . . . . 64.2 112.98 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.4 11.11 22.54 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.168 0.509 . . . . 73.04 111.431 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 69.62 -59.71 0.49 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.142 1.534 . . . . 73.45 115.142 172.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.1 m -70.29 132.53 87.87 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 112.343 0.497 . . . . 75.0 112.343 -175.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_exo -68.11 109.4 1.95 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.468 2.112 . . . . 71.24 109.252 175.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.5 mt -79.75 -44.17 21.21 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 116.503 -0.317 . . . . 74.34 111.435 -174.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 26.0 t0 71.18 161.99 0.24 Allowed 'General case' 0 C--O 1.243 0.76 0 C-N-CA 125.259 1.424 . . . . 74.43 109.945 -175.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 65.86 23.22 11.36 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.572 -0.529 . . . . 60.22 109.572 -171.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.619 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 33.4 tt0 -56.28 -37.75 70.25 Favored 'General case' 0 C--O 1.21 -0.992 0 C-N-CA 125.641 1.576 . . . . 73.13 111.359 -177.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.532 HD13 ' SD ' ' A' ' 6' ' ' MET . 38.5 mm -72.16 -48.78 10.18 Favored Pre-proline 0 C--N 1.274 -2.705 0 O-C-N 120.983 -1.073 . . . . 75.53 109.996 178.653 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . 0.465 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 68.1 Cg_exo -51.35 -29.9 32.19 Favored 'Trans proline' 0 CA--C 1.563 1.928 0 C-N-CA 121.311 1.341 . . . . 75.31 111.844 166.085 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.619 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 9.2 mp -59.63 -36.5 76.47 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.835 -0.432 . . . . 62.25 109.835 171.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.63 HG23 ' CB ' ' A' ' 74' ' ' LYS . 3.7 p -85.88 -41.63 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-O 122.375 1.083 . . . . 71.2 113.246 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.2 m -71.4 7.17 1.45 Allowed 'General case' 0 C--N 1.246 -3.904 0 C-N-CA 125.189 1.396 . . . . 73.15 113.845 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 15.1 tt -73.34 -17.9 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 N-CA-C 114.193 1.183 . . . . 75.5 114.193 -172.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -89.28 -78.49 0.35 Allowed 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 114.738 1.385 . . . . 74.4 114.738 -174.13 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -120.52 -108.95 2.18 Favored Glycine 0 N--CA 1.429 -1.783 0 CA-C-N 115.931 -0.577 . . . . 75.14 113.332 -170.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -55.96 116.76 3.4 Favored 'Trans proline' 0 C--O 1.248 1.006 0 C-N-CA 123.406 2.737 . . . . 74.33 113.448 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? . . . . . 0 N--CA 1.436 -1.154 0 N-CA-C 107.977 -1.12 . . . . 75.14 107.977 172.815 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 111.076 -0.81 . . . . 73.44 111.076 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -92.91 30.54 0.29 Allowed 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 123.616 2.877 . . . . 74.44 112.39 -176.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 65.94 95.74 0.06 Allowed 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.166 0.986 . . . . 75.13 111.807 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.39 -50.2 33.85 Favored Glycine 0 CA--C 1.489 -1.551 0 N-CA-C 108.795 -1.722 . . . . 61.34 108.795 176.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.6 m -80.95 99.15 8.24 Favored 'General case' 0 N--CA 1.417 -2.11 0 N-CA-C 107.376 -1.342 . . . . 73.42 107.376 174.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.5 ttt -80.04 -18.37 50.31 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.005 0.907 . . . . 72.41 109.698 -176.389 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -91.29 25.83 2.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.267 -0.879 . . . . 71.43 109.926 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.7 -10.35 59.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.937 -1.029 . . . . 55.3 108.882 173.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . 0.613 ' OE2' ' HE2' ' A' ' 74' ' ' LYS . 6.1 pt-20 -58.64 -38.68 78.62 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.241 -0.891 . . . . 74.4 109.697 175.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 50.0 m -57.78 -26.73 62.33 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.226 1.41 . . . . 71.44 111.165 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.1 mp -88.04 -27.59 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.471 -1.241 . . . . 74.21 110.66 -176.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -82.55 -66.82 0.84 Allowed 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.793 1.034 . . . . 73.11 113.793 -172.688 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 43.99 -172.19 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.508 1.67 . . . . 75.41 115.508 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.9 t30 40.19 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 126.679 1.992 . . . . 74.4 115.843 171.325 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -179.48 108.24 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.57 0.7 . . . . 75.24 110.356 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -71.98 -28.42 63.4 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 124.636 1.174 . . . . 73.11 112.526 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -58.6 -27.6 64.8 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.782 0.66 . . . . 74.04 112.782 -174.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.413 ' HB2' HD12 ' A' ' 97' ' ' ILE . 3.1 mm? -64.32 -36.3 83.68 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 121.099 -0.24 . . . . 73.44 110.519 176.768 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TRP . . . . . 0.402 ' HB2' HD13 ' A' ' 97' ' ' ILE . 74.7 t-105 -69.63 -49.58 52.54 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.128 -0.487 . . . . 75.44 110.219 -176.818 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.27 -39.75 91.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.136 -0.484 . . . . 72.22 110.813 179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TRP . . . . . 0.451 ' HE1' ' HG ' ' A' ' 88' ' ' LEU . 13.6 t-105 -60.85 -50.32 73.89 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.202 -0.454 . . . . 74.25 110.306 176.084 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.428 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -57.63 -53.07 62.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 124.073 0.858 . . . . 74.43 109.418 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.1 t -58.41 -47.36 88.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.873 -0.603 . . . . 74.35 112.227 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.407 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 74.7 mtp180 -69.18 -44.42 72.22 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 112.163 0.431 . . . . 75.43 112.163 -176.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -67.57 -39.84 84.9 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.199 -0.667 . . . . 75.23 109.199 -176.316 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 4.7 mt -73.9 -25.1 59.83 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.165 -0.471 . . . . 75.41 112.233 177.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -67.02 -20.99 65.95 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.176 -1.046 . . . . 64.42 108.176 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LYS . . . . . 0.407 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 33.5 mtmt -91.79 -15.21 28.61 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.548 0.69 . . . . 74.22 109.716 177.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.445 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -129.84 51.86 8.28 Favored Pre-proline 0 C--O 1.241 0.647 0 CA-C-N 115.375 -0.829 . . . . 61.41 112.683 -175.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.445 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.8 Cg_exo -68.56 -20.66 40.88 Favored 'Trans proline' 0 C--N 1.365 1.416 0 N-CA-C 108.546 -1.367 . . . . 72.55 108.546 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -63.25 -43.21 98.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 113.187 -1.824 . . . . 75.32 109.549 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TRP . . . . . 0.45 ' HE1' ' HG3' ' A' ' 83' ' ' GLU . 67.8 t90 -76.02 -47.7 23.82 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 121.943 0.878 . . . . 71.23 110.419 176.419 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.488 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.3 tm? -58.89 -44.29 91.12 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.181 -1.372 . . . . 74.12 112.221 -172.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.7 p -52.76 -54.15 37.98 Favored 'General case' 0 C--N 1.316 -0.879 0 O-C-N 123.54 0.525 . . . . 73.41 111.67 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.24 -45.49 76.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.108 1.363 . . . . 72.41 111.703 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -64.6 -43.9 92.32 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 112.511 0.56 . . . . 74.52 112.511 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.579 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 77.2 mt -55.54 -39.68 70.87 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 123.382 0.426 . . . . 74.01 111.135 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -62.29 -26.23 68.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.387 0.613 . . . . 74.11 112.224 -178.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.6 t -83.52 -22.26 32.51 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.693 -0.685 . . . . 71.22 110.311 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PHE . . . . . 0.47 ' CD1' HG23 ' A' ' 72' ' ' THR . 48.4 m-85 -98.05 -57.42 2.22 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.281 -0.418 . . . . 64.23 111.784 -178.095 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.543 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.4 mm? -85.34 113.19 49.14 Favored Pre-proline 0 N--CA 1.423 -1.778 0 N-CA-C 109.009 -0.737 . . . . 74.31 109.009 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.17 -33.38 72.56 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.276 2.651 . . . . 73.32 115.532 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.49 28.22 8.9 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 121.912 0.863 . . . . 73.13 112.525 -176.059 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.579 ' SD ' ' HB3' ' A' ' 37' ' ' LEU . 23.2 ttm -89.25 106.55 18.51 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 115.275 1.583 . . . . 75.24 115.275 -175.791 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -111.78 79.23 1.19 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.214 -2.143 . . . . 50.42 105.214 169.44 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.19 -2.0 57.96 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.145 -0.934 . . . . 74.24 111.727 -173.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -78.39 45.84 0.59 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 122.818 1.294 . . . . 73.0 112.678 -174.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -117.04 97.92 6.19 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 107.118 -1.438 . . . . 70.45 107.118 174.217 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.2 m -81.86 83.72 7.11 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-O 121.86 0.838 . . . . 74.12 112.053 -175.074 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.74 -33.55 58.11 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-O 122.529 1.157 . . . . 71.54 110.837 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -137.48 167.51 20.32 Favored Pre-proline 0 N--CA 1.384 -3.769 0 C-N-CA 126.695 1.998 . . . . 73.33 106.501 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -81.93 -148.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 122.001 1.801 . . . . 72.32 110.664 174.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.4 m -76.26 37.28 0.16 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 124.291 1.036 . . . . 75.21 111.776 -176.589 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 76.5 m-20 -64.18 148.25 95.85 Favored Pre-proline 0 N--CA 1.44 -0.975 0 C-N-CA 123.605 0.762 . . . . 73.31 112.983 -175.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -58.31 -35.12 99.04 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 123.479 2.786 . . . . 73.05 112.68 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -72.6 -31.27 65.05 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.171 0.51 . . . . 71.4 109.96 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 94.6 t -67.8 -52.03 44.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.347 -0.983 . . . . 75.31 108.347 177.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 47.1 mm -55.06 -43.45 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 114.478 -1.237 . . . . 74.03 109.849 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -58.71 -40.53 83.98 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.133 -0.94 . . . . 72.34 111.039 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 37.0 ttt180 -64.81 -37.55 88.01 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.681 0.753 . . . . 75.42 110.554 178.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.441 ' O ' ' HB2' ' A' ' 64' ' ' ARG . 94.5 mt-30 -72.66 -48.68 37.29 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 114.492 -1.231 . . . . 73.4 111.525 -176.648 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.468 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.3 mm? -67.36 -30.61 70.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 115.269 -0.878 . . . . 75.44 110.885 -178.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -54.06 -46.08 71.86 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.658 1.183 . . . . 74.23 110.222 174.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ARG . . . . . 0.543 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 26.1 mmt180 -56.39 -36.65 69.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 114.626 -1.17 . . . . 65.31 112.594 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.8 mt -71.04 -31.0 67.34 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.7 0.259 . . . . 73.31 111.7 -177.61 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -59.32 -35.74 74.37 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.055 -0.72 . . . . 74.2 109.055 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.82 -27.41 60.28 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 115.072 -0.967 . . . . 73.21 112.103 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -70.66 -52.7 19.47 Favored 'General case' 0 N--CA 1.423 -1.778 0 C-N-CA 120.824 -0.35 . . . . 73.32 111.36 -179.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.42 143.75 5.32 Favored Glycine 0 CA--C 1.477 -2.319 0 C-N-CA 118.835 -1.65 . . . . 61.44 114.537 -173.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.404 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.2 ptm -67.38 -30.67 70.51 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.887 -1.523 . . . . 71.2 106.887 168.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.7 -37.37 59.54 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 114.36 -1.291 . . . . 64.11 108.538 177.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.47 HG23 ' CD1' ' A' ' 40' ' ' PHE . 86.6 m -62.19 -38.73 90.21 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 114.912 -1.04 . . . . 71.1 111.089 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' TRP . . . . . 0.485 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 39.8 t-105 -68.25 -36.06 78.86 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.491 -0.559 . . . . 75.23 109.491 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . 0.613 ' HE2' ' OE2' ' A' ' 9' ' ' GLU . 85.5 mttt -58.17 -52.27 66.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 120.763 0.316 . . . . 74.4 110.199 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -60.34 -38.48 83.91 Favored 'General case' 0 N--CA 1.405 -2.688 0 CA-C-N 115.433 -0.803 . . . . 72.21 111.136 179.147 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -61.14 -50.58 72.63 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-N 115.112 -0.949 . . . . 74.51 110.798 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ILE . . . . . 0.547 HG23 ' O ' ' A' ' 91' ' ' GLU . 46.5 mm -70.15 -30.89 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.627 -0.829 . . . . 63.42 110.573 -177.469 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.84 -47.47 82.59 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.376 -0.829 . . . . 74.31 109.874 176.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -73.28 -37.25 66.32 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.951 -0.568 . . . . 74.32 111.239 177.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -50.45 -54.27 23.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.846 1.259 . . . . 74.31 109.449 178.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.6 m -66.71 -44.4 81.76 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.687 -0.688 . . . . 65.13 111.347 -178.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -61.62 -54.24 45.59 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.291 0.567 . . . . 65.42 111.097 -175.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . 0.45 ' HG3' ' HE1' ' A' ' 32' ' ' TRP . 22.5 mm-40 -70.21 -40.62 74.43 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.173 -0.921 . . . . 74.41 113.485 -175.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.6 mt -80.32 -39.8 27.98 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 120.011 -0.676 . . . . 65.31 112.63 -174.638 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -169.2 -96.62 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.03 0.377 . . . . 65.13 110.821 179.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . 0.446 ' O ' HD12 ' A' ' 88' ' ' LEU . 34.8 m -141.04 173.28 5.04 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 104.945 -2.243 . . . . 64.12 104.945 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . 0.44 ' HD2' ' HB ' ' A' ' 86' ' ' VAL . 5.6 Cg_endo -50.89 105.48 0.1 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 121.859 1.706 . . . . 71.21 110.3 171.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LEU . . . . . 0.495 HD22 ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -50.39 -53.3 30.28 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 125.314 1.446 . . . . 74.32 111.227 -172.446 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -154.2 48.81 0.62 Allowed 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 104.344 -2.465 . . . . 61.51 104.344 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' MET . . . . . 0.503 ' O ' HD22 ' A' ' 94' ' ' LEU . 65.7 mtt 74.31 146.14 0.08 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.655 -2.066 . . . . 71.34 109.84 -170.529 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLU . . . . . 0.547 ' O ' HG23 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -71.73 -35.18 70.08 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.273 1.035 . . . . 73.53 110.817 178.107 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.534 ' HA ' HG11 ' A' ' 95' ' ' VAL . 31.3 mm -59.42 -49.8 90.58 Favored Pre-proline 0 C--N 1.279 -2.487 0 CA-C-N 114.353 -1.294 . . . . 74.33 114.043 -172.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -54.85 -35.46 88.78 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.211 1.941 . . . . 74.51 111.259 174.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LEU . . . . . 0.503 HD22 ' O ' ' A' ' 90' ' ' MET . 4.0 mm? -71.42 -33.6 69.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.845 -1.07 . . . . 73.12 110.916 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' VAL . . . . . 0.534 HG11 ' HA ' ' A' ' 92' ' ' ILE . 4.3 p -83.59 -33.63 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 C-N-CA 119.355 -0.938 . . . . 71.24 112.3 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.3 t -55.71 -26.39 44.98 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 113.768 -1.56 . . . . 64.41 112.068 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.421 HG22 ' O ' ' A' ' 94' ' ' LEU . 12.0 tt -69.02 -30.38 46.45 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.096 0 CA-C-N 116.505 -0.316 . . . . 75.51 110.59 -177.683 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 16.7 t90 28.49 80.77 0.02 OUTLIER 'General case' 0 C--O 1.244 0.812 0 C-N-CA 127.265 2.226 . . . . 74.14 116.019 -177.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.64 -172.45 23.88 Favored Glycine 0 N--CA 1.418 -2.516 0 CA-C-N 115.042 -0.981 . . . . 62.14 112.243 175.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -91.17 48.96 0.7 Allowed 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 123.866 3.044 . . . . 74.45 111.409 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 . . . . . 0 C--N 1.3 -1.573 0 CA-C-N 115.957 -0.565 . . . . 73.11 110.606 179.97 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.41 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 42.8 tpp . . . . . 0 C--O 1.222 -0.368 0 CA-C-O 122.065 0.936 . . . . 73.2 108.98 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -74.8 24.85 0.09 Allowed 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 114.338 1.236 . . . . 75.41 114.338 -174.511 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.429 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.2 -15.1 59.63 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 122.411 1.1 . . . . 51.51 109.588 178.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 96' ' ' SER . 1.1 pt-20 -65.35 -41.71 93.57 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 113.808 -1.542 . . . . 71.22 111.52 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.2 m -74.89 -17.23 60.61 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.448 -0.797 . . . . 70.43 109.857 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.429 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.9 mm -87.48 -50.67 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-O 122.138 0.971 . . . . 60.3 108.887 -176.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.3 mmt180 -84.72 6.7 23.2 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.911 -1.495 . . . . 72.13 113.148 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -44.14 122.53 2.96 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 124.902 1.281 . . . . 71.55 112.798 -177.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.407 ' OD1' ' HG ' ' A' ' 18' ' ' LEU . 28.0 t-20 -162.86 150.73 13.73 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 104.559 -2.385 . . . . 71.32 104.559 176.096 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . 0.28 21.8 p30 -145.72 -44.5 0.21 Allowed 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 115.562 1.69 . . . . 73.24 115.562 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.52 -46.32 90.47 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 119.201 0.91 . . . . 71.32 111.833 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -67.29 -44.23 79.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.985 -0.552 . . . . 74.03 109.832 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.407 ' HG ' ' OD1' ' A' ' 14' ' ' ASN . 89.5 mt -66.07 -39.54 90.16 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.375 -0.829 . . . . 73.32 111.58 -177.669 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 73.0 t-105 -65.42 -43.84 89.29 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 110.274 -0.269 . . . . 75.35 110.274 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.98 -44.36 96.25 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 120.863 0.363 . . . . 72.34 110.666 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 17.9 t-105 -60.45 -48.59 81.1 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.587 -0.733 . . . . 75.31 110.583 175.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.463 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 33.9 tp -58.4 -53.04 62.81 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.675 -0.693 . . . . 73.4 109.862 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -53.85 -46.09 63.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 123.528 0.731 . . . . 64.13 112.441 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.552 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 3.9 mmp_? -72.4 -43.39 63.97 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 120.18 -0.608 . . . . 72.53 112.396 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.426 HD12 HD13 ' A' ' 84' ' ' LEU . 2.1 tm? -68.21 -42.34 80.0 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.047 0.451 . . . . 62.32 109.81 -176.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 33' ' ' LEU . 1.2 mt -68.56 -25.75 65.06 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 122.854 0.461 . . . . 72.42 110.936 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.4 t -71.56 -18.53 62.24 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 108.99 -0.744 . . . . 75.32 108.99 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.552 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.32 -2.29 52.44 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 121.725 0.774 . . . . 74.44 109.489 178.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.428 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.4 m-80 -137.92 50.21 3.11 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.165 -0.925 . . . . 73.11 111.78 -177.277 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.428 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.2 Cg_exo -65.62 -23.98 56.13 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 121.604 1.536 . . . . 65.2 109.197 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -66.1 -39.58 90.09 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 112.997 -1.911 . . . . 71.13 111.095 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.803 ' HE3' HD22 ' A' ' 33' ' ' LEU . 84.4 t90 -76.06 -44.73 37.64 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.492 -1.299 . . . . 75.24 107.492 -175.157 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.803 HD22 ' HE3' ' A' ' 32' ' ' TRP . 3.5 mm? -53.4 -56.96 12.51 Favored 'General case' 0 N--CA 1.407 -2.601 0 CA-C-N 113.015 -1.902 . . . . 64.52 113.61 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.552 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 3.4 p -53.74 -44.64 70.11 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.927 0.767 . . . . 63.31 111.133 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.92 72.23 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.673 1.589 . . . . 41.12 111.22 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.51 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.1 mmmt -69.28 -35.79 76.41 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-N 115.956 -0.565 . . . . 72.51 111.691 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 97.2 mt -60.61 -30.97 70.18 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 123.09 0.244 . . . . 52.34 110.817 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 34' ' ' SER . 10.3 mtp180 -66.85 -26.75 67.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.328 0.585 . . . . 73.55 111.906 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -78.4 -38.01 42.65 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.716 -0.674 . . . . 74.52 109.434 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.493 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 86.5 m-85 -80.31 -59.47 2.69 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.676 -0.693 . . . . 75.0 111.404 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.1 mm? -89.33 110.89 42.04 Favored Pre-proline 0 N--CA 1.432 -1.35 0 N-CA-C 109.269 -0.641 . . . . 63.22 109.269 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -70.85 -19.65 30.64 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.218 1.945 . . . . 73.23 111.851 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 p -114.13 28.58 8.65 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.086 -0.961 . . . . 71.42 109.935 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.844 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -43.33 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.941 1.4 . . . . 64.02 112.351 -175.432 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.09 60.06 4.71 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-O 123.088 1.423 . . . . 71.24 108.368 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.844 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.4 pp -81.03 -9.78 59.79 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.23 -1.805 . . . . 71.44 110.799 -176.234 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.25 -14.16 60.14 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.743 -1.117 . . . . 64.35 110.218 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.4 t -85.87 103.79 14.94 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 115.348 -0.842 . . . . 51.52 108.861 178.469 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.1 t -142.13 81.56 1.76 Allowed 'General case' 0 N--CA 1.428 -1.563 0 N-CA-C 107.878 -1.156 . . . . 70.02 107.878 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -39.58 94.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.84 -1.073 . . . . 73.22 111.743 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.25 155.85 53.26 Favored Pre-proline 0 N--CA 1.383 -3.819 0 CA-C-N 113.346 -1.752 . . . . 61.11 106.918 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.16 -145.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.558 1.677 0 C-N-CA 124.013 3.142 . . . . 52.42 112.164 174.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.0 m -74.73 38.37 0.12 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 123.864 0.866 . . . . 62.41 113.28 -175.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 57' ' ' VAL . 4.5 m-20 -62.08 149.52 86.18 Favored Pre-proline 0 N--CA 1.435 -1.196 0 C-N-CA 124.417 1.087 . . . . 72.42 110.544 177.565 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.45 -46.83 24.85 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 123.613 2.876 . . . . 65.44 113.703 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -74.34 -23.77 59.08 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.866 0.691 . . . . 64.35 112.866 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.46 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 87.0 t -72.7 -39.51 60.39 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 N-CA-C 108.289 -1.004 . . . . 70.35 108.289 177.257 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.11 -48.01 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 108.136 -1.061 . . . . 72.14 108.136 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 23.5 t-160 -52.03 -43.12 63.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.93 0.892 . . . . 74.33 110.708 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.406 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 65.2 ttt-85 -54.73 -41.37 70.29 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.084 0.953 . . . . 61.44 111.897 178.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.8 mt-30 -73.31 -39.45 65.3 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 115.225 -0.898 . . . . 71.24 110.509 -175.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -75.29 -31.09 60.59 Favored 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 114.603 -1.18 . . . . 73.34 110.883 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 28.6 t-20 -53.89 -47.03 71.52 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.691 1.196 . . . . 73.22 110.602 175.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.5 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 32.2 mmt-85 -53.84 -36.62 62.76 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 113.659 -1.61 . . . . 74.21 111.888 178.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.3 mt -72.05 -36.68 69.67 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.95 0.405 . . . . 63.43 111.051 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.43 -25.21 66.64 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.392 -0.822 . . . . 75.3 109.086 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -31.27 59.91 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.431 -0.804 . . . . 72.15 110.832 176.271 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.28 -57.17 5.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-O 121.436 0.636 . . . . 70.42 109.869 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -172.55 141.66 6.37 Favored Glycine 0 CA--C 1.466 -2.987 0 CA-C-N 115.122 -0.944 . . . . 21.25 111.387 -174.143 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.488 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 1.9 mpt? -70.45 -30.67 67.57 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.318 -1.734 . . . . 74.4 106.318 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.93 -29.01 58.19 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 113.437 -1.71 . . . . 74.41 108.11 176.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.3 m -70.47 -34.03 71.94 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.241 -0.89 . . . . 62.34 109.421 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.581 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 69.7 t-105 -63.67 -46.89 83.51 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.198 -0.668 . . . . 63.5 109.198 175.182 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 70' ' ' MET . 82.8 mttt -58.56 -36.0 73.24 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 115.968 -0.56 . . . . 65.45 111.521 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.43 ' O ' ' HB3' ' A' ' 78' ' ' ASN . 49.0 m -72.7 -47.22 48.97 Favored 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 123.147 0.579 . . . . 65.4 110.953 177.732 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.493 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 81.4 t80 -55.79 -50.44 70.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 123.328 0.651 . . . . 55.51 111.73 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.637 HG21 ' HB2' ' A' ' 94' ' ' LEU . 41.0 mm -62.87 -30.75 50.26 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.944 -0.571 . . . . 72.15 111.19 -176.709 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.43 ' HB3' ' O ' ' A' ' 75' ' ' SER . 3.6 t-20 -58.86 -46.51 87.58 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 109.422 -0.584 . . . . 64.1 109.422 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -73.16 -39.65 65.48 Favored 'General case' 0 C--O 1.198 -1.646 0 CA-C-N 115.487 -0.778 . . . . 70.32 110.445 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.428 HD21 HD21 ' A' ' 26' ' ' LEU . 2.3 tm? -50.33 -53.87 25.72 Favored 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 124.776 1.23 . . . . 74.51 109.249 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.98 -36.53 84.69 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.893 -0.594 . . . . 55.31 111.266 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -73.36 -54.2 8.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.98 0.419 . . . . 64.02 111.658 -176.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -74.98 -24.02 58.37 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.641 -0.709 . . . . 73.54 112.298 -172.01 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.426 HD13 HD12 ' A' ' 25' ' ' LEU . 85.4 mt -91.22 4.51 52.1 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.31 -0.556 . . . . 74.2 112.014 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 72.12 -46.84 0.65 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 114.221 1.193 . . . . 50.05 114.221 174.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.453 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 47.3 t -56.88 126.68 73.04 Favored Pre-proline 0 C--N 1.315 -0.909 0 C-N-CA 124.488 1.115 . . . . 73.12 112.864 -175.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 86' ' ' VAL . 5.3 Cg_endo -86.75 102.09 0.58 Allowed 'Trans proline' 0 N--CA 1.44 -1.64 0 C-N-CA 122.466 2.111 . . . . 60.44 110.426 173.173 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 mp -69.81 -53.15 19.55 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.211 -0.449 . . . . 54.14 109.84 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.1 t70 173.96 -50.77 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.557 1.143 . . . . 63.4 107.968 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.9 ttt -177.47 153.12 0.88 Allowed 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 104.89 -2.263 . . . . 53.13 104.89 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.547 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.1 pm0 -71.46 -42.37 68.23 Favored 'General case' 0 C--O 1.206 -1.216 0 CA-C-N 118.696 0.68 . . . . 73.32 112.342 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.637 ' O ' HG22 ' A' ' 95' ' ' VAL . 35.1 mm -54.23 -39.39 74.22 Favored Pre-proline 0 CA--C 1.594 2.66 0 C-N-CA 125.486 1.514 . . . . 64.25 114.118 -175.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -52.3 -41.8 64.12 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 122.126 1.884 . . . . 72.14 111.035 170.503 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.637 ' HB2' HG21 ' A' ' 77' ' ' ILE . 3.7 mm? -76.29 -25.03 54.45 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.756 -1.111 . . . . 75.22 110.128 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.637 HG22 ' O ' ' A' ' 92' ' ' ILE . 4.6 m -74.62 -29.02 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-O 122.43 1.11 . . . . 63.04 110.789 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.478 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 6.0 t -81.76 1.18 35.73 Favored 'General case' 0 C--N 1.275 -2.631 0 CA-C-N 113.846 -1.524 . . . . 64.52 111.476 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 18.2 tt -57.38 -30.84 36.77 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 N-CA-C 112.981 0.734 . . . . 73.43 112.981 -173.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 24.5 p-90 . . . . . 0 C--N 1.318 -0.77 0 N-CA-C 112.362 0.504 . . . . 74.31 112.362 -177.697 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 C--O 1.213 -0.826 0 N-CA-C 112.227 0.455 . . . . 74.34 112.227 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -104.24 23.5 12.99 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 120.919 0.39 . . . . 72.43 110.08 174.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.444 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.95 -17.58 57.04 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.812 1.292 . . . . 73.22 108.857 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.546 ' HB2' ' HB2' ' A' ' 96' ' ' SER . 0.8 OUTLIER -59.17 -45.65 90.44 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 113.178 -1.828 . . . . 74.51 114.088 -177.745 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 65.0 m -76.22 -16.49 59.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.311 0.577 . . . . 73.31 110.663 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.444 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.0 mm -82.47 -44.26 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 121.937 0.875 . . . . 64.31 108.938 -176.214 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -102.19 7.27 40.92 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.678 -1.146 . . . . 75.54 111.984 -175.287 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -35.21 122.31 0.58 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 126.279 1.831 . . . . 51.31 115.028 -172.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -145.2 151.6 38.67 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.479 -2.786 . . . . 74.22 103.479 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -128.7 -72.58 0.6 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 118.636 0.653 . . . . 72.43 112.244 -174.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.2 -38.21 90.26 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.32 0.859 . . . . 73.41 113.32 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -66.29 -37.84 86.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-O 121.886 0.85 . . . . 55.52 110.542 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.421 HD13 HD22 ' A' ' 94' ' ' LEU . 86.4 mt -75.32 -40.79 58.09 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.639 -1.164 . . . . 73.51 110.238 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 44.5 t-105 -64.39 -42.07 96.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 75.4 110.49 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.88 93.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.355 -0.384 . . . . 53.31 110.689 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -60.89 -50.55 72.95 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.685 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.82 -53.04 62.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.505 -0.77 . . . . 43.43 109.287 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.32 -42.4 95.29 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 115.583 -0.735 . . . . 72.12 112.774 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 20.4 tpt180 -72.62 -41.68 65.28 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 121.93 -0.482 . . . . 74.21 111.411 -177.691 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.572 HD12 HD13 ' A' ' 84' ' ' LEU . 2.0 tm? -69.78 -40.89 75.78 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.601 -0.518 . . . . 74.42 109.601 -176.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.491 HD13 HD23 ' A' ' 33' ' ' LEU . 5.9 mt -69.36 -25.13 64.03 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 112.398 0.518 . . . . 54.31 112.398 176.738 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -67.58 -19.67 65.28 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.677 -0.86 . . . . 52.33 108.677 175.784 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 35.3 mtmt -99.03 -2.1 38.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.635 -0.712 . . . . 65.24 109.491 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.418 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.2 m-80 -145.49 52.85 1.7 Allowed Pre-proline 0 C--O 1.243 0.74 0 N-CA-C 112.717 0.636 . . . . 73.24 112.717 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 15.8 Cg_exo -68.16 -22.83 40.2 Favored 'Trans proline' 0 C--N 1.356 0.926 0 N-CA-C 108.864 -1.245 . . . . 54.31 108.864 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.64 -43.63 88.85 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 113.477 -1.692 . . . . 63.12 110.583 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.593 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.4 t90 -71.6 -43.18 66.71 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 108.832 -0.803 . . . . 75.44 108.832 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.632 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.6 tm? -58.28 -44.81 88.64 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 114.395 -1.275 . . . . 75.12 109.053 -176.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.514 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.0 m -60.17 -48.54 81.31 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.358 -0.383 . . . . 75.33 111.249 176.943 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -39.6 70.65 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.742 0.817 . . . . 64.24 111.785 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.0 mmmt -75.57 -35.95 60.51 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 121.048 -0.261 . . . . 62.25 111.217 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 66.3 mt -58.76 -30.34 67.44 Favored 'General case' 0 C--O 1.203 -1.392 0 N-CA-C 110.466 -0.198 . . . . 63.04 110.466 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 34' ' ' SER . 88.5 mtt180 -58.55 -26.56 63.69 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 123.259 0.35 . . . . 60.54 111.624 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.3 t -88.42 -50.15 6.49 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 109.641 -0.503 . . . . 73.21 109.641 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.444 ' CD1' HG23 ' A' ' 72' ' ' THR . 75.5 m-85 -70.05 -46.06 65.77 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.476 0.917 . . . . 73.34 113.476 -175.388 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.538 HD23 ' H ' ' A' ' 45' ' ' ASP . 9.3 mp -87.7 113.47 54.57 Favored Pre-proline 0 C--N 1.312 -1.062 0 C-N-CA 123.993 0.917 . . . . 73.0 110.056 -178.154 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 41' ' ' LEU . 30.0 Cg_endo -61.81 -29.9 83.61 Favored 'Trans proline' 0 N--CA 1.482 0.813 0 C-N-CA 123.712 2.941 . . . . 64.33 114.155 -174.615 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.1 p -112.55 7.04 18.76 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.39 0.614 . . . . 61.22 110.308 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.417 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 26.5 mtt 41.7 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 127.312 2.245 . . . . 63.34 112.188 -172.799 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.538 ' H ' HD23 ' A' ' 41' ' ' LEU . 35.3 t70 -98.11 59.54 1.39 Allowed 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.406 -1.331 . . . . 73.42 107.406 176.008 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -96.34 -11.47 25.79 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.657 -1.611 . . . . 72.34 111.78 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -80.45 37.61 0.4 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 124.436 1.094 . . . . 73.1 111.87 -175.158 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.6 m -91.85 -0.34 57.51 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.804 -0.635 . . . . 72.44 111.495 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 72.7 m -91.44 64.65 5.11 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.454 0.645 . . . . 73.02 112.23 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.413 ' HD1' ' HG3' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -82.41 -32.47 29.08 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 122.67 1.224 . . . . 73.44 109.557 173.5 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 44.6 mt-10 -93.76 172.8 5.4 Favored Pre-proline 0 C--N 1.264 -3.126 0 CA-C-N 112.487 -2.142 . . . . 53.11 106.574 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 39.8 Cg_endo -66.45 -169.87 0.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 121.27 1.314 . . . . 62.24 111.85 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.0 m -78.18 38.55 0.29 Allowed 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 123.488 0.715 . . . . 64.05 112.248 -175.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.615 ' HB2' HG23 ' A' ' 57' ' ' VAL . 96.1 m-20 -57.65 149.72 50.37 Favored Pre-proline 0 N--CA 1.438 -1.067 0 C-N-CA 123.984 0.914 . . . . 73.44 111.931 -177.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -44.79 -51.86 6.85 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 124.144 3.23 . . . . 72.33 113.011 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -73.22 -26.27 61.07 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 113.416 0.895 . . . . 53.22 113.416 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.615 HG23 ' HB2' ' A' ' 54' ' ' ASN . 72.2 t -65.65 -38.64 82.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 108.575 -0.898 . . . . 71.5 108.575 175.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.9 mm -70.53 -50.21 46.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 115.478 -0.783 . . . . 74.5 109.812 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -52.73 -39.99 62.64 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.241 1.017 . . . . 74.35 110.953 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -57.57 -40.62 79.35 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 125.079 1.352 . . . . 63.44 111.856 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 58.9 mt-30 -76.12 -39.46 55.1 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.657 -0.702 . . . . 75.01 110.602 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.46 -30.66 71.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 114.933 -1.031 . . . . 63.41 111.26 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.423 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 47.4 t30 -55.58 -34.37 64.74 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.834 1.254 . . . . 73.31 111.165 177.768 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -63.32 -30.16 71.34 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.644 -0.707 . . . . 74.34 111.969 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.0 mt -73.09 -31.89 64.64 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.086 0.469 . . . . 73.23 110.212 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.495 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 70.9 t80 -61.92 -29.83 70.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.294 -0.866 . . . . 73.55 109.117 177.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.21 -21.52 36.37 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 114.868 -1.06 . . . . 74.0 111.781 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -82.37 -47.18 12.62 Favored 'General case' 0 N--CA 1.419 -2.021 0 O-C-N 122.148 -0.345 . . . . 72.35 111.389 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.66 142.86 4.2 Favored Glycine 0 CA--C 1.473 -2.586 0 C-N-CA 120.275 -0.964 . . . . 62.45 112.56 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.548 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.64 -31.18 68.03 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 106.95 -1.5 . . . . 70.2 106.95 170.492 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.5 64.05 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.595 -1.184 . . . . 60.23 108.264 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.444 HG23 ' CD1' ' A' ' 40' ' ' PHE . 96.1 m -58.1 -40.61 81.6 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.084 -0.962 . . . . 54.22 110.217 176.226 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.446 ' HE1' HG22 ' A' ' 97' ' ' ILE . 65.4 t-105 -61.65 -46.89 87.85 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.97 -0.559 . . . . 73.04 109.906 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 70' ' ' MET . 34.7 mtmt -60.79 -42.79 98.25 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.549 -0.296 . . . . 72.4 111.359 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.4 m -66.06 -42.24 89.74 Favored 'General case' 0 N--CA 1.412 -2.36 0 C-N-CA 123.04 0.536 . . . . 74.24 111.128 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.429 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 79.0 t80 -61.49 -51.25 69.42 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.518 -0.765 . . . . 74.01 111.574 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.553 HG21 ' HB2' ' A' ' 94' ' ' LEU . 41.9 mm -61.7 -33.28 56.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.303 -0.408 . . . . 72.43 111.878 -175.895 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.57 -45.2 94.0 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.127 -0.694 . . . . 74.02 109.127 176.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.443 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 85.2 m-20 -68.1 -40.15 82.66 Favored 'General case' 0 C--O 1.195 -1.808 0 CA-C-N 115.475 -0.784 . . . . 75.54 110.704 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.497 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 1.5 tm? -50.04 -51.4 42.61 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.039 1.336 . . . . 74.41 108.894 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 72.8 m -67.39 -36.9 82.24 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.95 -1.023 . . . . 53.32 112.187 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -76.59 -40.1 50.54 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 123.398 0.679 . . . . 75.51 112.209 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 38.8 mt-10 -85.75 -29.25 24.01 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.773 1.027 . . . . 71.21 113.773 -172.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.572 HD13 HD12 ' A' ' 25' ' ' LEU . 95.8 mt -90.81 -28.26 18.33 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 113.706 1.002 . . . . 63.43 113.706 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -148.34 -169.58 3.38 Favored 'General case' 0 C--N 1.283 -2.284 0 N-CA-C 104.602 -2.37 . . . . 75.1 104.602 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.0 m -82.17 134.17 49.58 Favored Pre-proline 0 C--N 1.283 -2.284 0 N-CA-C 107.421 -1.326 . . . . 71.3 107.421 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -22.93 100.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 1 C-N-CA 126.096 4.53 . . . . 71.05 114.171 -174.619 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.8 mt -64.16 -34.26 77.66 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 115.257 -0.883 . . . . 74.33 110.48 -176.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.3 t70 58.19 37.13 26.22 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 123.126 1.441 . . . . 74.25 110.889 173.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -143.46 32.35 1.32 Allowed 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.712 -1.588 . . . . 73.21 106.712 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.584 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -70.69 -39.76 73.3 Favored 'General case' 0 C--O 1.192 -1.938 0 CA-C-N 114.38 -1.282 . . . . 73.44 112.971 -174.979 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.537 ' O ' HG22 ' A' ' 95' ' ' VAL . 44.5 mm -55.74 -45.73 99.84 Favored Pre-proline 0 CA--C 1.574 1.886 0 C-N-CA 123.783 0.833 . . . . 72.15 112.107 -175.396 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -50.95 -37.53 56.53 Favored 'Trans proline' 0 CA--C 1.555 1.573 0 C-N-CA 121.921 1.747 . . . . 64.32 111.566 171.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.553 ' HB2' HG21 ' A' ' 77' ' ' ILE . 4.3 mm? -76.68 -31.69 57.43 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.838 -0.619 . . . . 73.41 110.911 176.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.584 HG13 ' O ' ' A' ' 91' ' ' GLU . 6.5 m -66.54 -29.47 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.301 0 CA-C-O 122.566 1.174 . . . . 73.1 110.815 -177.484 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.546 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 31.3 t -75.47 -16.23 60.34 Favored 'General case' 0 C--N 1.27 -2.88 0 CA-C-N 113.379 -1.737 . . . . 72.32 113.077 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.459 HG22 ' O ' ' A' ' 94' ' ' LEU . 10.7 tt -72.38 -5.28 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 CA-C-O 121.362 0.601 . . . . 72.02 111.617 -172.645 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.495 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 47.2 t90 . . . . . 0 C--N 1.319 -0.759 0 C-N-CA 125.166 1.386 . . . . 71.03 110.4 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.1 ttt . . . . . 0 CA--C 1.505 -0.783 0 CA-C-O 123.511 1.624 . . . . 73.11 111.067 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.521 ' O ' HD13 ' A' ' 11' ' ' ILE . 10.2 m-20 -141.82 24.25 2.04 Favored 'General case' 0 C--N 1.273 -2.75 0 CA-C-N 111.596 -2.547 . . . . 62.44 106.099 173.294 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HG2' ' A' ' 12' ' ' ARG . . . -74.41 -34.75 63.34 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-N 113.852 -1.522 . . . . 74.1 107.641 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.558 ' HB3' HG23 ' A' ' 92' ' ' ILE . 1.7 pm0 -51.47 -45.35 62.72 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 113.68 -1.6 . . . . 74.14 112.093 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.4 m -56.62 -40.6 75.66 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.362 1.065 . . . . 71.34 111.051 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.521 HD13 ' O ' ' A' ' 7' ' ' ASP . 1.2 mp -83.92 -43.21 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.024 0 CA-C-N 113.958 -1.474 . . . . 73.22 111.022 -175.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.472 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 35.9 mmt180 -69.1 -65.52 0.7 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 116.032 1.864 . . . . 74.3 116.032 -170.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.549 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 2.5 tm? -176.45 141.1 0.39 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.114 0.87 . . . . 61.54 110.991 -172.232 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.46 ' N ' HD13 ' A' ' 13' ' ' LEU . 6.7 p30 -153.65 138.0 16.67 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 106.593 -1.632 . . . . 54.3 106.593 168.305 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -152.63 153.13 32.72 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.379 -0.528 . . . . 70.22 110.581 -175.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.4 -30.56 71.29 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.112 0.965 . . . . 72.32 112.073 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -65.7 -26.03 67.58 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.142 0.496 . . . . 74.14 111.692 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.81 -35.61 64.9 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.782 -0.821 . . . . 71.54 108.782 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.473 ' HB2' ' CD1' ' A' ' 97' ' ' ILE . 77.0 t-105 -65.38 -45.38 84.28 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.423 -0.808 . . . . 73.24 109.086 177.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.68 87.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 72.22 110.992 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -59.93 -50.83 72.22 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.848 0.717 . . . . 73.01 110.715 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.14 -51.43 70.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.514 -0.767 . . . . 72.15 110.075 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.2 t -60.14 -42.8 91.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.514 -0.767 . . . . 71.25 112.018 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.513 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -69.45 -45.89 67.99 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.322 -0.622 . . . . 72.44 109.322 -176.432 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.413 ' CD1' HD13 ' A' ' 84' ' ' LEU . 2.2 tm? -65.93 -42.32 90.24 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.534 -0.543 . . . . 55.43 109.534 -177.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.644 HD13 HD23 ' A' ' 33' ' ' LEU . 7.6 mt -72.5 -25.49 61.42 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 112.942 0.719 . . . . 62.35 112.942 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 42.6 t -68.03 -20.14 64.96 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.336 -0.987 . . . . 65.22 108.336 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.2 mtmt -92.78 -7.22 47.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.666 -0.697 . . . . 75.31 109.955 177.413 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.425 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 43.7 m-80 -136.74 54.13 8.43 Favored Pre-proline 0 C--O 1.243 0.724 0 CA-C-N 115.986 -0.552 . . . . 55.53 112.162 -174.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.425 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.4 Cg_exo -68.84 -23.71 34.95 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.309 1.339 . . . . 63.21 109.081 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.7 -44.61 95.78 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 113.93 -1.486 . . . . 75.23 109.637 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.612 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.4 t90 -74.57 -45.13 47.38 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 121.453 0.644 . . . . 74.35 109.967 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.644 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -60.21 -45.31 93.61 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.738 -1.119 . . . . 63.42 110.687 -174.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.485 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.7 m -57.39 -46.53 83.34 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 123.236 0.335 . . . . 51.22 111.19 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.94 -40.54 80.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.287 1.035 . . . . 62.12 111.573 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.612 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.6 mmmt -73.94 -29.96 62.3 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 120.822 -0.351 . . . . 74.31 111.876 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.2 mt -62.66 -30.27 71.25 Favored 'General case' 0 C--O 1.2 -1.552 0 N-CA-C 109.71 -0.478 . . . . 74.33 109.71 173.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 34' ' ' SER . 70.8 mtt180 -62.87 -31.13 72.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.947 0.403 . . . . 74.14 111.395 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 t -85.28 -39.04 18.17 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.34 0.591 . . . . 75.22 110.826 -179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.6 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.0 m-85 -84.65 -46.45 11.49 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.175 0.806 . . . . 74.41 113.175 -176.464 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 mp -89.74 119.43 69.46 Favored Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 123.328 0.651 . . . . 65.12 110.489 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.51 -41.49 19.81 Favored 'Trans proline' 0 C--N 1.324 -0.714 0 C-N-CA 122.218 1.945 . . . . 72.33 110.872 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.0 t -86.5 -8.92 57.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.494 -0.775 . . . . 60.54 112.594 -176.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.445 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 12.4 mtt 28.75 91.5 0.01 OUTLIER 'General case' 0 C--O 1.236 0.395 0 C-N-CA 126.632 1.973 . . . . 65.22 112.89 -173.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -99.65 61.62 1.16 Allowed 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 123.263 1.506 . . . . 51.13 110.309 177.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 pp -89.19 -19.64 25.19 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 113.157 -1.838 . . . . 72.45 110.494 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.55 5.39 50.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.305 1.05 . . . . 74.32 108.809 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 41.9 t -85.7 21.8 1.77 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.965 -1.016 . . . . 60.23 109.354 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.6 m -73.14 94.04 1.89 Allowed 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 122.03 0.919 . . . . 73.23 108.899 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -20.45 62.2 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.405 -1.271 . . . . 72.34 113.149 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.534 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 37.9 mt-10 -137.04 170.39 10.89 Favored Pre-proline 0 N--CA 1.38 -3.942 0 N-CA-C 107.307 -1.368 . . . . 75.31 107.307 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.04 -151.43 0.01 OUTLIER 'Trans proline' 0 CA--C 1.562 1.894 0 C-N-CA 123.605 2.87 . . . . 54.33 112.962 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.6 p -75.33 37.18 0.13 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.004 0.922 . . . . 65.22 112.663 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.414 ' O ' HG12 ' A' ' 58' ' ' ILE . 78.5 m-20 -71.65 148.69 92.9 Favored Pre-proline 0 N--CA 1.431 -1.399 0 C-N-CA 123.987 0.915 . . . . 74.23 112.591 -176.45 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -59.88 -34.26 95.53 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.296 2.664 . . . . 73.34 113.132 -177.756 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -75.19 -23.82 57.73 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.35 0.595 . . . . 73.13 110.996 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.534 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 95.7 t -74.01 -45.26 49.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 108.047 -1.094 . . . . 54.23 108.047 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 54' ' ' ASN . 47.5 mm -58.67 -37.64 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 114.227 -1.351 . . . . 74.1 109.787 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -54.38 -43.74 71.66 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.712 -0.676 . . . . 73.35 111.6 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.52 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 2.0 tpp180 -54.9 -54.46 42.28 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.968 0.907 . . . . 74.41 110.791 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -59.46 -42.59 92.35 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.296 -1.32 . . . . 72.53 111.79 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.452 HD12 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -79.64 -30.85 41.45 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.418 -0.81 . . . . 71.43 111.535 -177.586 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.52 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 22.7 t-20 -53.42 -48.25 68.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 124.896 1.278 . . . . 71.12 110.177 174.105 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -55.07 -30.91 60.63 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 113.549 -1.66 . . . . 73.35 112.978 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.1 mt -72.16 -42.47 65.89 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 120.526 0.203 . . . . 71.44 111.283 -178.356 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.582 ' CD1' ' HB3' ' A' ' 98' ' ' TRP . 55.5 t80 -71.32 -24.95 62.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.638 0.732 . . . . 73.32 109.028 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -28.38 64.58 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.159 -0.928 . . . . 71.14 109.875 175.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.557 ' HB2' HG21 ' A' ' 72' ' ' THR . 37.3 mm-40 -74.79 -56.77 4.43 Favored 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 108.217 -1.031 . . . . 71.34 108.217 173.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -168.97 145.84 9.79 Favored Glycine 0 CA--C 1.479 -2.187 0 CA-C-N 115.495 -0.775 . . . . 53.23 112.147 -175.308 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.513 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 56.7 ttp -68.8 -32.27 71.88 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 105.606 -1.998 . . . . 74.23 105.606 170.198 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.7 68.32 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.623 -1.626 . . . . 72.22 108.3 176.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.6 HG23 ' CD1' ' A' ' 40' ' ' PHE . 96.8 m -57.36 -40.76 78.78 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.577 -0.738 . . . . 61.23 110.167 175.472 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.476 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.5 t-105 -61.51 -50.62 71.97 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 110.35 -0.241 . . . . 72.31 110.35 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 70' ' ' MET . 80.6 mttt -55.38 -45.14 76.58 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.111 0.482 . . . . 74.13 111.151 178.308 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.2 m -66.97 -40.58 87.51 Favored 'General case' 0 N--CA 1.406 -2.658 0 C-N-CA 123.845 0.858 . . . . 73.12 111.495 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.444 ' HZ ' ' CD2' ' A' ' 33' ' ' LEU . 81.9 t80 -61.26 -47.77 84.51 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.876 -0.602 . . . . 75.44 110.903 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 73' ' ' TRP . 49.6 mm -62.7 -33.47 60.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 CA-C-O 121.311 0.577 . . . . 62.33 110.055 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 44.2 t-20 -63.41 -39.27 94.06 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.376 -0.829 . . . . 63.33 109.184 176.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -75.33 -42.97 53.14 Favored 'General case' 0 C--O 1.194 -1.817 0 N-CA-C 110.252 -0.277 . . . . 74.34 110.252 178.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.404 HD21 HD21 ' A' ' 26' ' ' LEU . 1.5 tm? -49.86 -53.97 22.39 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 125.495 1.518 . . . . 72.33 109.212 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.466 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 52.7 t -63.31 -35.7 81.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.456 -0.793 . . . . 75.44 111.321 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -76.2 -54.6 6.56 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.183 0.516 . . . . 73.34 111.335 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -71.05 -39.31 72.33 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.539 -0.755 . . . . 64.43 112.627 -172.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.413 HD13 ' CD1' ' A' ' 25' ' ' LEU . 96.4 mt -82.58 -8.4 59.61 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.397 -0.521 . . . . 64.32 109.912 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 t70 49.86 68.66 0.71 Allowed 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 125.503 1.521 . . . . 60.23 112.86 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.31 116.86 10.32 Favored Pre-proline 0 C--N 1.296 -1.754 0 N-CA-C 105.967 -1.864 . . . . 65.04 105.967 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -69.49 103.74 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 121.768 1.645 . . . . 75.31 109.638 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.466 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 44.1 mt -81.18 -46.98 14.05 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 120.715 -0.394 . . . . 74.22 110.815 -175.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t70 70.13 -45.14 0.58 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 124.756 1.223 . . . . 74.41 110.961 -173.174 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 25.7 mmt -87.95 40.38 0.94 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 124.453 1.101 . . . . 64.1 110.096 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.641 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -69.19 -46.32 67.74 Favored 'General case' 0 C--O 1.191 -2.006 0 C-N-CA 120.437 -0.505 . . . . 75.12 111.356 -177.144 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.558 HG23 ' HB3' ' A' ' 9' ' ' GLU . 33.2 mm -64.49 -43.37 71.2 Favored Pre-proline 0 CA--C 1.567 1.6 0 C-N-CA 124.202 1.001 . . . . 73.11 109.632 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.549 ' HA ' ' O ' ' A' ' 13' ' ' LEU . 65.0 Cg_exo -50.22 -37.16 48.66 Favored 'Trans proline' 0 CA--C 1.565 2.03 0 C-N-CA 121.346 1.364 . . . . 62.54 112.167 167.075 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.448 ' O ' HG22 ' A' ' 97' ' ' ILE . 3.8 mm? -70.82 -40.46 72.46 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.589 -0.278 . . . . 70.23 110.479 173.048 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.641 HG13 ' O ' ' A' ' 91' ' ' GLU . 4.4 m -65.1 -33.93 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 CA-C-O 122.629 1.204 . . . . 75.04 110.562 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.463 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 23.0 t -64.27 -19.8 65.64 Favored 'General case' 0 C--N 1.28 -2.417 0 CA-C-N 113.467 -1.697 . . . . 44.22 112.701 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.473 ' CD1' ' HB2' ' A' ' 19' ' ' TRP . 13.5 tt -68.24 -26.78 34.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 C-N-CA 120.169 -0.612 . . . . 52.2 111.043 -174.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.582 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . 57.5 m95 . . . . . 0 N--CA 1.42 -1.936 0 CA-C-O 121.796 0.808 . . . . 73.41 110.854 175.41 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.8 tpp . . . . . 0 C--O 1.242 0.66 0 CA-C-O 122.021 0.915 . . . . 73.43 110.326 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -110.99 24.81 12.47 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.034 -0.985 . . . . 73.41 110.203 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.498 ' HA ' HD13 ' A' ' 11' ' ' ILE . . . -75.79 -12.7 60.23 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.772 1.272 . . . . 72.33 109.128 175.627 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.35 71.42 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 113.191 -1.822 . . . . 72.42 112.347 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 60.0 m -59.29 -47.46 85.3 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 122.464 1.126 . . . . 63.44 110.184 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.546 ' H ' HD12 ' A' ' 11' ' ' ILE . 4.2 mp -72.84 -42.08 61.02 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.237 0 CA-C-N 114.177 -1.374 . . . . 64.33 112.426 -175.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -76.69 -34.07 58.21 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.123 0.416 . . . . 73.43 112.123 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.2 mt 67.05 171.72 0.26 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.975 1.31 . . . . 72.5 113.595 -175.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -89.23 170.19 10.81 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.568 -0.742 . . . . 73.11 110.079 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.401 ' OD1' ' HB2' ' A' ' 17' ' ' ASN . 22.0 t-20 -159.26 133.59 7.75 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.082 -0.34 . . . . 74.52 110.082 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.49 -32.68 71.71 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.028 0.751 . . . . 74.11 113.028 -176.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASN . . . . . 0.401 ' HB2' ' OD1' ' A' ' 15' ' ' ASN . 89.5 m-20 -64.05 -35.45 80.77 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.499 -0.556 . . . . 75.23 109.499 177.84 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.71 -36.12 81.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 41.24 110.226 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -65.45 -45.51 83.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 71.55 110.089 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.66 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 74.4 110.329 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.407 ' CZ2' HD23 ' A' ' 88' ' ' LEU . 2.6 t-105 -56.96 -50.18 73.42 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.674 -0.694 . . . . 72.5 110.2 174.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -53.15 61.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 124.191 0.932 . . . . 73.13 109.307 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.4 t -55.57 -51.61 56.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 111.922 0.341 . . . . 64.21 111.922 -178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -71.97 -34.18 68.74 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 112.483 0.549 . . . . 74.45 112.483 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.431 HD22 ' HE2' ' A' ' 28' ' ' LYS . 1.9 tm? -73.79 -46.47 45.27 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.048 -1.093 . . . . 54.1 108.048 -176.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.466 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -65.95 -25.18 67.0 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 123.905 0.882 . . . . 72.33 110.439 -179.207 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.1 m -64.2 -17.61 63.71 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.224 0.535 . . . . 72.24 110.246 174.353 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.452 ' C ' ' HD3' ' A' ' 30' ' ' PRO . 30.1 mtmt -100.78 0.97 39.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.227 -0.657 . . . . 74.32 109.227 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.466 ' OD1' ' HA ' ' A' ' 26' ' ' LEU . 5.2 m120 -125.19 45.75 1.47 Allowed Pre-proline 0 CA--C 1.547 0.855 0 CA-C-N 115.629 -0.714 . . . . 70.32 110.315 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.452 ' HD3' ' C ' ' A' ' 28' ' ' LYS . 2.8 Cg_endo -71.3 -20.61 27.71 Favored 'Trans proline' 0 C--N 1.355 0.89 0 CA-C-N 121.321 1.508 . . . . 55.43 110.484 -173.465 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -75.83 -42.53 49.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.264 -1.335 . . . . 74.52 109.247 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.6 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.8 t90 -75.96 -47.75 23.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.735 -0.666 . . . . 65.34 111.1 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.505 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -56.71 -49.23 75.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.81 -1.087 . . . . 74.51 111.064 -173.61 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.634 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.5 p -54.44 -49.11 70.79 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 123.56 0.537 . . . . 75.22 111.522 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.47 -45.88 66.3 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.837 1.255 . . . . 71.25 112.501 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.6 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.8 mmmt -71.1 -30.25 66.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.567 0.222 . . . . 60.5 110.595 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.511 HD11 ' HB3' ' A' ' 61' ' ' GLN . 87.4 mt -66.91 -35.62 80.41 Favored 'General case' 0 C--O 1.202 -1.437 0 N-CA-C 109.776 -0.453 . . . . 61.01 109.776 174.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.634 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -60.45 -33.77 73.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.977 0.894 . . . . 64.14 109.825 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.437 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 59.6 m -74.32 -50.69 17.77 Favored 'General case' 0 N--CA 1.394 -3.267 0 C-N-CA 125.222 1.409 . . . . 51.33 112.626 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.564 ' CD1' HG23 ' A' ' 72' ' ' THR . 51.9 m-85 -78.43 -44.78 23.87 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.604 0.964 . . . . 71.42 113.604 -177.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 44' ' ' MET . 7.9 mp -85.69 129.03 56.34 Favored Pre-proline 0 C--N 1.301 -1.518 0 C-N-CA 123.578 0.751 . . . . 74.14 112.157 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 41' ' ' LEU . 10.0 Cg_endo -93.18 -16.15 0.83 Allowed 'Trans proline' 0 CA--C 1.556 1.606 0 C-N-CA 122.372 2.048 . . . . 60.21 110.874 169.182 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.8 p -114.4 28.61 8.62 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 124.307 1.043 . . . . 64.41 111.535 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.474 ' HA ' HD23 ' A' ' 41' ' ' LEU . 1.4 mpp? -37.66 110.0 0.11 Allowed 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 126.238 1.815 . . . . 65.34 114.181 -173.498 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -113.31 56.56 0.69 Allowed 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.791 -1.559 . . . . 75.45 106.791 170.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 pp -95.07 -15.96 23.03 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.576 -1.647 . . . . 50.15 110.846 -174.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -85.91 -2.22 58.05 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 122.003 0.906 . . . . 73.11 109.795 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.7 m -81.51 39.25 0.53 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 115.2 -0.909 . . . . 62.31 111.481 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.1 t -87.69 76.81 8.78 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-O 121.901 0.858 . . . . 62.22 108.822 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 122.732 1.253 . . . . 60.05 110.933 176.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -113.53 160.62 30.97 Favored Pre-proline 1 N--CA 1.379 -4.019 0 N-CA-C 105.478 -2.045 . . . . 64.22 105.478 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -69.22 -141.48 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 122.803 2.335 . . . . 44.01 112.353 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -75.78 38.36 0.16 Allowed 'General case' 0 C--N 1.296 -1.721 0 C-N-CA 123.999 0.92 . . . . 73.31 112.88 -175.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.49 ' HB2' HG23 ' A' ' 57' ' ' VAL . 6.3 m-20 -60.03 143.52 87.98 Favored Pre-proline 0 N--CA 1.427 -1.594 0 C-N-CA 123.997 0.919 . . . . 74.13 109.52 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.08 -40.92 79.57 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.339 2.693 . . . . 64.23 113.704 -175.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.86 -30.28 61.3 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.32 -0.237 . . . . 74.24 110.948 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.49 HG23 ' HB2' ' A' ' 54' ' ' ASN . 84.0 t -66.46 -44.86 90.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 N-CA-C 108.249 -1.019 . . . . 72.44 108.249 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.45 -49.09 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 114.564 -1.198 . . . . 72.23 109.385 176.581 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.0 t-160 -56.24 -35.4 67.34 Favored 'General case' 0 C--O 1.206 -1.214 0 CA-C-N 116.281 -0.418 . . . . 75.53 111.123 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.496 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.5 ttt180 -58.93 -44.33 91.31 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.557 0.694 . . . . 72.05 111.206 176.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.511 ' HB3' HD11 ' A' ' 37' ' ' LEU . 59.0 mt-30 -72.21 -38.42 69.0 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.211 -0.904 . . . . 74.42 110.142 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -72.05 -30.18 64.9 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.891 -1.049 . . . . 72.54 110.439 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.552 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 9.2 t30 -61.64 -32.58 72.74 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 124.648 1.179 . . . . 71.35 109.398 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -67.52 -33.36 74.92 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 115.154 -0.93 . . . . 70.12 111.899 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -72.29 -37.93 68.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 109.11 -0.7 . . . . 64.33 109.11 176.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.552 ' HB3' ' O ' ' A' ' 63' ' ' ASN . 34.9 t80 -52.88 -43.92 66.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.483 -1.235 . . . . 72.51 108.415 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.81 -16.7 60.69 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.975 -1.012 . . . . 73.23 113.345 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.459 ' HB2' HG21 ' A' ' 72' ' ' THR . 39.0 mm-40 -82.98 -44.3 15.42 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 118.671 0.668 . . . . 64.03 110.571 177.647 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 173.03 143.13 4.08 Favored Glycine 0 CA--C 1.475 -2.433 0 C-N-CA 120.019 -1.086 . . . . 53.12 112.678 -175.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.566 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.4 ptt? -70.47 -27.27 64.1 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 106.684 -1.599 . . . . 74.41 106.684 170.425 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.85 -34.36 57.85 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.391 -1.277 . . . . 75.5 108.16 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.564 HG23 ' CD1' ' A' ' 40' ' ' PHE . 93.3 m -63.6 -36.12 82.76 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.387 -0.824 . . . . 52.13 109.41 174.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -63.12 -50.88 68.72 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.636 -0.505 . . . . 72.14 109.636 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.566 ' HG3' ' O ' ' A' ' 70' ' ' MET . 84.3 mttt -54.75 -42.23 71.4 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.839 -0.619 . . . . 72.34 111.294 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -65.31 -47.68 75.73 Favored 'General case' 0 N--CA 1.411 -2.398 0 C-N-CA 123.256 0.622 . . . . 74.22 111.142 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -59.34 -51.08 71.46 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.332 -0.849 . . . . 75.0 111.104 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.2 mm -64.79 -36.91 78.81 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 O-C-N 123.411 0.444 . . . . 73.3 110.842 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -58.55 -46.31 87.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.05 -0.523 . . . . 74.03 110.083 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.502 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 72.1 m-20 -72.14 -39.33 68.86 Favored 'General case' 0 C--O 1.185 -2.306 0 C-N-CA 120.795 -0.362 . . . . 70.42 110.94 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.421 HD23 ' CH2' ' A' ' 32' ' ' TRP . 2.5 tm? -49.79 -54.2 20.64 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.963 1.305 . . . . 73.23 110.535 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.44 ' SG ' HD11 ' A' ' 88' ' ' LEU . 59.1 m -63.18 -32.26 73.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.073 -0.967 . . . . 42.24 111.246 -179.266 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -76.2 -52.86 9.18 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.631 -0.713 . . . . 74.44 111.14 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 28.9 mt-10 -66.76 -44.68 80.77 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.846 0.858 . . . . 43.24 112.582 -173.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 79.8 mt -80.28 -10.81 59.76 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 120.164 -0.614 . . . . 74.32 109.456 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.5 t70 55.74 71.15 0.57 Allowed 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.079 -1.418 . . . . 75.2 111.612 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.7 t -124.86 104.95 29.84 Favored Pre-proline 0 C--N 1.303 -1.419 0 CA-C-N 114.701 -1.136 . . . . 72.11 108.52 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -75.98 73.04 5.02 Favored 'Trans proline' 0 N--CA 1.449 -1.101 0 C-N-CA 122.011 1.807 . . . . 63.25 111.092 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.44 HD11 ' SG ' ' A' ' 81' ' ' CYS . 0.3 OUTLIER -95.87 -24.35 16.48 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.024 1.12 . . . . 64.13 114.024 -178.4 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 62.41 17.83 9.8 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 121.977 0.894 . . . . 71.22 111.247 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.521 ' O ' HD23 ' A' ' 94' ' ' LEU . 63.8 mtt -113.12 17.52 18.67 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.794 -1.093 . . . . 72.22 109.969 -177.557 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.637 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -60.9 -56.07 25.49 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.218 -0.446 . . . . 71.11 111.165 -175.7 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.535 ' O ' HG22 ' A' ' 95' ' ' VAL . 35.2 mm -66.64 -42.84 48.1 Favored Pre-proline 0 CA--C 1.571 1.764 0 C-N-CA 123.181 0.592 . . . . 72.12 110.728 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -48.05 -41.85 32.99 Favored 'Trans proline' 0 CA--C 1.557 1.638 0 C-N-CA 121.759 1.64 . . . . 62.3 111.943 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.698 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 4.3 mm? -69.45 -36.2 76.38 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 122.795 0.438 . . . . 72.0 110.804 173.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.637 HG13 ' O ' ' A' ' 91' ' ' GLU . 5.8 m -68.21 -35.02 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-O 121.986 0.898 . . . . 72.42 110.156 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.8 t -59.53 -26.42 65.32 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 125.501 1.52 . . . . 71.2 110.99 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.698 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 2.7 mt -50.09 -47.46 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 C-N-CA 123.883 0.873 . . . . 72.34 110.949 176.071 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.487 ' CD1' ' HA ' ' A' ' 66' ' ' PHE . 7.8 t-105 . . . . . 0 N--CA 1.409 -2.491 0 CA-C-O 122.813 1.292 . . . . 71.41 110.044 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.4 ' SD ' HD11 ' A' ' 92' ' ' ILE . 6.4 tpt . . . . . 0 N--CA 1.447 -0.601 0 N-CA-C 107.518 -1.289 . . . . 71.4 107.518 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.59 25.22 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.089 1.514 . . . . 61.5 115.089 -173.457 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.422 ' HB3' HG21 ' A' ' 92' ' ' ILE . . . -78.26 -17.44 56.67 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.857 1.313 . . . . 74.41 109.129 177.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.502 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -64.82 -31.49 72.75 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 113.408 -1.724 . . . . 75.15 112.925 179.047 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.534 ' HB2' HD12 ' A' ' 11' ' ' ILE . 51.7 m -61.86 -27.84 69.08 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.672 0.748 . . . . 72.34 110.483 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.534 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.62 -29.74 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.427 -1.26 . . . . 71.35 111.76 -173.302 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.431 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 37.2 mmt180 -85.91 -38.13 18.35 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.9 1.074 . . . . 75.11 113.9 -172.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.15 -51.85 0.27 Allowed 'General case' 0 CA--C 1.552 1.027 0 N-CA-C 117.407 2.373 . . . . 73.41 117.407 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 42.3 m-80 -126.42 -80.59 0.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.588 1.329 . . . . 52.12 114.588 -173.454 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 67.99 84.67 0.15 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.187 0.995 . . . . 74.31 110.92 -175.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.68 -47.17 55.96 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.379 -0.828 . . . . 72.31 113.086 -177.149 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -61.23 -33.1 72.95 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.126 0.417 . . . . 71.54 112.126 -176.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.441 HD13 HD22 ' A' ' 94' ' ' LEU . 94.3 mt -64.87 -33.95 77.21 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.056 -0.52 . . . . 74.01 111.595 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.504 ' CA ' HD11 ' A' ' 97' ' ' ILE . 65.9 t-105 -63.9 -39.96 95.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.32 -0.4 . . . . 74.31 110.289 177.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.48 -38.95 91.26 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.593 -0.276 . . . . 73.23 110.435 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 76.7 t90 -58.76 -50.38 74.15 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.861 -0.792 . . . . 75.52 108.861 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.16 -52.89 62.94 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 114.893 -1.049 . . . . 74.14 110.773 -176.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 67.2 t -53.16 -51.76 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.124 0.57 . . . . 65.45 112.117 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.43 -0.35 . . . . 62.32 111.533 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -74.44 -47.12 35.59 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 107.695 -1.224 . . . . 63.41 107.695 -176.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.527 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -68.11 -24.74 65.06 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 124.237 1.015 . . . . 73.43 111.211 -178.67 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.421 ' HA ' ' HB2' ' A' ' 53' ' ' SER . 48.0 t -63.53 -15.11 57.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.079 -0.711 . . . . 64.13 109.079 174.412 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -100.39 -4.53 28.84 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-O 121.064 0.459 . . . . 72.24 110.084 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.527 ' OD1' ' HA ' ' A' ' 26' ' ' LEU . 1.6 p-10 -133.93 48.36 3.17 Favored Pre-proline 0 N--CA 1.472 0.658 0 N-CA-C 113.362 0.875 . . . . 52.21 113.362 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.4 Cg_exo -72.36 -22.95 21.11 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.612 1.541 . . . . 52.14 111.154 -175.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -75.6 -51.32 13.13 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.857 -0.794 . . . . 60.52 108.857 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.548 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 60.9 t90 -60.72 -44.14 96.97 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.06 -0.973 . . . . 74.24 109.668 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.546 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -58.08 -43.4 86.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.627 -0.715 . . . . 75.1 109.641 -178.383 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 50.7 m -61.99 -49.44 76.06 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 116.26 -0.427 . . . . 52.33 110.964 177.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.14 -39.85 63.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.727 0.811 . . . . 64.32 111.612 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.548 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.2 mmmt -74.21 -33.48 63.4 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.979 -0.289 . . . . 73.52 111.306 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.9 mt -59.1 -34.1 71.62 Favored 'General case' 0 C--O 1.19 -2.05 0 N-CA-C 110.342 -0.244 . . . . 73.21 110.342 174.304 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.489 ' HG2' ' SD ' ' A' ' 44' ' ' MET . 90.5 mtt180 -59.33 -39.12 82.14 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.287 0.565 . . . . 61.55 110.51 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -72.26 -38.91 68.76 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 114.907 -1.042 . . . . 44.34 110.396 -176.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.544 ' CD1' HG23 ' A' ' 72' ' ' THR . 69.7 m-85 -89.29 -50.19 6.28 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 113.559 0.948 . . . . 73.02 113.559 -176.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.436 ' HB3' ' H ' ' A' ' 44' ' ' MET . 8.3 mp -79.65 128.38 74.89 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 123.591 0.756 . . . . 71.13 110.498 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -72.85 -22.12 20.48 Favored 'Trans proline' 0 C--N 1.321 -0.914 0 C-N-CA 122.23 1.953 . . . . 74.44 111.761 177.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.5 p -108.62 -30.59 8.14 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 113.871 1.063 . . . . 73.14 113.871 -176.341 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.489 ' SD ' ' HG2' ' A' ' 38' ' ' ARG 0.29 1.1 ptm 41.32 92.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 116.205 1.928 . . . . 52.33 116.205 -175.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -99.12 56.8 1.05 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 123.171 1.463 . . . . 72.42 108.244 177.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.406 HD22 ' HB3' ' A' ' 34' ' ' SER . 3.5 pp -92.18 -17.33 25.03 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.577 -1.647 . . . . 64.04 112.634 -173.128 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -88.74 0.21 56.7 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.025 0.917 . . . . 74.23 110.744 -176.294 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.3 m -81.78 69.46 8.46 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.615 -0.721 . . . . 65.22 109.697 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.3 m -93.15 82.89 4.58 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-O 121.896 0.855 . . . . 73.12 109.582 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.66 -28.28 30.76 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 122.698 1.237 . . . . 52.55 110.333 176.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -134.11 167.53 22.42 Favored Pre-proline 1 N--CA 1.376 -4.158 0 N-CA-C 104.948 -2.241 . . . . 62.0 104.948 176.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -76.83 -149.45 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 121.691 1.594 . . . . 75.44 110.648 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.421 ' HB2' ' HA ' ' A' ' 27' ' ' SER . 29.3 p -76.0 38.65 0.17 Allowed 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 123.666 0.786 . . . . 74.1 112.788 -177.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.94 150.98 46.86 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 125.156 1.382 . . . . 72.44 111.591 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -52.87 -43.85 53.1 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 123.529 2.819 . . . . 72.44 113.956 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.4 -28.92 61.3 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 120.977 -0.289 . . . . 73.43 111.37 -178.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 99.8 t -65.87 -52.54 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.362 -1.347 . . . . 62.41 107.362 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.0 mm -55.48 -47.41 78.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.641 -1.163 . . . . 75.43 110.148 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -54.16 -40.93 67.94 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.337 0.655 . . . . 75.21 111.462 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.0 ttm180 -68.17 -41.44 81.52 Favored 'General case' 0 C--N 1.297 -1.705 0 C-N-CA 123.412 0.685 . . . . 74.55 111.093 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.563 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 46.0 mt-30 -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.349 -0.841 . . . . 71.12 111.175 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.427 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -77.9 -30.58 50.73 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.452 -0.795 . . . . 65.32 110.678 -178.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.457 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 24.0 t-20 -54.59 -46.01 73.71 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.244 1.017 . . . . 64.24 110.622 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -54.03 -33.83 58.34 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.114 -1.403 . . . . 71.3 112.075 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.9 mt -72.45 -42.92 64.47 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.734 0.302 . . . . 62.45 111.026 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -64.83 -32.51 74.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.815 -0.63 . . . . 74.25 109.581 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.9 -24.8 63.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.287 -0.87 . . . . 72.13 111.624 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.563 ' HB2' HG21 ' A' ' 72' ' ' THR . 32.2 mm-40 -74.29 -37.37 63.69 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 108.615 -0.883 . . . . 73.42 108.615 175.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.489 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . 170.81 138.78 2.59 Favored Glycine 0 N--CA 1.415 -2.737 0 CA-C-N 114.678 -1.146 . . . . 64.23 110.909 -176.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.534 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.48 -26.55 63.67 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 106.864 -1.532 . . . . 72.22 106.864 171.385 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.44 -37.54 65.81 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 113.986 -1.461 . . . . 72.31 108.374 174.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.563 HG21 ' HB2' ' A' ' 68' ' ' GLN . 53.1 m -58.99 -42.47 90.12 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.488 -0.778 . . . . 74.15 109.707 173.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.477 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -61.27 -46.0 92.15 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.03 -0.532 . . . . 72.33 110.639 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 70' ' ' MET . 95.2 mttt -53.76 -46.39 70.91 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 122.581 0.352 . . . . 71.45 110.852 175.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.7 m -65.63 -42.28 91.67 Favored 'General case' 0 N--CA 1.407 -2.593 0 C-N-CA 123.033 0.533 . . . . 62.2 111.756 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 94.5 t80 -58.37 -49.22 78.01 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.042 -0.527 . . . . 73.33 111.584 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.485 HG22 ' HG3' ' A' ' 91' ' ' GLU . 49.3 mm -61.13 -33.92 58.16 Favored 'Isoleucine or valine' 0 C--O 1.244 0.792 0 O-C-N 123.336 0.397 . . . . 70.31 111.177 -177.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.444 ' HA ' ' OE1' ' A' ' 91' ' ' GLU . 5.7 t30 -57.96 -49.02 78.21 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.857 -0.611 . . . . 65.5 110.156 175.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.6 m-20 -72.85 -40.12 65.97 Favored 'General case' 0 C--O 1.194 -1.846 0 CA-C-N 114.928 -1.033 . . . . 72.22 110.666 -178.204 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.509 HD21 HD21 ' A' ' 26' ' ' LEU . 2.5 tm? -50.95 -54.47 24.02 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 125.229 1.412 . . . . 72.2 109.732 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.7 m -65.95 -40.67 91.55 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.151 -0.477 . . . . 62.52 110.281 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -65.38 -49.02 70.89 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 73.15 111.986 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 33.9 mt-10 -81.11 -17.71 49.01 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 112.942 0.719 . . . . 72.4 112.942 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -103.17 -39.39 6.88 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 112.501 0.556 . . . . 75.44 112.501 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -138.3 -151.64 0.39 Allowed 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.871 -1.159 . . . . 71.45 107.871 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.2 m -105.04 166.45 11.43 Favored Pre-proline 0 C--N 1.295 -1.771 0 N-CA-C 107.35 -1.352 . . . . 70.02 107.35 175.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.9 86.69 0.73 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.501 1.467 . . . . 71.44 111.577 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.612 HD13 ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -77.48 -13.43 59.92 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-N 115.905 -0.589 . . . . 61.23 112.003 178.058 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.6 t70 53.48 83.63 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 116.1 1.889 . . . . 71.33 116.1 174.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.498 ' HG2' ' CD2' ' A' ' 88' ' ' LEU . 26.2 ptm -156.12 32.25 0.34 Allowed 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.04 -2.578 . . . . 75.03 104.04 168.74 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.606 ' O ' HG13 ' A' ' 95' ' ' VAL . 35.2 tt0 -60.4 -50.84 72.0 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 111.547 -2.569 . . . . 71.43 111.759 -172.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.547 ' O ' HG22 ' A' ' 95' ' ' VAL . 42.4 mm -60.56 -45.4 97.2 Favored Pre-proline 0 CA--C 1.559 1.29 0 C-N-CA 123.011 0.525 . . . . 72.21 111.536 -177.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -47.89 -37.25 28.67 Favored 'Trans proline' 0 CA--C 1.553 1.454 0 C-N-CA 121.911 1.741 . . . . 74.45 111.812 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.441 HD22 HD13 ' A' ' 18' ' ' LEU . 4.4 mm? -76.26 -34.98 59.14 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 122.797 0.439 . . . . 72.35 110.972 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.606 HG13 ' O ' ' A' ' 91' ' ' GLU . 5.2 m -68.53 -30.59 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-O 122.799 1.285 . . . . 75.31 110.748 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.431 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 30.0 t -83.5 2.86 34.81 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 113.635 -1.62 . . . . 61.15 112.39 -178.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.566 ' HA ' ' O ' ' A' ' 14' ' ' ASN . 9.7 tt -62.67 -25.86 39.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 114.143 1.164 . . . . 73.31 114.143 -170.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 94.2 m95 . . . . . 0 C--N 1.322 -0.619 0 O-C-N 121.777 -0.577 . . . . 71.22 111.533 -179.821 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.186 0 CA-C-O 122.048 0.928 . . . . 65.42 111.165 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -106.34 25.68 10.78 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 114.903 -1.044 . . . . 71.22 110.897 177.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.02 -17.25 57.3 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-O 121.396 0.617 . . . . 64.04 109.355 174.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.24 -40.4 64.52 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 126.049 1.74 . . . . 74.21 115.222 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 33.5 t -58.35 -41.52 84.88 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 124.457 1.103 . . . . 63.52 110.261 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.545 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.5 mp -87.2 -36.69 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.147 0 CA-C-N 114.711 -1.131 . . . . 71.44 111.648 -176.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -72.66 -49.48 31.41 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 114.405 1.261 . . . . 72.51 114.405 -176.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 63.1 -168.91 0.19 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.862 0.726 . . . . 61.32 110.054 -171.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -138.85 178.59 7.05 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 121.631 -0.668 . . . . 73.24 111.279 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -114.2 145.02 42.25 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.9 -1.148 . . . . 75.21 107.9 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -64.17 -29.38 70.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.096 0.558 . . . . 72.5 110.516 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -60.46 -39.01 86.03 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 109.082 -0.71 . . . . 72.43 109.082 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.436 HD21 HD13 ' A' ' 94' ' ' LEU . 6.7 tt -72.31 -38.4 68.72 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.152 -1.386 . . . . 72.55 109.182 -177.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.431 ' HA ' HD11 ' A' ' 97' ' ' ILE . 66.8 t-105 -60.77 -51.14 70.6 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.312 -0.404 . . . . 73.32 109.968 175.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.49 -38.23 86.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 115.689 -0.687 . . . . 70.4 110.558 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.7 t-105 -61.48 -50.89 70.94 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.302 0.376 . . . . 75.01 111.074 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.85 -50.15 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.529 -0.545 . . . . 53.42 109.529 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -61.16 -46.32 96.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.947 -0.569 . . . . 55.12 111.811 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.472 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 78.3 ttt180 -69.12 -42.48 75.99 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.7 -0.227 . . . . 73.42 111.606 -176.151 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.424 HD22 ' HE3' ' A' ' 28' ' ' LYS . 2.4 tm? -67.31 -43.73 80.96 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.446 -0.576 . . . . 62.43 109.446 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.442 HD13 HD13 ' A' ' 33' ' ' LEU . 1.5 mt -70.02 -25.18 63.46 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 122.444 0.298 . . . . 71.21 111.673 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -70.2 -12.91 61.92 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.794 -0.817 . . . . 73.12 108.794 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 7.0 mtmp? -101.17 -5.15 26.0 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.512 -0.551 . . . . 65.33 109.512 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.473 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 92.3 m-20 -136.72 52.06 5.52 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.411 -0.813 . . . . 74.32 111.172 -175.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.473 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 6.1 Cg_exo -71.97 -21.78 23.89 Favored 'Trans proline' 0 C--N 1.358 1.04 0 N-CA-C 108.687 -1.313 . . . . 64.43 108.687 -177.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.49 -36.93 68.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.49 -1.686 . . . . 73.54 109.914 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.592 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 69.2 t90 -75.11 -45.16 42.96 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.571 -0.852 . . . . 75.12 109.098 173.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.475 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 60.3 tp -56.46 -48.82 76.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.367 -1.288 . . . . 62.23 112.346 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.7 m -55.99 -36.74 68.24 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 123.575 0.547 . . . . 72.21 111.641 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.81 -38.84 87.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.382 0.611 . . . . 53.42 110.184 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.592 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.8 mmmt -76.53 -37.25 56.98 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.685 -0.406 . . . . 71.31 111.392 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 88.0 mt -54.37 -49.71 69.19 Favored 'General case' 0 C--O 1.186 -2.251 0 O-C-N 123.574 0.546 . . . . 75.11 110.264 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.498 ' HA ' ' HB3' ' A' ' 44' ' ' MET . 28.4 ptt180 -65.22 -30.49 71.39 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 113.463 0.912 . . . . 74.24 113.463 -178.07 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 72.1 m -69.93 -23.47 63.22 Favored 'General case' 0 N--CA 1.385 -3.709 0 CA-C-N 115.314 -0.857 . . . . 53.54 111.793 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.43 ' CD1' HG23 ' A' ' 72' ' ' THR . 57.7 m-85 -100.66 -44.11 5.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 123.825 0.85 . . . . 62.03 112.639 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.461 HD21 ' HG2' ' A' ' 64' ' ' ARG . 9.5 mp -76.59 120.48 81.85 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 124.438 1.095 . . . . 72.43 110.67 178.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -62.98 -34.5 70.64 Favored 'Trans proline' 0 CA--C 1.535 0.575 0 C-N-CA 122.953 2.436 . . . . 74.14 113.533 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.6 p -114.34 -5.37 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.18 0.514 . . . . 74.51 112.062 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.498 ' HB3' ' HA ' ' A' ' 38' ' ' ARG 0.286 6.4 ptt? 41.96 92.12 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 115.532 1.679 . . . . 71.43 115.532 -174.959 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -100.92 58.22 0.9 Allowed 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 107.908 -1.145 . . . . 62.42 107.908 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 pp -96.17 -5.18 41.17 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.743 -1.117 . . . . 74.21 112.915 -175.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -80.7 -13.34 59.09 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.767 0.794 . . . . 75.42 111.326 -176.267 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -75.53 91.09 2.78 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.195 -0.911 . . . . 75.4 110.153 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.1 t -141.74 76.53 1.55 Allowed 'General case' 0 N--CA 1.419 -1.975 0 N-CA-C 108.352 -0.981 . . . . 65.5 108.352 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.31 -28.56 69.29 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-N 113.83 -1.532 . . . . 74.03 112.475 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HB2' HG21 ' A' ' 57' ' ' VAL . 50.0 mt-10 -122.73 169.44 9.8 Favored Pre-proline 0 C--N 1.247 -3.864 0 N-CA-C 106.187 -1.783 . . . . 63.54 106.187 178.234 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -68.04 -156.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.558 1.685 0 C-N-CA 121.321 1.347 . . . . 71.33 111.517 173.038 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.0 m -75.72 39.12 0.16 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 124.154 0.982 . . . . 75.04 113.197 -174.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -57.08 149.6 44.83 Favored Pre-proline 0 N--CA 1.432 -1.354 0 C-N-CA 126.186 1.794 . . . . 63.32 111.295 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -46.65 -45.89 18.96 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.35 3.367 . . . . 70.15 114.243 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -74.6 -25.98 59.61 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.178 0.513 . . . . 74.13 110.966 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' A' ' 51' ' ' GLU . 95.5 t -73.97 -47.73 41.43 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.572 -0.899 . . . . 52.25 108.572 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.4 mm -59.02 -41.81 84.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.962 -1.017 . . . . 72.4 109.861 176.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -55.62 -46.58 77.36 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 115.643 -0.708 . . . . 62.4 110.025 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -58.89 -43.34 90.95 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.365 0.603 . . . . 74.15 111.209 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.33 -46.45 76.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.012 -0.995 . . . . 74.53 111.603 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.401 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -74.44 -30.59 61.96 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.465 -0.788 . . . . 75.42 111.918 -177.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -63.13 -38.45 91.23 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 123.706 0.802 . . . . 63.22 109.854 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.461 ' HG2' HD21 ' A' ' 41' ' ' LEU . 9.5 tpp85 -59.5 -29.46 67.88 Favored 'General case' 1 N--CA 1.375 -4.181 0 C-N-CA 124.924 1.29 . . . . 73.42 111.877 178.582 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -71.09 -38.07 72.42 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.795 -0.446 . . . . 73.4 109.795 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -69.08 -31.23 69.83 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.899 -0.778 . . . . 71.54 108.899 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.88 -26.72 66.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.436 -0.802 . . . . 55.1 110.944 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.525 ' HB2' HG21 ' A' ' 72' ' ' THR . 35.8 mm-40 -70.83 -48.56 53.42 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 107.782 -1.192 . . . . 75.24 107.782 174.243 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.407 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -174.92 139.69 4.95 Favored Glycine 0 CA--C 1.474 -2.499 0 CA-C-N 114.635 -1.166 . . . . 55.14 110.739 -176.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.619 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -66.08 -29.73 70.12 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 106.211 -1.774 . . . . 75.55 106.211 171.666 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.22 -35.54 59.0 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.789 -1.55 . . . . 63.5 108.718 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.525 HG21 ' HB2' ' A' ' 68' ' ' GLN . 91.1 m -58.75 -41.16 85.87 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.742 -0.663 . . . . 74.11 110.03 175.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.575 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -63.33 -49.37 74.2 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.441 -0.345 . . . . 65.04 110.424 176.982 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 70' ' ' MET . 86.7 mttt -54.7 -35.39 63.57 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.325 0.65 . . . . 74.33 111.545 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.1 m -72.17 -49.94 31.73 Favored 'General case' 0 N--CA 1.409 -2.507 0 N-CA-C 109.69 -0.485 . . . . 72.52 109.69 176.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -50.51 -48.51 56.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 124.125 0.97 . . . . 75.55 112.189 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.41 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 41.1 mm -57.4 -37.07 55.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 N-CA-C 112.644 0.609 . . . . 75.3 112.644 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -65.92 -34.06 77.26 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.288 0.566 . . . . 74.33 110.169 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.404 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 1.2 m-20 -78.21 -42.77 30.35 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.712 -0.676 . . . . 73.53 110.174 175.171 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.412 HD21 HD21 ' A' ' 26' ' ' LEU . 2.4 tm? -50.19 -54.52 20.29 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.869 1.668 . . . . 74.42 110.542 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 13.2 p -64.48 -33.36 75.71 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.379 -0.828 . . . . 71.42 111.643 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -75.93 -54.64 6.58 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.063 -0.971 . . . . 72.53 111.778 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 40.5 mt-10 -70.93 -31.35 67.93 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.504 0.927 . . . . 72.54 113.504 -170.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.5 -49.34 19.05 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 119.993 -0.683 . . . . 71.33 111.857 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -161.69 -97.3 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.13 0.269 . . . . 74.21 110.514 -176.902 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -140.64 165.02 32.72 Favored Pre-proline 0 C--N 1.3 -1.573 0 N-CA-C 105.445 -2.057 . . . . 74.32 105.445 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -43.5 107.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 122.967 2.444 . . . . 64.34 112.101 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -8.86 59.61 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.835 -1.075 . . . . 62.35 112.823 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -175.12 -161.64 0.1 Allowed 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 103.179 -2.897 . . . . 73.42 103.179 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.506 ' O ' HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -86.59 141.62 28.88 Favored 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 106.926 -1.509 . . . . 71.15 106.926 178.448 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.566 ' O ' HG13 ' A' ' 95' ' ' VAL . 36.2 tt0 -52.78 -52.25 57.44 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 124.977 1.311 . . . . 65.43 112.94 -175.059 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 95' ' ' VAL . 39.3 mm -64.44 -45.6 77.46 Favored Pre-proline 0 C--O 1.169 -3.154 0 CA-C-O 117.534 -1.222 . . . . 70.21 113.136 -172.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -49.38 -35.13 34.71 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 CA-C-N 122.837 2.049 . . . . 72.51 112.097 172.917 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.506 HD23 ' O ' ' A' ' 90' ' ' MET . 3.4 mm? -72.2 -36.59 69.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.691 -0.686 . . . . 71.54 109.385 175.553 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.575 ' HA ' ' CD1' ' A' ' 73' ' ' TRP . 2.9 m -69.87 -36.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-O 122.385 1.088 . . . . 74.31 109.993 177.047 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.6 m -70.42 5.24 1.86 Allowed 'General case' 0 C--N 1.293 -1.858 0 C-N-CA 127.694 2.398 . . . . 72.22 113.007 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.431 HD11 ' HA ' ' A' ' 19' ' ' TRP . 10.3 tp -66.61 -28.56 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.088 0.47 . . . . 55.34 111.163 -175.631 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 . . . . . 0 N--CA 1.421 -1.887 0 N-CA-C 108.126 -1.064 . . . . 72.31 108.126 -179.796 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 tpt . . . . . 0 N--CA 1.45 -0.469 0 CA-C-O 121.201 0.524 . . . . 72.43 110.162 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -78.32 25.09 0.24 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.933 0.893 . . . . 70.34 112.205 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.56 -13.27 60.09 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.22 -1.03 . . . . 64.3 108.22 174.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.432 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -60.88 -38.24 84.96 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.376 -1.284 . . . . 63.44 112.142 178.627 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.602 ' HB2' HD12 ' A' ' 11' ' ' ILE . 68.0 m -54.92 -32.17 60.89 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 124.679 1.192 . . . . 74.33 111.727 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.602 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -83.88 -25.91 7.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 C-N-CA 124.91 1.284 . . . . 74.31 110.322 -173.499 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -110.16 7.4 23.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.646 -0.707 . . . . 62.24 111.964 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.4 tt -51.35 121.43 6.27 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.576 1.151 . . . . 74.41 112.586 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.405 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 26.4 t-20 -152.42 149.43 28.58 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 105.093 -2.188 . . . . 71.01 105.093 177.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -122.17 -73.77 0.64 Allowed 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 118.815 -1.154 . . . . 65.42 113.122 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.97 -34.34 75.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.958 1.466 . . . . 72.12 114.958 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -70.26 -40.21 74.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 120.259 -0.576 . . . . 73.13 110.966 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.8 mt -74.44 -34.86 63.3 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.242 -0.436 . . . . 71.21 110.241 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.438 ' HB2' HD11 ' A' ' 97' ' ' ILE . 49.0 t-105 -61.15 -50.12 74.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.278 -0.419 . . . . 65.42 110.769 178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.11 85.73 Favored 'General case' 0 C--O 1.243 0.74 0 O-C-N 123.225 0.328 . . . . 43.55 110.902 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.439 ' HE1' HD22 ' A' ' 88' ' ' LEU . 22.2 t-105 -63.88 -51.03 66.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.739 -0.664 . . . . 73.32 110.948 176.004 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.8 tp -60.08 -49.2 78.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.998 -0.546 . . . . 62.03 110.076 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.406 ' HA ' HG21 ' A' ' 58' ' ' ILE . 42.3 t -57.42 -46.38 85.64 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 CA-C-N 115.681 -0.69 . . . . 73.35 111.446 179.072 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.521 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 19.7 tpt180 -68.52 -44.26 75.02 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 116.644 -0.253 . . . . 55.22 110.728 -176.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.415 HD12 HD13 ' A' ' 84' ' ' LEU . 1.9 tm? -67.93 -42.96 80.22 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 109.674 -0.491 . . . . 73.5 109.674 -176.405 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.409 HD21 HD21 ' A' ' 80' ' ' LEU . 2.3 mt -71.61 -24.53 61.9 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 112.008 0.373 . . . . 74.14 112.008 177.339 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.6 t -67.09 -23.28 65.83 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 107.723 -1.214 . . . . 71.24 107.723 175.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 31.1 mtmt -90.94 -10.2 43.32 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.66 -0.7 . . . . 70.44 110.084 178.133 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -135.4 52.3 6.86 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 122.883 0.473 . . . . 74.2 111.33 -177.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.01 -17.88 24.6 Favored 'Trans proline' 0 C--N 1.368 1.556 0 N-CA-C 108.759 -1.285 . . . . 72.22 108.759 -178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -71.55 -38.58 71.0 Favored 'General case' 0 N--CA 1.417 -2.099 0 CA-C-N 113.386 -1.734 . . . . 73.03 109.455 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.444 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.1 t90 -74.67 -47.98 28.75 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.657 -0.817 . . . . 71.35 109.554 176.291 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.55 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 52.8 tp -54.05 -51.48 63.92 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.009 -1.45 . . . . 70.31 112.418 -175.091 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.531 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.9 p -50.34 -51.79 42.63 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 123.878 0.736 . . . . 75.01 112.127 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.73 -43.48 76.63 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 125.083 1.353 . . . . 74.33 112.081 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.444 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.0 mmmt -74.05 -30.03 62.19 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.325 -0.235 . . . . 73.33 110.436 178.284 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 98.0 mt -63.77 -35.88 82.03 Favored 'General case' 0 C--O 1.187 -2.205 0 N-CA-C 109.256 -0.646 . . . . 73.21 109.256 173.434 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -61.51 -33.56 74.02 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.269 0.557 . . . . 73.35 110.562 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.3 m -74.56 -41.59 60.28 Favored 'General case' 0 N--CA 1.402 -2.855 0 C-N-CA 124.981 1.312 . . . . 72.03 112.324 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.57 ' CD1' HG23 ' A' ' 72' ' ' THR . 67.1 m-85 -88.99 -48.31 7.52 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 113.091 0.775 . . . . 74.45 113.091 -177.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 8.4 mp -89.85 139.0 27.57 Favored Pre-proline 0 C--N 1.295 -1.777 0 C-N-CA 124.425 1.09 . . . . 50.04 112.139 -177.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 41' ' ' LEU . 3.7 Cg_endo -91.04 -13.0 2.14 Favored 'Trans proline' 0 CA--C 1.551 1.326 0 C-N-CA 122.241 1.96 . . . . 73.43 109.284 166.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.9 p -114.37 26.59 10.13 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 125.668 1.587 . . . . 60.35 111.567 -172.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.454 ' HB3' ' HB2' ' A' ' 41' ' ' LEU 0.257 0.0 OUTLIER -59.11 96.08 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 115.946 1.832 . . . . 75.21 115.946 -173.943 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.413 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 16.4 m-20 -83.72 74.06 10.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.004 -1.48 . . . . 74.41 107.004 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 34' ' ' SER . 4.6 pp -95.81 -27.35 15.26 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-N 115.24 -0.891 . . . . 74.1 111.456 -178.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -103.66 6.13 36.85 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 122.265 1.031 . . . . 73.1 109.668 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 63.6 m -81.72 74.33 8.72 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 122.407 1.099 . . . . 41.32 109.464 177.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.4 t -90.52 83.33 5.84 Favored 'General case' 0 N--CA 1.403 -2.793 0 CA-C-N 114.36 -1.291 . . . . 64.11 110.142 -176.03 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.411 ' CE1' HG22 ' A' ' 57' ' ' VAL . 0.6 OUTLIER -79.76 -28.79 40.36 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 123.166 1.46 . . . . 75.31 108.696 170.026 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -135.0 161.87 61.11 Favored Pre-proline 1 N--CA 1.373 -4.313 0 CA-C-N 112.03 -2.35 . . . . 63.03 105.191 177.44 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.2 Cg_exo -67.81 -143.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.846 2.364 . . . . 73.52 111.917 175.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.9 m -76.91 37.64 0.19 Allowed 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 124.1 0.96 . . . . 71.4 110.489 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 52' ' ' PRO . 7.2 m-20 -65.32 152.23 92.39 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 126.795 2.038 . . . . 74.34 113.258 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -54.32 -41.67 74.36 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 123.954 3.103 . . . . 64.2 114.272 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.47 -29.69 61.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.225 0.536 . . . . 73.35 110.478 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 86.8 t -66.38 -51.65 55.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.207 -1.034 . . . . 71.4 108.207 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.406 HG21 ' HA ' ' A' ' 23' ' ' VAL . 46.9 mm -59.65 -41.56 85.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.561 -1.199 . . . . 71.43 109.709 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -56.42 -42.15 77.55 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.838 0.455 . . . . 74.22 111.251 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.529 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 21.2 ttt180 -61.21 -42.0 97.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.599 0.714 . . . . 75.41 110.953 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 84.6 mt-30 -71.39 -42.24 68.63 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.942 -1.026 . . . . 51.11 111.764 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.406 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -75.51 -31.11 60.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 115.347 -0.842 . . . . 72.34 110.547 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.529 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 23.7 t-20 -53.33 -49.77 66.4 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.957 1.303 . . . . 52.35 110.23 173.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.431 ' CB ' HD21 ' A' ' 41' ' ' LEU . 30.0 mmt180 -54.69 -33.6 61.14 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.553 -1.658 . . . . 54.11 113.071 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -67.02 -40.66 87.29 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.641 0.258 . . . . 71.25 110.575 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -67.17 -32.95 74.39 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.812 -0.81 . . . . 74.42 108.812 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.09 -18.96 63.27 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.321 -0.854 . . . . 64.25 111.281 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -79.52 -55.85 4.74 Favored 'General case' 0 N--CA 1.413 -2.277 0 N-CA-C 107.137 -1.431 . . . . 64.14 107.137 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -166.51 140.29 6.25 Favored Glycine 0 N--CA 1.42 -2.372 0 CA-C-N 114.132 -1.395 . . . . 73.1 111.036 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.445 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 45.8 ttm -65.13 -30.88 71.85 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 106.137 -1.801 . . . . 62.4 106.137 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.15 -35.52 59.16 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.641 -1.618 . . . . 61.52 109.123 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.57 HG23 ' CD1' ' A' ' 40' ' ' PHE . 54.9 m -59.96 -36.95 78.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.813 -0.631 . . . . 72.34 110.007 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.506 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 75.1 t-105 -61.94 -53.0 61.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.678 -0.49 . . . . 72.43 109.678 176.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.507 ' HA ' HG12 ' A' ' 95' ' ' VAL . 92.4 mttt -51.28 -46.58 62.5 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.89 0.876 . . . . 74.52 111.727 177.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.66 -44.11 74.79 Favored 'General case' 0 N--CA 1.41 -2.444 0 C-N-CA 123.035 0.534 . . . . 43.13 112.168 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -57.06 -46.02 82.79 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 122.816 0.446 . . . . 74.11 110.382 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.646 HG21 ' HB2' ' A' ' 94' ' ' LEU . 45.4 mm -63.71 -31.35 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.019 0 CA-C-N 115.751 -0.659 . . . . 74.12 111.565 -177.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.22 -40.77 94.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.5 -0.556 . . . . 73.42 109.5 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 82.7 m-20 -68.44 -42.28 79.06 Favored 'General case' 0 C--O 1.187 -2.221 0 CA-C-N 116.017 -0.538 . . . . 72.23 109.756 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.468 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -50.52 -53.91 26.49 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.085 1.354 . . . . 75.22 109.767 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.4 m -64.24 -35.14 79.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 45.34 111.403 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -76.33 -54.29 6.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.206 0.526 . . . . 73.3 112.105 -178.252 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 31.0 mt-10 -74.78 -22.57 58.68 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.734 1.013 . . . . 73.04 113.734 -169.353 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.415 HD13 HD12 ' A' ' 25' ' ' LEU . 94.6 mt -79.71 -42.13 25.29 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 119.046 -1.061 . . . . 62.01 111.823 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . 0.25 4.3 p30 -171.19 -90.48 0.01 OUTLIER 'General case' 0 C--O 1.241 0.641 0 N-CA-C 112.677 0.621 . . . . 74.34 112.677 174.274 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 69.4 t -130.51 148.04 68.37 Favored Pre-proline 0 C--N 1.301 -1.507 0 N-CA-C 106.297 -1.742 . . . . 74.32 106.297 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -39.22 109.0 0.08 OUTLIER 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 123.393 2.729 . . . . 74.45 112.207 173.27 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.439 HD22 ' HE1' ' A' ' 21' ' ' TRP . 0.7 OUTLIER -74.29 -15.58 60.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.026 -0.988 . . . . 71.2 112.91 -178.297 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.86 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 105.207 -2.146 . . . . 74.13 105.207 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.1 mmt -168.5 163.66 12.51 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 102.886 -3.005 . . . . 54.34 102.886 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.585 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.9 OUTLIER -72.01 -43.66 64.68 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 118.489 0.586 . . . . 75.14 111.105 -179.548 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.521 ' O ' HG22 ' A' ' 95' ' ' VAL . 29.5 mm -50.47 -44.14 81.95 Favored Pre-proline 0 CA--C 1.572 1.796 0 C-N-CA 125.7 1.6 . . . . 70.42 114.132 -171.642 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.03 -43.38 58.75 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.494 1.463 . . . . 65.41 110.793 174.56 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.646 ' HB2' HG21 ' A' ' 77' ' ' ILE . 2.8 mm? -75.15 -31.88 61.17 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.586 -1.188 . . . . 74.03 109.78 -179.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.585 HG13 ' O ' ' A' ' 91' ' ' GLU . 4.1 m -67.74 -31.36 52.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-O 122.176 0.989 . . . . 72.31 110.49 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.4 t -80.79 5.8 14.84 Favored 'General case' 0 C--N 1.281 -2.386 0 CA-C-N 113.708 -1.587 . . . . 33.03 112.408 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.438 HD11 ' HB2' ' A' ' 19' ' ' TRP . 15.4 tt -60.46 -27.81 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 CA-C-O 121.478 0.656 . . . . 64.52 110.448 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.428 -1.533 0 N-CA-C 106.913 -1.514 . . . . 64.01 106.913 173.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.8 tmm? . . . . . 0 CA--C 1.487 -1.479 0 N-CA-C 108.369 -0.974 . . . . 74.35 108.369 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -168.19 23.46 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 114.352 -1.294 . . . . 73.4 109.495 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.455 ' HB3' ' HB ' ' A' ' 92' ' ' ILE . . . -77.63 -12.03 59.93 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.765 1.269 . . . . 52.24 108.788 178.197 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.413 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -66.65 -30.57 70.86 Favored 'General case' 0 N--CA 1.415 -2.224 0 CA-C-N 112.917 -1.947 . . . . 71.35 111.892 178.814 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.4 m -67.38 -37.79 83.7 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.638 0.732 . . . . 63.42 111.699 177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.1 mp -84.63 -49.26 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.285 0 CA-C-N 115.168 -0.924 . . . . 73.31 112.015 -176.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -77.91 -36.16 49.84 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.977 -0.689 . . . . 74.14 112.302 -176.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt 60.09 106.91 0.02 OUTLIER 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.39 1.076 . . . . 72.33 113.856 -177.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -69.12 155.57 40.15 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.762 -0.653 . . . . 65.31 110.872 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -157.22 179.88 8.85 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.855 -0.612 . . . . 60.31 109.829 -174.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 mp0 -61.91 -34.68 76.5 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.441 0.697 . . . . 75.32 112.794 -175.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -59.7 -46.92 87.63 Favored 'General case' 0 CA--C 1.474 -1.978 0 CA-C-O 123.0 1.381 . . . . 75.34 109.513 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.448 HD21 HD12 ' A' ' 94' ' ' LEU . 3.2 tm? -65.84 -39.51 90.88 Favored 'General case' 0 N--CA 1.407 -2.625 0 CA-C-N 111.667 -2.515 . . . . 63.53 110.361 -174.696 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.475 ' CE3' HG12 ' A' ' 97' ' ' ILE . 61.3 t-105 -68.72 -45.75 70.74 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.824 0.345 . . . . 72.43 110.366 174.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.39 85.41 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.634 -0.712 . . . . 64.43 111.309 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.59 -47.34 70.22 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.019 0.528 . . . . 64.32 111.406 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -60.9 -49.99 75.24 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.005 -0.543 . . . . 71.52 110.076 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.797 -0.638 . . . . 64.14 111.443 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.551 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 40.1 mmt180 -72.01 -42.92 65.83 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 112.213 0.449 . . . . 74.35 112.213 -175.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.485 HD12 HD13 ' A' ' 84' ' ' LEU . 2.6 tm? -67.99 -38.23 82.44 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.407 -0.59 . . . . 72.25 109.407 -177.509 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.503 HD13 HD13 ' A' ' 33' ' ' LEU . 3.3 mt -71.98 -25.45 61.86 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 112.248 0.462 . . . . 61.41 112.248 176.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 t -69.38 -20.98 63.82 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.054 -1.091 . . . . 72.14 108.054 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.551 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.44 -2.56 51.65 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.584 -0.735 . . . . 64.34 109.956 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.437 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -138.32 52.39 4.69 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 115.686 -0.688 . . . . 73.25 111.682 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.1 Cg_exo -68.6 -22.36 38.2 Favored 'Trans proline' 0 C--N 1.364 1.346 0 N-CA-C 108.342 -1.446 . . . . 73.32 108.342 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -67.2 -44.62 79.14 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.01 -1.45 . . . . 72.25 110.375 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.419 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 64.3 t90 -74.31 -44.22 53.46 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 119.387 -0.925 . . . . 71.31 109.251 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.597 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.8 tp -57.74 -52.45 65.4 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.082 -1.417 . . . . 64.01 111.799 -175.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.479 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 15.0 p -51.52 -48.02 63.11 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 124.014 0.821 . . . . 72.52 111.807 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.36 85.01 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.878 0.871 . . . . 72.02 111.691 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 36' ' ' LYS . 24.7 mmmt -68.9 -38.47 79.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.71 -0.396 . . . . 71.24 111.638 177.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.631 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 99.0 mt -58.61 -30.95 67.64 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 123.335 0.654 . . . . 74.51 111.118 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 34' ' ' SER . 51.5 mtm180 -61.87 -30.97 71.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.743 0.417 . . . . 73.12 111.841 -178.126 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.7 t -84.08 -27.07 28.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.645 0.736 . . . . 62.5 110.185 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.459 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.6 m-85 -89.75 -54.74 3.93 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.631 -0.713 . . . . 75.13 112.518 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.565 HD22 ' SD ' ' A' ' 44' ' ' MET . 9.9 mp -87.49 121.22 71.23 Favored Pre-proline 0 C--N 1.311 -1.088 0 N-CA-C 112.627 0.603 . . . . 71.24 112.627 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -84.14 -15.9 6.43 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 C-N-CA 122.105 1.87 . . . . 74.23 110.49 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 t -115.15 27.83 9.12 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.292 -0.867 . . . . 64.11 110.004 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.637 ' HG2' HD23 ' A' ' 46' ' ' LEU . 5.3 tpt -58.2 111.4 1.19 Allowed 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 113.828 1.047 . . . . 73.21 113.828 -174.289 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -99.6 68.63 1.58 Allowed 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 107.663 -1.236 . . . . 70.33 107.663 174.25 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.637 HD23 ' HG2' ' A' ' 44' ' ' MET . 3.0 pp -95.1 -20.64 19.12 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 114.888 -1.051 . . . . 75.41 111.068 -174.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.51 -17.9 50.16 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.124 -0.944 . . . . 74.52 110.696 -174.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.9 m -93.32 74.87 4.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.771 -1.104 . . . . 54.44 112.06 -175.181 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 p -89.91 84.73 6.23 Favored 'General case' 0 N--CA 1.412 -2.369 0 CA-C-O 121.944 0.878 . . . . 74.23 110.009 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -28.64 68.72 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 114.713 -1.13 . . . . 72.33 111.563 177.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -123.53 164.34 29.03 Favored Pre-proline 1 N--CA 1.369 -4.481 0 N-CA-C 105.215 -2.142 . . . . 74.12 105.215 177.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.492 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 29.0 Cg_endo -65.68 -155.19 0.03 OUTLIER 'Trans proline' 0 CA--C 1.551 1.345 0 C-N-CA 122.562 2.175 . . . . 72.33 112.592 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.7 m -75.52 37.45 0.14 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.453 0.701 . . . . 72.24 110.739 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.492 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 5.0 m-20 -60.59 147.54 83.31 Favored Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 124.822 1.249 . . . . 74.42 113.227 -176.629 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -43.52 -50.52 6.82 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 124.411 3.407 . . . . 74.54 113.688 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -74.89 -18.96 60.34 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 113.407 0.892 . . . . 71.42 113.407 -178.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.473 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 90.5 t -75.43 -42.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 N-CA-C 107.611 -1.255 . . . . 71.22 107.611 175.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.4 mm -66.2 -42.03 90.35 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-N 115.09 -0.959 . . . . 72.43 108.854 175.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -54.52 -45.74 73.42 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 124.878 1.271 . . . . 73.41 112.854 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 57' ' ' VAL . 6.7 ptm180 -64.59 -31.55 72.82 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-N 118.549 0.613 . . . . 65.32 111.792 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.0 mt-30 -72.52 -44.01 62.79 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.574 0.702 . . . . 73.34 109.435 -177.287 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.11 -33.09 65.37 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.859 -1.064 . . . . 72.02 110.429 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.414 ' HA ' ' CD2' ' A' ' 66' ' ' PHE . 26.1 t-20 -56.83 -52.4 65.25 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 124.095 0.958 . . . . 74.14 109.854 175.027 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.517 ' CB ' HD21 ' A' ' 41' ' ' LEU . 21.8 mmt180 -56.71 -29.55 62.55 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.36 -1.291 . . . . 74.54 113.474 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.419 HD21 HD23 ' A' ' 37' ' ' LEU . 56.2 mt -68.79 -45.07 72.27 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 121.125 -0.23 . . . . 73.42 110.863 176.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.414 ' CD2' ' HA ' ' A' ' 63' ' ' ASN . 0.5 OUTLIER -70.3 -25.21 63.22 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 119.807 -0.757 . . . . 71.12 109.62 -179.54 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.19 -30.38 67.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.437 -0.801 . . . . 51.41 110.719 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.48 ' HB2' HG21 ' A' ' 72' ' ' THR . 42.1 mm-40 -66.35 -38.72 88.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 109.003 -0.74 . . . . 44.25 109.003 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -179.59 139.56 3.91 Favored Glycine 0 N--CA 1.404 -3.449 0 CA-C-N 114.575 -1.193 . . . . 53.5 111.29 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.579 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -66.01 -31.47 72.39 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.022 -1.844 . . . . 74.43 106.022 171.166 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.64 -41.84 44.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.059 -1.428 . . . . 63.51 108.975 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.48 HG21 ' HB2' ' A' ' 68' ' ' GLN . 89.6 m -53.35 -41.27 65.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.845 0.458 . . . . 65.15 110.276 175.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.9 t-105 -62.63 -50.98 69.1 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.693 -0.685 . . . . 73.42 110.358 177.263 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.579 ' HG3' ' O ' ' A' ' 70' ' ' MET . 87.5 mttt -55.42 -42.76 74.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.616 0.366 . . . . 65.33 111.374 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.9 m -66.12 -46.99 75.6 Favored 'General case' 0 N--CA 1.409 -2.5 0 C-N-CA 123.355 0.662 . . . . 75.5 110.674 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -57.14 -50.83 71.59 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.746 -0.661 . . . . 74.31 110.624 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.445 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 32.1 mm -59.76 -32.77 50.31 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.439 -0.8 . . . . 74.44 111.607 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -64.71 -43.53 93.16 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.568 -0.53 . . . . 74.33 109.568 177.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -72.24 -37.9 69.02 Favored 'General case' 0 C--O 1.189 -2.096 0 CA-C-N 116.403 -0.362 . . . . 73.04 110.385 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.0 tm? -49.53 -54.59 17.16 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 125.402 1.481 . . . . 75.12 110.135 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.8 m -67.82 -35.21 78.21 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 115.942 -0.572 . . . . 44.24 111.09 -178.016 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -75.81 -48.77 20.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.838 -0.619 . . . . 71.23 111.393 -176.054 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -71.33 -27.06 63.11 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 122.906 0.482 . . . . 75.32 111.755 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.485 HD13 HD12 ' A' ' 25' ' ' LEU . 85.8 mt -92.26 -3.54 55.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 116.192 -0.458 . . . . 63.25 109.955 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 t70 59.24 38.72 23.29 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.021 1.328 . . . . 61.31 111.551 174.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 m -120.0 105.44 42.64 Favored Pre-proline 0 C--N 1.304 -1.375 0 CA-C-N 115.245 -0.889 . . . . 71.4 111.241 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.75 102.64 1.34 Allowed 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 121.963 1.776 . . . . 64.42 108.959 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.2 mt -96.79 -14.94 21.6 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.437 0.532 . . . . 73.12 112.437 -173.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.7 t70 70.69 -64.84 0.36 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 124.709 1.204 . . . . 62.41 110.572 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.425 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . 23.9 ptp -77.31 35.11 0.17 Allowed 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.68 1.592 . . . . 63.02 112.411 -175.435 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.7 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 17.8 tt0 -58.9 -36.12 74.17 Favored 'General case' 0 C--O 1.186 -2.246 0 C-N-CA 125.831 1.652 . . . . 74.4 110.039 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.522 ' O ' HG22 ' A' ' 95' ' ' VAL . 47.1 mm -70.88 -45.29 15.72 Favored Pre-proline 0 C--O 1.176 -2.791 0 O-C-N 121.268 -0.895 . . . . 70.52 109.484 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.425 ' HG2' ' HB2' ' A' ' 90' ' ' MET . 21.4 Cg_exo -47.62 -38.21 28.31 Favored 'Trans proline' 0 CA--C 1.554 1.498 0 CA-C-N 121.2 1.464 . . . . 71.14 111.855 164.83 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 8.9 mp -59.6 -47.74 84.39 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 108.688 -0.856 . . . . 73.2 108.688 171.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 91' ' ' GLU . 3.7 m -64.91 -35.63 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 CA-C-O 122.267 1.032 . . . . 72.21 111.381 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.0 t -83.94 6.05 23.23 Favored 'General case' 0 C--N 1.276 -2.62 0 C-N-CA 125.715 1.606 . . . . 63.03 111.87 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.475 HG12 ' CE3' ' A' ' 19' ' ' TRP . 3.0 tp -65.47 -18.56 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 108.336 -0.987 . . . . 74.13 108.336 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 75.3 t90 . . . . . 0 N--CA 1.42 -1.96 0 C-N-CA 125.541 1.536 . . . . 70.22 108.194 176.51 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.9 ttm . . . . . 0 C--O 1.238 0.474 0 CA-C-O 123.305 1.526 . . . . 64.3 107.466 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -157.41 26.08 0.29 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.335 -2.211 . . . . 61.34 108.312 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.666 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -61.81 -13.34 23.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.286 -0.87 . . . . 70.34 112.955 -178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.63 -37.62 84.63 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.652 0.781 . . . . 75.22 109.745 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.1 m -75.78 -17.66 59.79 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-N 114.051 -1.432 . . . . 70.22 110.541 -174.425 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.666 HG12 ' HA ' ' A' ' 8' ' ' ALA . 6.6 mm -87.6 -44.31 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 CA-C-N 115.412 -0.813 . . . . 71.24 110.247 -174.608 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -104.13 -45.33 4.75 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 114.431 1.271 . . . . 74.45 114.431 -174.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 54.91 83.64 0.08 Allowed 'General case' 0 C--N 1.344 0.368 0 N-CA-C 108.896 -0.779 . . . . 73.33 108.896 -166.24 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.474 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 5.5 t-20 -120.31 -168.51 1.64 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.122 -0.49 . . . . 72.34 110.109 -170.353 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.628 ' O ' HD12 ' A' ' 18' ' ' LEU . 5.6 t-20 -148.98 -173.05 4.26 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 109.19 -0.671 . . . . 74.35 109.19 -176.192 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -48.14 -27.48 2.39 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 128.192 2.597 . . . . 72.15 114.099 -171.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -57.98 -28.97 64.86 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 123.09 0.556 . . . . 73.41 110.975 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.643 ' HB2' ' SD ' ' A' ' 90' ' ' MET . 0.0 OUTLIER -62.17 -33.33 74.32 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.533 -0.758 . . . . 71.32 110.653 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.492 ' N ' HD13 ' A' ' 18' ' ' LEU . 75.9 t-105 -68.43 -32.43 72.46 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-N 115.672 -0.695 . . . . 72.31 110.117 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.95 -31.18 70.73 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.093 0.473 . . . . 45.34 109.971 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.581 ' CZ2' ' HG ' ' A' ' 25' ' ' LEU . 73.4 t90 -63.09 -50.07 71.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.635 -0.876 . . . . 73.51 108.635 173.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.06 -53.23 58.52 Favored 'General case' 0 CA--C 1.516 -0.361 0 O-C-N 124.509 1.13 . . . . 73.43 110.415 -176.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.8 t -53.82 -53.64 25.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 O-C-N 123.8 0.688 . . . . 72.25 112.052 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.503 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 26.6 mmt180 -74.57 -32.01 62.25 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 113.233 0.827 . . . . 64.1 113.233 -176.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.581 ' HG ' ' CZ2' ' A' ' 21' ' ' TRP . 1.8 tm? -70.59 -42.64 70.75 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.699 -0.852 . . . . 63.13 108.699 -178.521 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.513 HD13 HD23 ' A' ' 33' ' ' LEU . 1.2 mt -70.76 -24.63 62.64 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.924 -0.58 . . . . 22.13 111.185 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 p -69.71 -11.95 61.25 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.907 0.86 . . . . 64.24 108.854 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.9 mtmt -99.56 -9.87 22.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.307 -0.627 . . . . 62.41 109.307 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.441 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.3 m-80 -133.62 53.39 10.2 Favored Pre-proline 0 C--O 1.24 0.578 0 CA-C-N 115.664 -0.698 . . . . 72.53 111.934 -175.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -70.07 -22.19 31.01 Favored 'Trans proline' 0 C--N 1.363 1.335 0 N-CA-C 108.472 -1.395 . . . . 72.22 108.472 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.11 -41.86 85.49 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 113.325 -1.762 . . . . 72.25 109.929 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.493 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 73.5 t90 -73.83 -43.04 59.95 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 119.646 -0.822 . . . . 73.44 109.47 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.513 HD23 HD13 ' A' ' 26' ' ' LEU . 2.0 tm? -60.36 -43.26 96.71 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.105 -0.952 . . . . 74.1 110.344 -174.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 m -63.98 -35.16 79.77 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 120.799 0.333 . . . . 71.21 111.625 178.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.26 80.49 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 121.261 0.553 . . . . 32.24 110.172 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.5 mmtt -76.74 -40.61 47.95 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.117 -0.633 . . . . 74.53 112.609 173.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 78.0 mt -51.56 -41.7 61.32 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.189 0.596 . . . . 51.43 111.938 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.475 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 0.1 OUTLIER -59.54 -28.06 66.76 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.383 1.253 . . . . 74.43 114.383 -177.673 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.4 t -77.06 -40.45 46.22 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 115.745 -0.661 . . . . 64.41 110.133 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -81.84 -47.25 13.04 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 123.655 0.782 . . . . 74.54 112.637 -176.167 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 mp -80.9 124.89 81.17 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 123.379 0.672 . . . . 73.35 109.867 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -72.01 -36.47 5.88 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.045 2.497 . . . . 75.31 114.014 -177.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.5 p -106.12 -5.59 19.26 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.775 0.798 . . . . 71.23 110.316 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.475 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 2.0 mpp? 40.68 92.18 0.01 OUTLIER 'General case' 0 N--CA 1.408 -2.572 0 C-N-CA 127.69 2.396 . . . . 64.34 115.735 -175.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -101.62 70.03 1.25 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 122.733 1.254 . . . . 63.54 108.459 168.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -95.79 -5.13 42.59 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 113.146 -1.843 . . . . 63.21 110.607 -176.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -75.84 47.35 0.42 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.388 1.475 . . . . 71.24 110.436 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.4 m -86.08 -3.47 58.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.629 -0.714 . . . . 74.35 112.715 -176.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 50.7 m -82.95 65.39 8.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.769 0.795 . . . . 63.31 112.733 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.41 -28.22 37.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-O 122.921 1.343 . . . . 75.42 109.931 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.447 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 54.1 mt-10 -116.22 173.39 3.06 Favored Pre-proline 1 N--CA 1.375 -4.185 0 N-CA-C 104.919 -2.252 . . . . 73.44 104.919 175.91 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 50.8 Cg_endo -66.85 -156.52 0.03 OUTLIER 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 121.296 1.331 . . . . 64.14 112.074 175.115 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.6 m -76.1 38.4 0.17 Allowed 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.194 0.998 . . . . 62.11 112.417 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 57' ' ' VAL . 86.2 m-20 -60.08 148.39 77.96 Favored Pre-proline 0 N--CA 1.438 -1.054 0 C-N-CA 125.156 1.382 . . . . 74.52 112.308 -179.062 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.61 -32.93 97.74 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 123.129 2.553 . . . . 65.11 112.781 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.2 mp0 -68.95 -40.39 78.96 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.591 -0.892 . . . . 61.03 108.591 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.412 HG23 ' HB2' ' A' ' 54' ' ' ASN . 78.1 t -63.59 -48.57 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 CA-C-N 114.191 -1.368 . . . . 54.51 109.234 178.531 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.4 mm -59.81 -46.58 93.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.223 -0.899 . . . . 61.51 110.443 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -57.15 -38.8 74.08 Favored 'General case' 0 C--O 1.202 -1.406 0 CA-C-O 119.404 -0.331 . . . . 60.13 111.59 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 46.5 ttt180 -61.39 -40.56 94.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.851 0.834 . . . . 74.34 111.281 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -67.23 -47.15 71.67 Favored 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.434 -1.257 . . . . 74.31 110.317 -177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.94 -31.04 67.52 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.553 -1.203 . . . . 73.44 111.151 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 59.5 t30 -54.78 -51.13 66.72 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 124.616 1.166 . . . . 71.42 110.015 176.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -55.14 -31.33 61.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.66 -1.154 . . . . 70.35 113.077 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.8 mt -72.64 -43.73 62.84 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 112.273 0.472 . . . . 64.14 112.273 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -69.96 -25.61 63.72 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.717 -0.846 . . . . 74.1 108.717 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.02 -31.27 68.83 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.338 -0.846 . . . . 73.04 110.832 174.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.44 ' HB2' HG21 ' A' ' 72' ' ' THR . 48.5 mm-40 -68.21 -41.6 81.08 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 109.049 -0.723 . . . . 72.42 109.049 176.078 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.79 142.34 4.79 Favored Glycine 0 N--CA 1.421 -2.328 0 CA-C-N 114.986 -1.006 . . . . 64.24 112.365 -177.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.2 ptm -69.17 -26.57 64.92 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 106.498 -1.667 . . . . 64.12 106.498 170.037 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.415 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . . . -75.67 -46.9 28.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 113.684 -1.598 . . . . 74.34 108.004 175.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.44 HG21 ' HB2' ' A' ' 68' ' ' GLN . 84.9 m -53.55 -41.72 66.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.836 0.71 . . . . 75.31 110.339 177.153 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.574 ' O ' HG12 ' A' ' 77' ' ' ILE . 75.9 t-105 -60.17 -49.43 77.67 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.424 -0.807 . . . . 74.23 111.466 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.415 ' HE3' ' HA ' ' A' ' 71' ' ' ALA . 9.4 ptpt -69.59 -35.02 74.94 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 121.134 0.492 . . . . 53.2 111.479 -174.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.0 m -67.58 -42.45 82.49 Favored 'General case' 0 N--CA 1.405 -2.712 0 CA-C-N 115.632 -0.713 . . . . 35.11 110.361 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.4 -49.62 75.62 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.601 0.761 . . . . 73.14 111.522 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.599 HG21 ' HB2' ' A' ' 94' ' ' LEU . 47.2 mm -59.0 -33.87 51.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.466 -0.788 . . . . 74.25 111.852 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.1 -39.02 93.15 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.965 0.412 . . . . 70.23 110.266 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.447 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 2.4 m-20 -74.51 -36.01 63.2 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.942 0.401 . . . . 65.43 110.474 176.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.496 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.0 tm? -54.4 -54.54 39.2 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.715 1.206 . . . . 71.54 110.225 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 29.9 p -66.9 -32.67 74.07 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.81 -0.632 . . . . 74.23 111.394 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -71.27 -54.75 9.79 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.04 -0.982 . . . . 74.12 111.926 -176.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 19.8 mt-10 -73.31 -22.28 60.37 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 112.52 0.563 . . . . 71.41 112.52 -171.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.9 mt -86.97 -2.26 58.48 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.492 -0.483 . . . . 63.24 111.548 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 t70 72.9 -32.02 0.24 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 114.546 1.313 . . . . 70.52 114.546 174.754 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.46 ' O ' HD23 ' A' ' 88' ' ' LEU . 61.4 t -48.68 124.43 12.24 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 124.367 1.067 . . . . 65.4 111.891 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -80.27 44.01 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.462 2.774 . . . . 75.4 111.696 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.539 ' H ' HD23 ' A' ' 88' ' ' LEU . 2.0 pt? -62.88 -48.47 78.83 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.506 -0.315 . . . . 54.13 111.326 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.471 ' O ' ' HB1' ' A' ' 8' ' ' ALA . 48.2 m-20 56.3 31.27 18.25 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.139 0.971 . . . . 65.32 111.856 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.643 ' SD ' ' HB2' ' A' ' 18' ' ' LEU . 50.4 mtt -99.76 13.99 31.78 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.116 -1.068 . . . . 64.13 108.116 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.669 ' O ' HG13 ' A' ' 95' ' ' VAL . 3.3 tt0 -47.14 -60.92 2.15 Favored 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 125.184 1.394 . . . . 51.5 113.35 -174.149 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -64.14 -44.03 75.9 Favored Pre-proline 0 C--O 1.201 -1.48 0 CA-C-N 119.111 0.869 . . . . 61.11 111.717 -178.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -48.37 -35.49 27.98 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 121.476 1.451 . . . . 70.55 111.763 170.243 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.599 ' HB2' HG21 ' A' ' 77' ' ' ILE . 3.3 mm? -67.98 -51.97 41.23 Favored 'General case' 0 C--O 1.202 -1.406 0 N-CA-C 109.078 -0.712 . . . . 71.54 109.078 169.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.669 HG13 ' O ' ' A' ' 91' ' ' GLU . 2.7 m -60.44 -37.57 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-O 122.062 0.934 . . . . 73.12 113.204 -171.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.1 t -93.52 6.17 49.11 Favored 'General case' 0 C--N 1.26 -3.312 0 CA-C-N 114.146 -1.388 . . . . 71.43 111.774 -174.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.433 HG22 ' O ' ' A' ' 94' ' ' LEU . 8.3 tt -55.24 -39.73 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 112.833 0.679 . . . . 64.24 112.833 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 43.7 m95 . . . . . 0 N--CA 1.411 -2.377 0 N-CA-C 107.608 -1.256 . . . . 73.51 107.608 179.559 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.521 ' O ' ' HG3' ' A' ' 9' ' ' GLU . 2.2 mpt? . . . . . 0 C--O 1.206 -1.223 0 N-CA-C 111.961 0.356 . . . . 65.01 111.961 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.33 25.33 1.21 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 113.328 0.862 . . . . 71.43 113.328 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.505 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.21 -15.7 58.56 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-O 121.821 0.82 . . . . 60.24 108.987 172.074 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.541 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -56.68 -41.36 77.16 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.643 1.177 . . . . 74.21 114.001 -179.251 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.572 ' HB2' HD12 ' A' ' 11' ' ' ILE . 74.7 m -55.06 -36.64 65.81 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 125.058 1.343 . . . . 64.15 110.36 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.572 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -81.73 -29.71 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.969 0 C-N-CA 125.164 1.386 . . . . 64.45 109.672 -175.394 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -76.6 -64.88 1.02 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.87 -0.604 . . . . 73.53 112.486 -177.243 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -175.42 -75.98 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 110.048 -0.353 . . . . 73.33 110.048 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.6 t30 65.31 109.12 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.377 1.071 . . . . 73.11 111.644 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.471 ' H ' HD23 ' A' ' 18' ' ' LEU . 28.0 t-20 -172.78 163.4 5.07 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 122.358 -0.214 . . . . 74.23 110.463 -176.537 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.04 -27.88 35.03 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.519 1.528 . . . . 73.02 111.472 177.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.2 -28.13 62.59 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 112.599 0.592 . . . . 61.12 112.599 177.791 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.632 HD12 HD22 ' A' ' 94' ' ' LEU . 3.6 mm? -71.1 -34.59 71.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.219 0.533 . . . . 71.02 109.741 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.454 ' HB2' HD11 ' A' ' 97' ' ' ILE . 74.2 t-105 -65.98 -42.34 89.98 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.401 -0.818 . . . . 75.13 110.236 -178.026 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.72 -42.65 97.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.061 -0.518 . . . . 72.43 110.35 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -59.41 -50.44 73.93 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.103 -0.499 . . . . 74.21 110.531 176.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.446 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -57.3 -53.31 59.61 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.94 0.775 . . . . 75.43 109.551 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.36 -46.96 94.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 112.849 0.685 . . . . 62.2 112.849 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -72.3 -36.79 69.03 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 112.301 0.482 . . . . 72.1 112.301 -174.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.67 -40.8 63.41 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.943 -0.762 . . . . 62.13 108.943 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.569 HD13 HD23 ' A' ' 33' ' ' LEU . 3.6 mt -71.36 -24.14 62.04 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 112.656 0.613 . . . . 73.2 112.656 178.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.0 t -62.81 -20.96 65.54 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.275 -1.009 . . . . 61.21 108.275 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -97.46 -0.05 46.8 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.061 0.458 . . . . 62.11 110.218 177.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.415 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.2 m-80 -139.36 54.66 6.22 Favored Pre-proline 0 C--O 1.245 0.825 0 C-N-CA 122.886 0.474 . . . . 73.51 111.352 -177.472 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.415 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -71.22 -21.66 26.67 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.247 1.298 . . . . 74.3 108.808 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -71.71 -36.61 70.59 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 113.625 -1.625 . . . . 72.21 110.437 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.468 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 82.0 t90 -75.0 -48.09 25.85 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 119.518 -0.873 . . . . 72.32 110.016 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.569 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -56.76 -45.65 81.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.822 -1.081 . . . . 70.54 111.172 -172.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.516 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 10.6 p -57.81 -44.93 86.71 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.126 -0.488 . . . . 74.11 112.21 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.87 -44.35 78.03 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 124.106 0.963 . . . . 51.42 111.598 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 70.7 mmtt -71.38 -29.67 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.933 -0.307 . . . . 74.23 111.548 176.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.6 mt -62.7 -36.07 81.74 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 110.263 -0.273 . . . . 73.43 110.263 174.474 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -63.39 -35.22 79.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.63 0.729 . . . . 51.05 109.769 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.8 m -71.91 -47.47 52.33 Favored 'General case' 0 N--CA 1.392 -3.374 0 C-N-CA 124.883 1.273 . . . . 71.13 111.902 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.529 ' CD1' HG23 ' A' ' 72' ' ' THR . 52.8 m-85 -84.61 -46.48 11.48 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 114.059 1.133 . . . . 73.14 114.059 -174.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 1.9 mm? -95.85 112.83 60.61 Favored Pre-proline 0 N--CA 1.424 -1.739 0 C-N-CA 122.317 0.247 . . . . 74.51 110.423 -175.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.83 -37.9 18.97 Favored 'Trans proline' 0 C--O 1.217 -0.542 0 C-N-CA 122.303 2.002 . . . . 72.44 111.193 178.411 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.8 t -103.95 30.15 5.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.613 -0.722 . . . . 73.3 110.787 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.555 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -43.61 131.78 5.06 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 115.294 1.59 . . . . 71.25 115.294 178.343 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -124.81 59.77 1.2 Allowed 'General case' 0 C--N 1.276 -2.598 0 CA-C-N 114.499 -1.228 . . . . 73.22 109.198 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.2 pp -84.55 -16.53 41.93 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.336 -1.302 . . . . 65.14 110.079 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.35 -18.14 62.39 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 114.927 -1.033 . . . . 73.22 110.124 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.9 m -80.69 84.4 6.25 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 114.511 -1.222 . . . . 52.21 108.87 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 m -117.19 78.41 1.22 Allowed 'General case' 0 N--CA 1.424 -1.769 0 CA-C-O 121.915 0.864 . . . . 74.04 109.792 -177.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -63.89 1.14 Allowed 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 113.543 -1.662 . . . . 62.4 111.334 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.41 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 10.4 mm-40 -99.78 162.02 22.49 Favored Pre-proline 1 C--N 1.237 -4.313 0 CA-C-N 113.823 -1.535 . . . . 74.52 109.372 -179.492 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 17.8 Cg_endo -62.66 -150.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.561 1.84 0 C-N-CA 124.085 3.19 . . . . 73.34 113.154 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 m -75.34 37.79 0.13 Allowed 'General case' 0 CA--C 1.572 1.795 0 C-N-CA 123.655 0.782 . . . . 64.21 112.365 -175.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.493 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 6.0 m-20 -65.54 150.25 96.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 C-N-CA 125.926 1.69 . . . . 73.45 112.687 -178.162 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.3 -47.48 27.19 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.717 2.944 . . . . 71.1 113.382 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.428 ' HA ' ' HB3' ' A' ' 59' ' ' HIS . 70.8 mm-40 -71.76 -25.73 62.15 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 112.971 0.73 . . . . 72.44 112.971 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.528 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 95.7 t -66.21 -42.97 92.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.196 0 N-CA-C 108.485 -0.932 . . . . 53.34 108.485 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.411 ' O ' HD23 ' A' ' 62' ' ' LEU . 49.4 mm -67.14 -46.01 85.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.051 -0.977 . . . . 64.0 109.215 175.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 56' ' ' GLU . 20.2 t-160 -54.22 -40.1 67.34 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.114 0.966 . . . . 72.44 110.981 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -54.98 -55.69 27.99 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.768 0.794 . . . . 73.13 110.712 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 60.4 mt-30 -62.26 -34.69 77.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.256 -1.338 . . . . 74.45 110.932 -176.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.508 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -77.04 -35.6 56.76 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-N 114.903 -1.044 . . . . 73.15 111.926 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 46.1 t-20 -57.46 -35.88 70.72 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.227 1.011 . . . . 50.2 108.695 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.55 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 12.5 mmt180 -55.37 -42.72 74.33 Favored 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.486 -1.233 . . . . 70.35 111.534 175.764 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.508 HD12 HD13 ' A' ' 62' ' ' LEU . 78.6 mt -72.22 -33.7 67.77 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.026 0.441 . . . . 72.23 110.085 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.543 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 90.5 t80 -58.34 -31.17 67.33 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.839 -1.073 . . . . 71.41 109.482 174.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.59 -34.19 53.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.445 -0.798 . . . . 40.25 111.54 177.596 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -67.39 -56.7 8.63 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.116 0.413 . . . . 74.12 112.116 -178.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.67 143.46 5.26 Favored Glycine 0 CA--C 1.474 -2.519 0 C-N-CA 120.005 -1.093 . . . . 44.52 113.299 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.53 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.6 ptt? -70.61 -28.48 64.88 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 107.106 -1.442 . . . . 72.01 107.106 169.794 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.73 -35.78 65.1 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 114.41 -1.268 . . . . 74.23 107.949 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.529 HG23 ' CD1' ' A' ' 40' ' ' PHE . 98.9 m -65.8 -38.9 90.21 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.616 -1.175 . . . . 75.32 109.747 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.624 ' HD1' HG23 ' A' ' 95' ' ' VAL . 36.9 t-105 -64.37 -42.11 96.36 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 108.921 -0.77 . . . . 75.41 108.921 177.923 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.835 ' HA ' HG21 ' A' ' 95' ' ' VAL . 93.5 mttt -55.76 -51.78 66.21 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.583 0.353 . . . . 65.52 110.87 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.4 m -61.89 -39.75 93.06 Favored 'General case' 0 N--CA 1.408 -2.539 0 C-N-CA 123.761 0.824 . . . . 51.22 110.719 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -62.8 -52.96 61.15 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.826 -1.079 . . . . 74.24 111.618 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 73' ' ' TRP . 27.0 mm -69.13 -32.07 52.59 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 119.843 -0.743 . . . . 63.41 110.352 -175.034 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -57.04 -52.15 66.4 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.893 -1.049 . . . . 72.32 108.807 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 4.7 m-20 -67.42 -38.44 84.6 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 115.312 -0.858 . . . . 70.12 111.648 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.469 HD21 HD21 ' A' ' 26' ' ' LEU . 2.6 tm? -51.16 -55.62 16.94 Favored 'General case' 0 C--N 1.311 -1.096 0 C-N-CA 124.711 1.204 . . . . 75.45 110.502 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.565 ' SG ' ' HB3' ' A' ' 91' ' ' GLU . 56.1 m -68.54 -32.93 73.21 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.872 -0.603 . . . . 64.41 111.204 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -70.98 -46.27 62.61 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.557 -0.747 . . . . 75.22 112.048 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 15.1 mt-10 -83.8 -19.62 34.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 113.175 0.806 . . . . 74.43 113.175 -173.166 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 72.7 mt -79.93 33.32 0.27 Allowed 'General case' 0 C--O 1.243 0.728 0 N-CA-C 113.145 0.794 . . . . 75.22 113.145 -177.128 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 76.32 -27.12 0.18 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.906 1.682 . . . . 51.32 114.27 171.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.8 p -136.93 105.8 8.85 Favored Pre-proline 0 C--N 1.296 -1.75 0 CA-C-O 120.953 0.406 . . . . 72.52 111.503 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.8 83.7 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.014 1.809 . . . . 70.32 109.675 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.17 -6.96 54.93 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.627 1.343 . . . . 45.21 114.627 -175.853 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.9 t70 54.46 81.19 0.11 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.983 1.475 . . . . 74.14 114.983 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.457 ' O ' HD23 ' A' ' 94' ' ' LEU . 24.1 ptm -153.11 22.37 0.56 Allowed 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 105.546 -2.02 . . . . 62.23 105.546 172.828 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.565 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 9.2 pt-20 -70.54 -36.32 73.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 112.77 -2.014 . . . . 55.53 111.512 -173.439 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.77 ' HA ' HG12 ' A' ' 95' ' ' VAL . 47.2 mm -69.39 -49.13 23.98 Favored Pre-proline 0 C--N 1.277 -2.567 0 CA-C-N 115.977 -0.556 . . . . 73.04 110.793 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -50.72 -44.47 40.61 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.091 1.861 . . . . 65.41 111.54 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.632 HD22 HD12 ' A' ' 18' ' ' LEU . 4.2 mm? -62.76 -39.19 93.4 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.642 0.608 . . . . 55.01 112.642 175.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.835 HG21 ' HA ' ' A' ' 74' ' ' LYS . 5.7 p -75.5 -32.64 25.52 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.122 0 CA-C-O 122.131 0.967 . . . . 45.21 113.105 -177.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.535 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . 21.9 t -58.67 -20.21 46.19 Favored 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 114.075 -1.42 . . . . 63.44 111.521 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 19' ' ' TRP . 3.6 tt -67.58 -16.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 116.183 -0.462 . . . . 62.54 111.664 -175.91 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.543 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 61.4 t90 . . . . . 0 N--CA 1.445 -0.697 0 N-CA-C 109.311 -0.626 . . . . 73.51 109.311 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.6 ptp . . . . . 0 CA--C 1.507 -0.687 0 CA-C-O 121.638 0.732 . . . . 55.41 109.135 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.65 71.99 1.43 Allowed 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 126.208 1.803 . . . . 73.12 112.749 -171.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.24 -34.41 49.18 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 114.422 -1.263 . . . . 65.35 110.188 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.517 ' CD ' ' HB3' ' A' ' 96' ' ' SER . 0.0 OUTLIER -57.53 -31.46 66.1 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 124.079 0.951 . . . . 74.4 111.288 -178.036 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.6 m -60.29 -30.14 69.29 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 125.043 1.337 . . . . 73.35 111.089 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.1 mp -87.36 -20.43 7.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 114.512 -1.222 . . . . 72.3 109.824 -176.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.582 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.6 mmm180 -107.38 -66.69 1.01 Allowed 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 112.706 0.632 . . . . 74.52 112.706 -177.005 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 12' ' ' ARG . 11.4 mt 170.63 173.84 0.07 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.089 1.756 . . . . 63.41 110.562 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.7 p30 -160.19 170.29 21.47 Favored 'General case' 0 C--O 1.252 1.231 0 N-CA-C 107.208 -1.404 . . . . 75.02 107.208 172.122 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.465 ' H ' HD23 ' A' ' 18' ' ' LEU . 28.3 t-20 -160.45 167.86 26.37 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 118.096 0.407 . . . . 73.42 110.839 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.59 -28.07 12.99 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 126.073 1.749 . . . . 72.45 112.717 178.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -57.03 -29.33 63.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.192 -0.458 . . . . 73.04 111.588 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.465 HD23 ' H ' ' A' ' 15' ' ' ASN . 4.0 mm? -65.33 -43.15 91.87 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.185 0.517 . . . . 62.23 110.362 177.032 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -69.22 -46.44 67.38 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.305 -0.861 . . . . 75.2 110.706 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.79 97.97 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 44.12 111.443 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 -56.48 -49.31 75.03 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.025 -0.534 . . . . 71.43 110.537 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.4 tm? -60.8 -53.29 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 123.834 0.709 . . . . 62.4 110.211 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.14 -50.3 78.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 112.612 0.597 . . . . 75.44 112.612 -176.521 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.522 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 5.1 tpm_? -72.65 -33.73 66.8 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.973 -0.291 . . . . 73.14 110.54 -175.044 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.443 HD22 ' HE2' ' A' ' 28' ' ' LYS . 1.9 tm? -69.81 -44.88 69.12 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.548 -0.908 . . . . 64.33 108.548 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.673 HD13 HD23 ' A' ' 33' ' ' LEU . 3.6 mt -71.44 -24.48 62.03 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.604 -0.725 . . . . 55.55 112.118 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 p -67.81 -15.67 63.74 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 108.766 -0.827 . . . . 75.35 108.766 177.243 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 34.6 mtmt -97.39 -4.1 39.02 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 121.729 0.776 . . . . 74.24 109.39 179.154 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.442 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.1 m-80 -138.78 54.92 7.12 Favored Pre-proline 0 C--O 1.243 0.73 0 CA-C-N 115.128 -0.942 . . . . 65.23 110.638 -176.077 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 9.2 Cg_exo -72.29 -21.22 23.49 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 121.437 1.425 . . . . 54.41 108.698 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -71.68 -39.76 70.04 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 114.224 -1.353 . . . . 52.53 109.944 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.61 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 72.2 t90 -74.2 -42.7 59.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.242 -0.983 . . . . 74.01 109.823 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.673 HD23 HD13 ' A' ' 26' ' ' LEU . 2.2 tm? -62.93 -44.57 95.7 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.074 -0.966 . . . . 75.01 110.654 -174.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.57 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 15.8 p -57.89 -47.68 82.07 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.652 0.263 . . . . 73.3 111.524 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.63 67.98 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 124.315 1.046 . . . . 64.52 111.468 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.61 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 32.8 mmmt -72.09 -32.82 67.37 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 120.642 -0.423 . . . . 73.12 111.058 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.3 mt -61.88 -32.9 73.3 Favored 'General case' 0 C--O 1.191 -1.976 0 N-CA-C 109.894 -0.41 . . . . 64.32 109.894 174.366 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.57 ' HG3' ' O ' ' A' ' 34' ' ' SER . 39.8 mtt180 -64.67 -28.64 69.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.08 0.467 . . . . 74.33 110.885 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.6 t -84.72 -41.38 16.28 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.463 -0.79 . . . . 71.3 110.563 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.526 ' CD1' HG23 ' A' ' 72' ' ' THR . 66.7 m-85 -82.22 -46.24 13.99 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.781 0.66 . . . . 75.04 112.781 -177.711 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 7.0 mp -88.6 120.49 70.26 Favored Pre-proline 0 C--N 1.305 -1.345 0 C-N-CA 124.02 0.928 . . . . 75.14 110.107 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.14 -24.39 12.64 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 121.914 1.743 . . . . 64.35 111.113 177.308 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.4 p -114.97 28.51 8.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 123.809 0.844 . . . . 71.42 110.945 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.523 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.4 98.81 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.693 1.368 . . . . 63.33 114.693 -174.95 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -103.33 72.87 1.18 Allowed 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.899 1.333 . . . . 65.03 107.44 176.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.408 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 4.1 pp -96.14 -12.5 24.64 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 113.375 -1.738 . . . . 62.05 113.538 -173.129 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -83.4 -11.15 57.91 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.468 0.651 . . . . 74.24 111.131 -174.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.6 t -72.78 106.75 4.87 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 115.023 -0.989 . . . . 71.24 109.216 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.8 p -139.23 87.13 2.17 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.913 0.863 . . . . 70.3 112.001 -177.217 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.32 -25.85 60.81 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.645 -1.161 . . . . 70.22 112.116 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -129.63 161.86 56.64 Favored Pre-proline 0 N--CA 1.381 -3.889 0 CA-C-N 113.629 -1.623 . . . . 61.52 107.446 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.44 ' HB2' ' H ' ' A' ' 53' ' ' SER . 36.3 Cg_endo -68.37 -148.85 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.928 2.419 . . . . 70.23 111.617 173.39 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.44 ' H ' ' HB2' ' A' ' 52' ' ' PRO . 6.1 m -75.27 37.86 0.13 Allowed 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 124.419 1.088 . . . . 60.21 112.705 -175.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.555 ' HB2' HG23 ' A' ' 57' ' ' VAL . 7.3 m-20 -58.05 147.04 66.72 Favored Pre-proline 0 N--CA 1.436 -1.166 0 C-N-CA 125.025 1.33 . . . . 73.02 111.27 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -53.35 -34.9 72.82 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 123.892 3.062 . . . . 52.33 112.377 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -73.23 -39.95 65.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.79 -0.641 . . . . 75.32 109.341 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.555 HG23 ' HB2' ' A' ' 54' ' ' ASN . 96.3 t -67.46 -44.69 86.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.618 -1.174 . . . . 75.11 109.248 -178.598 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.412 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.3 mm -63.44 -43.45 98.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.457 -0.792 . . . . 70.22 109.669 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 12.8 t-160 -58.13 -37.28 74.32 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 116.229 -0.442 . . . . 75.31 111.128 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.94 -44.84 96.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.315 0.578 . . . . 74.33 111.109 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.423 HE21 HG12 ' A' ' 57' ' ' VAL . 70.3 mt-30 -64.52 -47.08 80.2 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.144 -0.935 . . . . 52.45 110.115 -178.299 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 58' ' ' ILE . 4.3 mm? -68.83 -30.77 69.39 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.326 -1.306 . . . . 54.11 111.656 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 4.7 t30 -61.26 -37.39 82.96 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 123.853 0.861 . . . . 74.21 109.62 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -59.37 -31.36 69.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.868 -1.06 . . . . 44.22 112.041 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.18 -43.73 64.11 Favored 'General case' 0 CA--C 1.501 -0.916 0 N-CA-C 109.635 -0.506 . . . . 63.22 109.635 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -61.04 -39.54 90.2 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.409 -0.96 . . . . 62.41 108.409 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.42 66.12 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.918 -1.037 . . . . 74.42 111.957 177.696 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.478 ' HB2' HG21 ' A' ' 72' ' ' THR . 9.1 mm-40 -81.45 -50.24 9.67 Favored 'General case' 0 N--CA 1.415 -2.175 0 N-CA-C 108.605 -0.887 . . . . 70.12 108.605 173.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.421 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -179.02 143.23 5.69 Favored Glycine 0 CA--C 1.477 -2.29 0 CA-C-N 115.508 -0.769 . . . . 72.33 112.563 -175.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -26.77 64.01 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 106.772 -1.566 . . . . 74.41 106.772 170.256 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.39 -36.96 68.8 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.121 -1.4 . . . . 72.34 108.201 174.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.526 HG23 ' CD1' ' A' ' 40' ' ' PHE . 53.0 m -62.39 -33.94 75.74 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.916 -1.038 . . . . 60.33 110.733 177.216 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -66.48 -38.58 87.62 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.323 -0.621 . . . . 74.4 109.323 178.152 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.967 ' HA ' HG21 ' A' ' 95' ' ' VAL . 8.8 mtmt -68.31 -32.23 72.21 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 113.205 0.817 . . . . 65.34 113.205 176.64 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.3 m -68.33 -38.15 81.26 Favored 'General case' 0 N--CA 1.402 -2.837 0 CA-C-O 121.953 0.882 . . . . 74.21 109.063 171.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -65.52 -53.84 36.66 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 114.365 -1.289 . . . . 53.24 112.966 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -64.04 -32.14 56.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.993 0 CA-C-N 118.611 0.642 . . . . 74.23 111.245 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.15 -42.39 99.21 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.4 -0.818 . . . . 70.25 109.331 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.478 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 83.1 m-20 -74.94 -41.19 60.12 Favored 'General case' 0 C--O 1.193 -1.878 0 CA-C-N 115.959 -0.564 . . . . 72.41 111.175 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.448 HD21 HD21 ' A' ' 26' ' ' LEU . 2.4 tm? -50.12 -53.98 23.71 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 125.454 1.502 . . . . 64.14 110.505 -179.204 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.407 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 50.8 t -66.76 -34.43 77.82 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.207 -0.906 . . . . 52.22 110.702 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -75.75 -50.19 15.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.333 -0.849 . . . . 74.03 112.381 -175.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 36.1 mt-10 -75.32 -28.36 59.62 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 112.196 0.443 . . . . 71.01 112.196 -173.039 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.8 mt -85.16 -13.64 49.48 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.261 -0.644 . . . . 70.23 109.261 176.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.7 t70 54.01 57.84 5.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.261 1.424 . . . . 74.11 110.743 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 6.0 m -134.52 108.09 11.05 Favored Pre-proline 0 C--N 1.301 -1.529 0 CA-C-N 114.012 -1.449 . . . . 61.43 109.392 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -63.43 111.0 1.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.279 1.986 . . . . 70.21 109.66 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.407 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 41.2 mt -82.91 -39.8 21.02 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.852 -0.739 . . . . 74.14 109.272 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 62.19 12.25 4.98 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.228 1.011 . . . . 63.21 110.688 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.41 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 18.8 ttt -157.25 34.26 0.28 Allowed 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 106.949 -1.5 . . . . 74.34 106.949 -176.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.97 -34.5 71.48 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-N 114.458 -1.246 . . . . 74.01 109.632 -179.041 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.54 ' HA ' HG12 ' A' ' 95' ' ' VAL . 49.0 mm -63.35 -50.5 73.93 Favored Pre-proline 0 C--N 1.288 -2.074 0 CA-C-N 115.319 -0.855 . . . . 54.14 111.989 -177.304 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.501 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 50.4 Cg_exo -58.7 -24.38 70.7 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 121.782 1.654 . . . . 65.34 111.756 172.303 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.401 ' O ' HG22 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -74.4 -31.95 62.52 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.898 -1.149 . . . . 71.11 107.898 177.409 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.967 HG21 ' HA ' ' A' ' 74' ' ' LYS . 9.0 p -88.2 -46.72 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.949 0 N-CA-C 113.949 1.092 . . . . 62.04 113.949 -178.361 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.517 ' HB3' ' CD ' ' A' ' 9' ' ' GLU . 4.0 t -78.73 3.44 16.56 Favored 'General case' 0 C--N 1.27 -2.871 0 CA-C-N 115.627 -0.715 . . . . 65.42 110.846 -175.439 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.434 HG23 ' CD1' ' A' ' 98' ' ' TRP . 17.2 tt -56.81 -40.01 68.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.347 0.659 . . . . 70.54 109.952 176.765 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.434 ' CD1' HG23 ' A' ' 97' ' ' ILE . 46.6 m95 . . . . . 0 N--CA 1.448 -0.553 0 N-CA-C 108.924 -0.769 . . . . 75.32 108.924 178.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 53.1 tpp . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 121.785 0.803 . . . . 75.13 110.639 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.08 24.99 12.34 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.729 -0.669 . . . . 62.11 109.674 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.522 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.64 -9.54 59.42 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 114.966 -1.015 . . . . 44.04 109.768 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.469 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -60.22 -44.34 95.25 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.4 1.08 . . . . 72.31 112.173 -179.512 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.468 ' HB2' HD12 ' A' ' 11' ' ' ILE . 75.2 m -54.48 -31.73 56.4 Favored 'General case' 0 C--N 1.288 -2.108 0 C-N-CA 125.354 1.462 . . . . 71.13 111.302 174.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.522 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -85.13 -38.2 12.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 C-N-CA 125.026 1.331 . . . . 75.04 110.367 -174.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.74 -38.41 28.76 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.996 0.739 . . . . 73.22 112.996 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.5 mt 61.51 -175.27 0.13 Allowed 'General case' 0 C--O 1.242 0.679 0 C-N-CA 124.38 1.072 . . . . 64.04 113.221 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.507 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 9.7 p30 -125.02 -177.79 3.97 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.84 -0.537 . . . . 55.53 111.562 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.531 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.7 t30 -154.39 153.11 31.05 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.382 -0.97 . . . . 74.14 108.382 -174.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -69.79 -34.53 73.87 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.146 0.43 . . . . 72.21 112.002 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -62.05 -35.95 80.14 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 122.122 0.963 . . . . 75.43 109.041 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 7.3 tt -65.84 -39.06 90.45 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.34 -1.755 . . . . 74.43 110.062 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.44 ' HB2' HD11 ' A' ' 97' ' ' ILE . 20.8 t-105 -71.42 -46.71 59.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.78 0.324 . . . . 63.53 110.245 174.964 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.01 -40.86 74.03 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-N 115.857 -0.611 . . . . 73.22 110.884 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -53.04 -50.44 64.3 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 124.134 0.896 . . . . 73.05 110.847 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mt -66.49 -45.15 80.61 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 112.741 0.645 . . . . 63.42 112.741 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -51.71 -53.73 15.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 123.738 0.649 . . . . 63.34 111.467 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.452 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 98.2 mtt180 -73.13 -33.7 65.67 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 112.13 0.418 . . . . 62.02 112.13 -176.22 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.408 HD12 HD13 ' A' ' 84' ' ' LEU . 0.9 OUTLIER -73.67 -46.5 46.13 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 73.32 109.598 -177.229 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.557 HD13 HD23 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -66.24 -25.36 66.86 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 123.679 0.792 . . . . 70.1 110.553 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' ' 53' ' ' SER . 57.7 m -72.58 -10.17 59.47 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.256 0.55 . . . . 52.33 110.838 176.879 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 70.9 mttt -98.44 -11.43 22.36 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 108.31 -0.996 . . . . 73.25 108.31 177.243 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.46 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 47.5 m-80 -132.44 51.35 7.03 Favored Pre-proline 0 N--CA 1.436 -1.169 0 CA-C-N 114.499 -1.228 . . . . 52.4 110.822 -175.088 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.46 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 2.8 Cg_exo -72.75 -19.37 24.09 Favored 'Trans proline' 0 C--N 1.361 1.191 0 N-CA-C 108.65 -1.327 . . . . 52.02 108.65 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -74.89 -37.23 62.18 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 114.189 -1.369 . . . . 72.11 109.641 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -73.21 -42.97 62.03 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.467 -0.893 . . . . 73.2 109.002 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.661 HD13 HD13 ' A' ' 37' ' ' LEU . 2.6 tm? -59.32 -47.16 86.45 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.616 -1.175 . . . . 74.24 110.226 -176.25 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.1 p -62.27 -38.44 89.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.686 0.279 . . . . 61.42 111.478 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.49 96.75 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.045 0.538 . . . . 72.44 111.272 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HE3' ' HB3' ' A' ' 79' ' ' ASP . 42.9 mmtt -74.52 -52.41 11.99 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 112.6 0.592 . . . . 73.32 112.6 177.073 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.661 HD13 HD13 ' A' ' 33' ' ' LEU . 10.7 mp -53.41 -31.22 44.1 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 113.999 1.111 . . . . 73.11 113.999 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.645 ' HB2' ' SD ' ' A' ' 44' ' ' MET . 31.5 ptt180 -66.69 -30.84 71.18 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.394 0.887 . . . . 74.05 113.394 179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 t -72.88 -31.99 65.07 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.495 0.664 . . . . 70.41 109.704 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.524 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.2 m-85 -83.11 -58.61 2.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.706 -0.679 . . . . 73.22 111.497 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mp -72.52 121.69 85.52 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 123.977 0.911 . . . . 75.32 110.439 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.56 -33.73 21.57 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 122.562 2.174 . . . . 75.42 112.617 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 p -94.07 -5.48 47.29 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.206 -0.452 . . . . 65.25 110.609 -178.14 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.645 ' SD ' ' HB2' ' A' ' 38' ' ' ARG . 8.9 mtt 36.48 91.51 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 127.643 2.377 . . . . 75.42 112.309 -175.265 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -101.92 72.87 1.37 Allowed 'General case' 0 C--N 1.287 -2.116 0 CA-C-O 122.485 1.136 . . . . 74.31 108.852 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.501 HD11 ' HB3' ' A' ' 38' ' ' ARG . 10.7 mt -92.55 -40.32 10.86 Favored 'General case' 0 CA--C 1.487 -1.464 0 CA-C-N 112.945 -1.934 . . . . 73.42 107.633 -175.542 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.14 3.35 10.77 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 112.948 -1.933 . . . . 75.1 110.994 -176.005 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.04 -15.29 63.63 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 125.039 1.336 . . . . 64.33 111.429 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.8 m -75.85 69.28 2.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.657 0.741 . . . . 52.34 111.895 -179.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.47 -9.05 57.03 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.128 0.965 . . . . 73.51 111.609 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.655 ' OE2' HG22 ' A' ' 57' ' ' VAL . 2.6 pt-20 -111.09 160.23 29.76 Favored Pre-proline 0 C--N 1.28 -2.42 0 CA-C-N 114.323 -1.308 . . . . 72.42 109.075 175.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -62.37 -170.74 0.09 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.874 2.382 . . . . 74.31 113.696 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.439 ' HB3' ' OG ' ' A' ' 27' ' ' SER . 13.2 m -76.46 36.91 0.16 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 115.169 -0.923 . . . . 74.23 112.005 -175.06 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.544 ' HB2' HG23 ' A' ' 57' ' ' VAL . 5.1 m-20 -68.39 147.55 98.18 Favored Pre-proline 0 N--CA 1.434 -1.275 0 O-C-N 122.253 -0.28 . . . . 75.54 110.955 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -56.51 -40.1 86.84 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.206 2.604 . . . . 64.01 113.275 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -74.92 -24.08 58.45 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.114 0.483 . . . . 65.55 110.731 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.655 HG22 ' OE2' ' A' ' 51' ' ' GLU . 89.8 t -69.96 -47.68 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 107.871 -1.159 . . . . 63.41 107.871 175.894 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -61.03 -45.36 98.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 114.23 -1.35 . . . . 71.13 109.725 177.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -55.2 -39.73 69.95 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.823 0.849 . . . . 72.22 111.633 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.35 -41.52 97.19 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.728 0.811 . . . . 64.14 111.365 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 18.9 mt-30 -71.81 -43.87 64.89 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.145 -0.934 . . . . 63.51 110.374 -176.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.421 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -72.41 -29.91 64.15 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.827 -1.079 . . . . 72.0 111.47 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -53.27 -42.17 66.26 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 75.45 110.335 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.2 mmt85 -55.04 -32.87 62.21 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.653 -1.158 . . . . 75.4 112.707 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.3 mt -72.35 -39.24 68.24 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 120.604 0.24 . . . . 65.2 110.81 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -64.38 -37.67 88.34 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.636 -0.876 . . . . 73.42 108.636 174.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.01 -28.25 69.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.668 -1.151 . . . . 65.14 111.439 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.402 ' HB2' HG21 ' A' ' 72' ' ' THR . 9.7 mm-40 -74.56 -57.49 3.9 Favored 'General case' 0 N--CA 1.409 -2.491 0 N-CA-C 107.772 -1.196 . . . . 72.32 107.772 174.725 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLY . . . . . 0.437 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -170.5 142.42 7.14 Favored Glycine 0 CA--C 1.466 -3.005 0 CA-C-N 114.917 -1.038 . . . . 24.52 112.369 -175.302 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.61 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.6 tpp -67.14 -33.11 74.73 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.378 -1.712 . . . . 41.34 106.378 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.95 -37.31 84.05 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 114.594 -1.184 . . . . 51.24 108.483 176.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.524 HG23 ' CD1' ' A' ' 40' ' ' PHE . 99.2 m -61.9 -42.63 99.3 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.677 -1.147 . . . . 70.54 110.442 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.654 ' HD1' HG23 ' A' ' 95' ' ' VAL . 70.0 t-105 -67.32 -41.23 85.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 110.345 -0.243 . . . . 74.2 110.345 179.067 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.714 ' HA ' HG21 ' A' ' 95' ' ' VAL . 73.5 mttt -56.99 -39.52 74.81 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.391 0.615 . . . . 74.22 111.278 175.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.7 m -70.95 -44.15 66.67 Favored 'General case' 0 N--CA 1.4 -2.936 0 CA-C-N 115.663 -0.698 . . . . 42.43 110.015 177.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.31 -46.12 89.45 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 123.868 0.867 . . . . 45.02 112.475 -178.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.566 HG22 ' HB2' ' A' ' 91' ' ' GLU . 43.7 mm -66.34 -31.17 52.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.155 0 C-N-CA 119.223 -0.991 . . . . 72.03 111.611 -176.472 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -64.76 -40.78 95.85 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.514 -0.55 . . . . 75.01 109.514 174.773 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.5 ' HB3' ' HE3' ' A' ' 36' ' ' LYS . 6.4 m-20 -65.19 -42.16 93.85 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 116.459 -0.337 . . . . 73.15 110.322 175.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.465 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -51.97 -55.02 23.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.839 1.256 . . . . 71.24 109.585 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 26.0 p -67.89 -40.46 83.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.279 0.474 . . . . 61.21 112.279 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -63.56 -54.33 37.78 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 123.389 0.676 . . . . 71.44 110.504 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -72.84 -37.12 67.55 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 113.915 1.08 . . . . 74.32 113.915 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.408 HD13 HD12 ' A' ' 25' ' ' LEU . 89.3 mt -85.2 -31.92 22.94 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.976 -0.69 . . . . 72.32 111.985 -177.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -146.36 -100.55 0.09 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.268 -0.973 . . . . 71.22 111.924 -178.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.414 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 76.3 t -141.16 151.44 61.84 Favored Pre-proline 0 C--N 1.307 -1.279 0 N-CA-C 106.853 -1.536 . . . . 74.33 106.853 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -51.31 108.05 0.21 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 121.846 1.697 . . . . 62.3 108.93 168.016 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 86' ' ' VAL . 86.7 mt -90.95 -22.89 20.63 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 113.973 1.101 . . . . 73.44 113.973 -168.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.98 17.2 9.58 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 123.665 1.698 . . . . 72.23 108.82 -172.254 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.455 ' O ' HD23 ' A' ' 94' ' ' LEU . 63.8 mtt -120.13 12.92 11.98 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 113.434 -1.712 . . . . 74.23 107.479 175.493 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.566 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -71.41 -36.14 71.25 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.313 -0.858 . . . . 74.32 111.002 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.742 ' HA ' HG12 ' A' ' 95' ' ' VAL . 35.7 mm -61.18 -46.46 95.81 Favored Pre-proline 0 C--N 1.287 -2.137 0 CA-C-N 115.648 -0.706 . . . . 71.51 112.275 -178.345 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.446 ' HD2' ' C ' ' A' ' 90' ' ' MET . 76.3 Cg_exo -51.49 -38.57 64.37 Favored 'Trans proline' 0 C--N 1.359 1.113 0 C-N-CA 122.232 1.955 . . . . 63.35 112.134 170.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.508 ' HA ' HD21 ' A' ' 18' ' ' LEU . 4.5 mm? -72.04 -33.28 67.88 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.809 -0.632 . . . . 65.45 111.564 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.742 HG12 ' HA ' ' A' ' 92' ' ' ILE . 3.3 p -78.25 -29.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 122.395 1.093 . . . . 75.12 112.147 177.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.6 t -73.24 4.28 4.73 Favored 'General case' 0 C--N 1.259 -3.336 0 CA-C-N 113.899 -1.5 . . . . 74.33 111.665 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.507 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 14.5 tt -64.33 -28.85 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 75.15 111.197 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 11.5 m95 . . . . . 0 N--CA 1.422 -1.856 0 N-CA-C 105.054 -2.202 . . . . 74.52 105.054 171.878 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.439 -1.013 0 N-CA-C 114.073 1.138 . . . . 70.54 114.073 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -110.14 23.79 13.85 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.297 -0.961 . . . . 75.43 111.131 177.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.99 -14.56 59.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.8 0.81 . . . . 64.33 109.776 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.441 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.5 OUTLIER -65.13 -33.01 74.99 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.033 -0.985 . . . . 65.42 113.175 -178.588 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.9 t -61.78 -37.31 83.88 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.949 0.881 . . . . 73.14 109.897 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.461 ' H ' HD12 ' A' ' 11' ' ' ILE . 2.9 mp -87.5 -43.77 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 114.625 -1.171 . . . . 70.01 112.415 -177.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 12' ' ' ARG . 11.5 mmt180 -81.94 -30.78 31.59 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.028 0.751 . . . . 72.51 113.028 -175.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 64.82 133.39 0.02 OUTLIER 'General case' 0 C--O 1.247 0.952 0 C-N-CA 125.976 1.711 . . . . 75.4 115.374 -178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -72.89 156.3 39.02 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 115.495 -0.775 . . . . 73.2 108.938 175.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.433 ' H ' HD12 ' A' ' 18' ' ' LEU . 44.8 t-20 -157.76 143.39 17.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.092 -1.077 . . . . 74.44 108.092 -174.087 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -52.84 -28.51 23.19 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.304 1.041 . . . . 52.42 111.442 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -56.63 -39.6 73.92 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.124 0.969 . . . . 62.54 110.158 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.433 HD12 ' H ' ' A' ' 15' ' ' ASN . 34.1 mt -70.67 -36.71 73.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.779 -1.101 . . . . 65.35 110.551 -175.264 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -69.44 -42.22 75.23 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.408 -0.59 . . . . 75.15 109.408 177.244 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.04 -48.19 82.93 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.503 -0.317 . . . . 71.05 110.222 177.746 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.454 ' HE1' HD22 ' A' ' 88' ' ' LEU . 2.3 t-105 -54.5 -50.28 68.18 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.782 -0.645 . . . . 74.14 110.77 175.246 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -59.79 -53.05 62.5 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 123.74 0.65 . . . . 62.35 109.286 -177.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.4 t -56.48 -50.57 72.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 116.233 -0.439 . . . . 75.02 112.131 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.574 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 97.3 mtt180 -69.63 -41.56 75.48 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.285 0.476 . . . . 73.42 112.285 -174.067 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.57 -42.91 86.34 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.262 -0.644 . . . . 75.14 109.262 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.561 HD21 HD21 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -70.34 -25.1 63.13 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.961 -0.563 . . . . 62.21 110.437 -179.255 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.9 m -71.56 -18.9 62.22 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.287 -0.634 . . . . 61.13 109.287 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 40.3 mtmt -91.84 1.37 57.22 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.814 0.816 . . . . 44.11 109.188 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -141.03 55.64 5.65 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 114.81 -1.086 . . . . 73.24 110.267 -178.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -67.98 -26.01 37.86 Favored 'Trans proline' 0 C--N 1.363 1.34 0 C-N-CA 121.389 1.393 . . . . 63.45 108.986 -176.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -66.85 -42.07 86.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-N 113.55 -1.659 . . . . 72.32 110.131 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.597 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 80.1 t90 -74.57 -45.47 45.13 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 119.809 -0.757 . . . . 74.12 109.664 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.613 ' O ' HD13 ' A' ' 37' ' ' LEU . 2.9 tm? -57.4 -52.52 65.02 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.392 -1.276 . . . . 65.41 110.537 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.487 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 12.9 p -54.28 -42.59 70.21 Favored 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 112.371 0.508 . . . . 65.21 112.371 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.65 86.91 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 124.254 1.021 . . . . 73.22 112.447 177.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.597 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.2 mmmt -72.13 -31.26 65.83 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.891 0.377 . . . . 72.12 110.394 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.613 HD13 ' O ' ' A' ' 33' ' ' LEU . 5.2 mp -61.49 -31.08 71.05 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 122.679 0.392 . . . . 70.1 111.701 173.313 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 34' ' ' SER . 28.6 mtm180 -66.23 -35.4 80.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.986 0.898 . . . . 64.2 109.537 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.44 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 50.2 m -75.47 -36.07 60.74 Favored 'General case' 0 N--CA 1.399 -3.0 0 C-N-CA 125.734 1.614 . . . . 73.35 112.648 -178.396 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.592 ' CD1' HG23 ' A' ' 72' ' ' THR . 66.1 m-85 -94.51 -47.43 6.55 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 113.192 0.812 . . . . 73.43 113.192 -178.555 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.616 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.0 OUTLIER -101.0 115.92 64.66 Favored Pre-proline 0 N--CA 1.436 -1.157 0 O-C-N 122.315 -0.241 . . . . 53.23 110.699 -176.146 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.14 -25.61 9.97 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.823 1.682 . . . . 71.21 111.248 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.5 m -99.12 23.89 8.53 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.511 1.148 . . . . 73.33 110.875 -174.227 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.498 ' HB2' ' HB2' ' A' ' 41' ' ' LEU . 4.0 tpt -74.95 104.19 5.45 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 113.846 1.054 . . . . 62.21 113.846 -176.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -94.01 77.02 4.12 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 106.369 -1.715 . . . . 63.31 106.369 170.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.484 HD23 ' HG2' ' A' ' 44' ' ' MET . 3.9 pp -89.22 -17.49 28.96 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.165 -1.38 . . . . 53.41 112.305 -174.358 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -72.39 -18.43 61.73 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.532 0.682 . . . . 74.53 111.73 -175.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.7 m -100.74 95.03 6.38 Favored 'General case' 0 C--N 1.276 -2.595 0 CA-C-N 115.649 -0.705 . . . . 75.1 110.625 -176.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.8 m -91.76 95.39 9.84 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.547 0.689 . . . . 75.31 109.669 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.21 -48.44 81.48 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.864 -1.062 . . . . 70.14 110.939 176.287 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.423 ' HB2' HG21 ' A' ' 57' ' ' VAL . 45.4 mt-10 -116.97 164.62 18.02 Favored Pre-proline 0 C--N 1.245 -3.936 0 CA-C-N 113.281 -1.781 . . . . 72.22 106.877 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.8 -150.87 0.04 OUTLIER 'Trans proline' 0 CA--C 1.553 1.453 0 C-N-CA 122.221 1.948 . . . . 75.23 110.812 174.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -75.47 38.08 0.14 Allowed 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 124.189 0.996 . . . . 72.44 112.334 -176.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.17 146.81 91.91 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 123.637 0.775 . . . . 72.32 111.019 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.21 -27.92 78.89 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.724 2.283 . . . . 64.5 111.933 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -68.74 -40.28 79.94 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.533 -0.914 . . . . 75.24 108.533 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.493 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 58.4 t -66.47 -50.36 67.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.717 -1.129 . . . . 73.3 109.042 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.44 ' O ' HD23 ' A' ' 62' ' ' LEU . 47.3 mm -55.15 -39.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-N 114.792 -1.094 . . . . 70.02 109.776 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.497 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 57.0 t-80 -61.89 -28.98 69.9 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.604 -0.725 . . . . 63.32 111.461 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.414 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 25.3 mmt180 -74.22 -40.75 62.24 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 122.317 1.056 . . . . 74.43 108.251 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.565 ' HB3' HD21 ' A' ' 37' ' ' LEU . 41.1 mt-30 -70.25 -43.88 69.61 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 113.555 -1.657 . . . . 65.42 110.534 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.494 HD13 HD12 ' A' ' 65' ' ' LEU . 3.9 mm? -73.42 -30.5 63.27 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.875 -1.057 . . . . 73.15 111.232 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 53.6 t-20 -56.42 -43.37 79.34 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.467 1.107 . . . . 54.15 108.858 175.449 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.616 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 34.0 mmt180 -58.48 -37.01 74.63 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.758 -1.11 . . . . 74.33 112.343 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.494 HD12 HD13 ' A' ' 62' ' ' LEU . 88.5 mt -71.82 -44.68 63.48 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 116.552 -0.295 . . . . 62.51 111.571 -177.171 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -67.38 -27.77 67.38 Favored 'General case' 0 C--O 1.245 0.851 0 N-CA-C 108.851 -0.796 . . . . 72.31 108.851 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.24 81.0 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.245 -0.889 . . . . 73.25 110.709 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.455 ' HB2' HG21 ' A' ' 72' ' ' THR . 12.6 mm100 -60.4 -47.94 83.89 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.054 -0.721 . . . . 73.12 109.054 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.81 141.02 5.43 Favored Glycine 0 N--CA 1.403 -3.539 0 CA-C-N 114.772 -1.104 . . . . 72.23 111.143 -178.269 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.624 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 21.7 ptp -69.67 -26.61 64.47 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.025 -1.843 . . . . 72.14 106.025 169.662 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.5 67.01 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.37 -1.286 . . . . 74.12 108.262 173.789 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.592 HG23 ' CD1' ' A' ' 40' ' ' PHE . 81.2 m -55.39 -40.82 71.85 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 123.399 0.68 . . . . 64.01 110.129 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.5 t-105 -61.26 -49.29 77.68 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 115.765 -0.652 . . . . 72.22 110.247 176.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.624 ' HG3' ' O ' ' A' ' 70' ' ' MET . 91.5 mttt -55.82 -42.48 75.75 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.959 0.409 . . . . 64.53 110.754 176.525 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 42.3 m -65.88 -44.93 83.88 Favored 'General case' 0 N--CA 1.406 -2.636 0 C-N-CA 123.334 0.654 . . . . 75.11 110.773 179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -58.33 -49.52 76.9 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.718 -0.673 . . . . 73.23 111.006 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.493 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 49.5 mm -64.47 -38.31 82.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 O-C-N 123.349 0.406 . . . . 74.44 110.738 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -69.67 -32.93 71.85 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.198 0.523 . . . . 74.34 110.781 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 67.9 m-20 -74.01 -39.61 63.48 Favored 'General case' 0 C--O 1.193 -1.875 0 C-N-CA 119.867 -0.733 . . . . 70.25 110.163 171.983 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.561 HD21 HD21 ' A' ' 26' ' ' LEU . 2.8 tm? -50.76 -53.96 27.38 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.924 1.29 . . . . 61.3 111.073 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 25.3 p -63.29 -33.7 76.08 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.623 -0.717 . . . . 75.43 111.662 -178.738 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -73.47 -54.35 8.46 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 123.554 0.742 . . . . 71.13 111.129 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 42.3 mt-10 -68.61 -36.73 79.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.396 -0.82 . . . . 62.35 112.814 -172.047 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.6 -10.24 44.06 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.936 -0.706 . . . . 43.32 110.032 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.5 t70 55.95 69.48 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.194 0.998 . . . . 63.01 110.219 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -132.88 129.08 21.01 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 115.082 -0.963 . . . . 61.35 110.666 -177.524 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -75.89 109.55 2.91 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.115 1.877 . . . . 63.11 110.076 176.412 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.454 HD22 ' HE1' ' A' ' 21' ' ' TRP . 65.9 mt -86.05 -31.1 22.14 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 120.175 -0.61 . . . . 55.3 109.634 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.7 t70 71.31 -49.68 0.68 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.854 1.261 . . . . 63.33 111.559 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.511 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . 20.6 ptp -116.43 68.56 0.73 Allowed 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.098 0.951 . . . . 61.02 108.55 175.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 36.2 tt0 -70.36 -46.04 64.9 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.354 -1.293 . . . . 63.44 112.13 -172.949 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.588 ' O ' HG22 ' A' ' 95' ' ' VAL . 44.4 mm -64.43 -42.8 68.88 Favored Pre-proline 0 C--O 1.175 -2.852 0 C-N-CA 123.358 0.663 . . . . 72.2 111.034 -178.04 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.511 ' HG2' ' HB2' ' A' ' 90' ' ' MET . 3.1 Cg_exo -48.37 -33.33 22.35 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.937 1.758 . . . . 61.22 112.89 167.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 4.5 mm? -68.32 -44.06 76.23 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 108.952 -0.759 . . . . 64.55 108.952 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 92' ' ' ILE . 2.8 m -63.77 -34.47 68.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.278 0 CA-C-O 123.051 1.405 . . . . 72.24 110.712 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.3 m -89.21 7.23 36.45 Favored 'General case' 0 C--N 1.274 -2.713 0 C-N-CA 127.667 2.387 . . . . 53.25 113.453 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.5 tp -60.91 -24.95 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.078 0.551 . . . . 62.31 111.598 -176.081 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 23.9 m0 . . . . . 0 N--CA 1.432 -1.339 0 C-N-CA 124.961 1.304 . . . . 75.13 112.278 -174.33 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 28.5 ttt . . . . . 0 N--CA 1.432 -1.362 0 CA-C-O 122.913 1.34 . . . . 72.23 109.531 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.524 ' O ' HD13 ' A' ' 11' ' ' ILE . 28.7 t70 -161.85 25.12 0.12 Allowed 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 112.119 -2.31 . . . . 72.23 108.175 -177.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.94 -31.94 64.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.9 1.333 . . . . 60.23 107.468 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.8 pm0 -55.93 -38.88 70.89 Favored 'General case' 0 N--CA 1.422 -1.858 0 CA-C-N 112.768 -2.014 . . . . 71.44 112.216 175.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -66.92 -26.74 67.0 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.779 0.799 . . . . 63.03 111.19 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.524 HD13 ' O ' ' A' ' 7' ' ' ASP . 1.0 OUTLIER -83.51 -24.91 7.85 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.836 0 CA-C-N 115.143 -0.935 . . . . 75.02 110.453 -175.296 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.488 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 38.2 mmt180 -84.68 -65.03 1.06 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.373 -0.376 . . . . 73.22 110.19 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LEU . . . . . 0.423 ' HA ' ' O ' ' A' ' 96' ' ' SER . 41.5 mt 50.83 166.08 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 117.196 2.295 . . . . 63.23 117.196 -179.332 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.6 t30 51.46 87.61 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.907 1.683 . . . . 51.14 113.231 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.538 ' HB3' HD23 ' A' ' 18' ' ' LEU . 46.7 m-80 -125.32 89.86 3.12 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.893 -0.594 . . . . 44.13 110.942 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.82 -39.24 69.94 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.251 -0.431 . . . . 64.33 111.63 -177.719 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.02 -34.07 76.78 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.274 0.559 . . . . 73.14 110.127 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.627 HD12 HD22 ' A' ' 94' ' ' LEU . 4.6 mm? -67.12 -37.99 84.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.167 -0.924 . . . . 72.34 110.914 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.4 t-105 -66.24 -46.76 76.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.348 -0.387 . . . . 74.31 110.307 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.77 -32.54 74.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.005 -0.543 . . . . 64.24 111.133 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -67.74 -50.17 58.66 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.347 -0.612 . . . . 62.23 109.347 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.1 -52.77 63.1 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.727 0.811 . . . . 63.45 110.077 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.3 t -57.51 -48.62 82.6 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 C-N-CA 122.898 0.479 . . . . 75.44 111.575 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -72.3 -31.68 65.92 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.271 -0.422 . . . . 71.34 111.483 -175.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -72.98 -43.97 61.62 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 107.964 -1.124 . . . . 51.52 107.964 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.471 HD13 HD23 ' A' ' 33' ' ' LEU . 4.8 mt -73.43 -24.23 60.22 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 113.304 0.853 . . . . 74.11 113.304 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . 0.54 ' HA ' ' HB3' ' A' ' 53' ' ' SER . 53.2 p -59.15 -22.04 60.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.515 0.674 . . . . 72.41 109.792 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.6 mtmt -92.43 -15.2 27.48 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.483 -0.781 . . . . 72.24 109.522 -178.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -133.96 51.5 6.6 Favored Pre-proline 0 C--O 1.242 0.701 0 CA-C-N 114.902 -1.044 . . . . 61.23 111.849 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.38 -22.31 29.42 Favored 'Trans proline' 0 C--N 1.366 1.49 0 N-CA-C 108.939 -1.216 . . . . 75.22 108.939 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -66.71 -39.62 88.1 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-N 113.352 -1.749 . . . . 64.34 110.09 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.527 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 70.6 t90 -74.34 -45.49 46.9 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 119.605 -0.838 . . . . 52.23 109.378 178.272 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.596 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 3.1 tm? -59.05 -49.52 77.57 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.61 -1.177 . . . . 61.11 110.947 -174.269 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.52 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 21.1 p -58.94 -45.27 90.85 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.029 0.381 . . . . 63.2 112.029 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.95 70.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.109 0.964 . . . . 62.0 111.416 176.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.521 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 26.3 mmmt -72.56 -35.8 68.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.99 -0.284 . . . . 70.41 110.668 178.794 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.4 mt -59.41 -31.13 68.98 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.969 -0.56 . . . . 73.4 110.855 177.084 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 34' ' ' SER . 59.7 mtp180 -61.5 -34.82 76.14 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.04 -0.527 . . . . 72.33 112.234 -176.707 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -87.58 -38.97 15.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.273 -0.421 . . . . 64.13 110.476 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.446 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 76.4 m-85 -73.85 -47.89 35.1 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.066 0.765 . . . . 73.31 113.066 -178.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.533 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.5 mm? -102.43 112.54 65.65 Favored Pre-proline 0 N--CA 1.432 -1.34 0 CA-C-O 120.758 0.313 . . . . 73.25 110.957 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -81.15 3.06 8.11 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.511 2.141 . . . . 74.03 111.373 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 27.6 p -111.53 -2.0 15.64 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.061 -0.972 . . . . 75.43 111.193 -177.295 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.505 ' HB2' ' HB2' ' A' ' 41' ' ' LEU . 36.9 tpp -65.22 110.07 2.44 Favored 'General case' 0 N--CA 1.413 -2.315 0 N-CA-C 115.489 1.663 . . . . 74.32 115.489 -174.465 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -108.79 82.92 1.68 Allowed 'General case' 0 N--CA 1.428 -1.532 0 N-CA-C 105.243 -2.132 . . . . 73.41 105.243 165.307 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.492 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 4.6 pp -81.75 5.01 19.88 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-N 114.58 -1.191 . . . . 73.2 111.486 -173.158 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -80.34 -9.35 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.999 -1.0 . . . . 63.45 111.452 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.3 p -89.35 77.59 7.36 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.966 0.889 . . . . 71.22 111.931 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.5 m -95.02 83.07 3.87 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.315 -0.857 . . . . 72.53 109.217 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -22.96 57.84 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.74 1.257 . . . . 72.43 111.846 178.441 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -137.03 161.6 60.48 Favored Pre-proline 1 N--CA 1.374 -4.273 0 N-CA-C 105.678 -1.971 . . . . 63.32 105.678 178.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.408 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.1 Cg_exo -69.57 -143.47 0.02 OUTLIER 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 122.975 2.45 . . . . 73.25 110.923 175.102 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.54 ' HB3' ' HA ' ' A' ' 27' ' ' SER . 13.0 m -80.59 38.33 0.43 Allowed 'General case' 0 C--N 1.293 -1.853 0 CA-C-O 122.18 0.99 . . . . 43.12 110.66 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.408 ' H ' ' C ' ' A' ' 52' ' ' PRO . 6.7 m-20 -62.35 151.41 82.41 Favored Pre-proline 0 C--N 1.317 -0.823 0 C-N-CA 126.298 1.839 . . . . 75.13 112.802 -178.169 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -54.07 -43.45 58.17 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 124.011 3.141 . . . . 52.41 114.158 -175.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -73.86 -31.52 63.21 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-O 120.65 0.262 . . . . 55.42 110.372 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -63.7 -52.1 61.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.356 -0.979 . . . . 73.13 108.356 176.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.466 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.0 mm -56.97 -41.44 77.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.708 -1.133 . . . . 75.4 109.259 176.727 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.456 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 48.7 t-80 -58.92 -36.46 74.76 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-N 115.74 -0.664 . . . . 74.22 112.092 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -64.21 -44.42 92.01 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 108.118 -1.067 . . . . 54.12 108.118 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -67.39 -47.47 70.22 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.208 -1.814 . . . . 73.44 110.885 -172.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.466 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -74.17 -32.04 62.94 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 114.321 -1.309 . . . . 74.33 111.453 -177.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 67.1 t30 -63.16 -44.62 94.95 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.95 0.881 . . . . 54.14 109.847 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.533 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 19.0 mmt180 -57.56 -29.82 64.72 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.193 -1.367 . . . . 63.43 112.943 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.46 -39.18 85.3 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.658 0.266 . . . . 53.42 110.981 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -70.96 -29.8 65.91 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.566 -0.901 . . . . 74.43 108.566 178.442 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -19.94 65.1 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.738 -0.664 . . . . 70.54 110.529 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -79.84 -49.09 12.47 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 108.517 -0.92 . . . . 63.14 108.517 173.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.44 141.61 6.52 Favored Glycine 0 CA--C 1.479 -2.179 0 CA-C-N 115.001 -0.999 . . . . 71.02 111.526 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.521 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 59.5 ttp -67.74 -29.5 68.74 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.15 -1.796 . . . . 71.1 106.15 171.209 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.92 -32.95 34.48 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 113.707 -1.588 . . . . 63.31 109.026 177.412 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.412 HG23 ' CD1' ' A' ' 40' ' ' PHE . 98.7 m -60.4 -38.56 84.35 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.254 -0.647 . . . . 61.31 109.254 175.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.613 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.2 t-105 -61.57 -54.2 46.24 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 123.609 0.568 . . . . 72.12 109.739 175.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 70' ' ' MET . 85.9 mttt -53.97 -45.25 71.31 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.146 0.578 . . . . 71.05 111.935 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -65.34 -45.74 83.0 Favored 'General case' 0 N--CA 1.408 -2.558 0 C-N-CA 123.095 0.558 . . . . 74.44 111.104 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.446 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 81.0 t80 -57.49 -45.36 84.99 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.555 -0.748 . . . . 74.33 110.739 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.568 HG21 ' HB2' ' A' ' 94' ' ' LEU . 49.2 mm -63.5 -33.11 59.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 116.103 -0.499 . . . . 72.12 111.347 -178.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -66.16 -42.61 88.75 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.627 -0.829 . . . . 73.51 109.368 175.037 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 2.2 m-20 -64.12 -38.23 90.3 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 120.731 0.3 . . . . 64.42 110.427 175.998 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.6 tm? -53.66 -55.56 24.96 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 124.66 1.184 . . . . 72.31 109.863 177.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 87' ' ' PRO . 26.8 p -68.53 -40.24 80.84 Favored 'General case' 0 N--CA 1.42 -1.948 0 CA-C-N 116.15 -0.477 . . . . 72.21 111.674 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -65.86 -48.04 72.89 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.856 -0.611 . . . . 73.54 112.558 -174.668 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 6.1 mt-10 -80.69 -26.89 37.24 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.126 -0.63 . . . . 73.33 112.06 -174.194 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.3 mt -85.97 -37.39 19.05 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 120.442 -0.503 . . . . 64.42 111.098 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -148.82 -100.3 0.08 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 121.042 -0.263 . . . . 71.13 110.969 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -141.19 164.21 37.07 Favored Pre-proline 0 C--N 1.314 -0.962 0 N-CA-C 108.108 -1.071 . . . . 64.22 108.108 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.482 ' HA ' ' SG ' ' A' ' 81' ' ' CYS . 50.1 Cg_exo -57.8 114.89 2.16 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.898 1.732 . . . . 72.5 108.18 170.96 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.62 -19.09 29.84 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 113.304 0.853 . . . . 53.24 113.304 -169.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 78.7 -0.1 2.47 Favored 'General case' 0 N--CA 1.506 2.339 0 CA-C-O 123.542 1.639 . . . . 73.42 108.401 -173.149 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.452 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 27.8 ttt -105.75 6.26 31.65 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 113.157 -1.838 . . . . 75.44 108.071 -179.372 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.664 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -66.73 -46.53 75.18 Favored 'General case' 0 C--O 1.199 -1.601 0 CA-C-N 116.128 -0.487 . . . . 64.3 111.884 -178.808 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.456 ' O ' HG22 ' A' ' 95' ' ' VAL . 39.9 mm -59.09 -44.57 98.88 Favored Pre-proline 0 C--O 1.185 -2.332 0 CA-C-O 118.646 -0.693 . . . . 72.2 110.081 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.452 ' HD2' ' C ' ' A' ' 90' ' ' MET . 52.5 Cg_exo -47.63 -42.41 29.64 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 121.994 1.796 . . . . 72.32 112.342 169.539 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.627 HD22 HD12 ' A' ' 18' ' ' LEU . 4.4 mm? -67.01 -39.84 87.15 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.976 0.417 . . . . 72.33 110.616 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.664 HG13 ' O ' ' A' ' 91' ' ' GLU . 2.9 m -68.19 -29.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 122.824 1.297 . . . . 73.43 110.895 -178.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.488 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 24.5 t -82.92 5.13 22.93 Favored 'General case' 0 C--N 1.276 -2.629 0 C-N-CA 127.274 2.23 . . . . 62.3 111.68 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 17.3 tt -50.21 -48.16 24.54 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 113.439 0.903 . . . . 73.15 113.439 -173.207 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 4.1 p90 . . . . . 0 CA--C 1.499 -0.981 0 C-N-CA 126.339 1.856 . . . . 74.44 107.031 174.181 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 C--O 1.233 0.218 0 N-CA-C 108.493 -0.929 . . . . 72.41 108.493 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.418 ' O ' HD13 ' A' ' 11' ' ' ILE . 3.2 m-20 -105.12 25.71 10.23 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.266 0.839 . . . . 64.33 113.266 -174.572 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.431 ' HB3' ' HB ' ' A' ' 92' ' ' ILE . . . -77.2 -9.18 58.62 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 122.482 1.134 . . . . 51.01 109.778 175.583 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.482 ' HB3' ' OG ' ' A' ' 96' ' ' SER . 0.0 OUTLIER -69.19 -30.42 68.6 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.005 -1.452 . . . . 73.12 112.267 179.178 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.607 ' HB2' HD12 ' A' ' 11' ' ' ILE . 70.6 m -66.78 -32.45 73.75 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 122.271 1.034 . . . . 63.53 109.443 177.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.607 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.0 OUTLIER -84.38 -51.45 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.364 0 CA-C-N 113.888 -1.506 . . . . 61.15 110.918 -173.538 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -112.72 -6.92 13.84 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 115.003 1.483 . . . . 71.43 115.003 -173.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 53.29 -92.62 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.062 0.945 . . . . 75.44 113.18 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -170.37 170.55 7.03 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 124.513 1.125 . . . . 64.15 108.053 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.421 ' H ' HD12 ' A' ' 18' ' ' LEU . 46.8 t30 -152.67 152.58 31.91 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.08 -38.79 92.58 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 123.752 0.821 . . . . 75.4 111.076 -177.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -61.3 -29.28 69.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.29 -0.414 . . . . 51.31 111.811 -178.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.539 HD21 ' SD ' ' A' ' 90' ' ' MET . 83.4 mt -65.81 -44.93 84.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.491 -0.559 . . . . 71.44 109.491 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.445 ' HB2' HD11 ' A' ' 97' ' ' ILE . 61.3 t-105 -69.48 -36.88 76.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.48 -0.782 . . . . 74.54 109.842 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.35 -44.09 88.8 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 116.215 -0.448 . . . . 53.53 111.249 178.525 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.545 ' CH2' ' HG ' ' A' ' 25' ' ' LEU . 70.1 t90 -60.76 -48.13 83.18 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.684 -0.858 . . . . 71.13 108.684 176.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.441 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -54.4 -53.22 56.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.93 -1.032 . . . . 70.44 109.294 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.0 t -60.13 -44.66 95.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 112.407 0.521 . . . . 75.44 112.407 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.485 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 42.2 ttm180 -69.95 -45.28 67.78 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 120.596 -0.441 . . . . 75.24 111.029 -176.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.545 ' HG ' ' CH2' ' A' ' 21' ' ' TRP . 2.7 tm? -67.82 -40.32 83.8 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.917 -0.401 . . . . 75.23 109.917 -175.645 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.661 HD13 HD23 ' A' ' 33' ' ' LEU . 6.8 mt -71.0 -25.59 62.75 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 120.957 0.408 . . . . 72.03 111.804 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.0 t -68.93 -17.35 63.94 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.606 -0.887 . . . . 73.23 108.606 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 30.1 mtmt -101.66 -2.63 29.91 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.733 -0.667 . . . . 74.01 110.02 177.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -135.53 57.62 20.66 Favored Pre-proline 0 C--O 1.243 0.756 0 CA-C-N 116.139 -0.482 . . . . 71.43 111.185 -178.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -67.98 -28.47 35.37 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 121.307 1.338 . . . . 74.44 108.774 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.88 -44.27 96.55 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-N 113.16 -1.836 . . . . 75.42 110.624 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.519 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 78.2 t90 -74.85 -45.84 40.4 Favored 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 119.92 -0.712 . . . . 75.02 110.055 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.661 HD23 HD13 ' A' ' 26' ' ' LEU . 2.6 tm? -60.32 -47.14 87.3 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.536 -1.211 . . . . 72.04 111.104 -173.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.608 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 50.1 m -57.43 -48.77 78.24 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 123.191 0.307 . . . . 73.21 111.222 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.02 -39.56 69.24 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.19 0.996 . . . . 71.22 111.854 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.519 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.7 mmmt -73.0 -33.25 65.68 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.784 -0.366 . . . . 70.33 111.091 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.2 mt -62.01 -32.46 72.94 Favored 'General case' 0 C--O 1.183 -2.401 0 N-CA-C 109.986 -0.375 . . . . 74.42 109.986 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 34' ' ' SER . 67.6 mtt180 -63.21 -30.47 71.61 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.13 0.491 . . . . 74.33 111.482 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 t -87.47 -35.72 18.07 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 115.48 -0.782 . . . . 73.55 110.536 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.73 ' CD1' HG23 ' A' ' 72' ' ' THR . 56.9 m-85 -86.64 -49.14 7.73 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 113.009 0.744 . . . . 73.32 113.009 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 8.6 mp -88.99 114.08 58.7 Favored Pre-proline 0 C--N 1.3 -1.561 0 C-N-CA 123.834 0.854 . . . . 62.42 109.228 179.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.97 -32.38 13.66 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.678 1.585 . . . . 74.43 110.333 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.4 m -105.59 29.13 6.81 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 115.22 -0.9 . . . . 63.54 109.472 -177.41 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.503 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -44.89 101.49 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.965 1.306 . . . . 60.11 114.311 -174.497 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.45 72.8 6.05 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.333 1.063 . . . . 75.12 108.775 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.409 HD22 ' HB3' ' A' ' 34' ' ' SER . 3.4 pp -96.52 -16.12 21.28 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.327 -1.306 . . . . 74.41 112.192 -178.419 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -87.12 -1.88 58.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.797 0.808 . . . . 75.53 111.796 -173.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.02 73.59 1.25 Allowed 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.461 -0.495 . . . . 44.52 110.656 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.1 m -101.32 83.97 2.55 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-O 121.595 0.712 . . . . 55.35 109.666 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -30.41 70.66 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 114.715 -1.129 . . . . 73.04 112.172 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -120.74 169.5 8.7 Favored Pre-proline 1 N--CA 1.377 -4.078 0 N-CA-C 106.337 -1.727 . . . . 62.32 106.337 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -81.12 -151.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.804 1.669 . . . . 71.11 110.869 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.5 m -76.47 38.74 0.19 Allowed 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 124.29 1.036 . . . . 74.55 112.607 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -65.88 151.62 94.76 Favored Pre-proline 0 N--CA 1.447 -0.599 0 C-N-CA 123.472 0.709 . . . . 72.24 112.152 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.9 -42.01 60.19 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 123.866 3.044 . . . . 73.35 114.369 -176.795 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -74.35 -27.9 60.89 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 120.792 0.33 . . . . 74.1 110.9 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 95.0 t -69.84 -47.19 71.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 107.937 -1.134 . . . . 62.45 107.937 177.351 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.447 ' O ' HD23 ' A' ' 62' ' ' LEU . 45.9 mm -58.91 -47.66 88.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.557 -1.202 . . . . 74.1 109.507 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -54.89 -37.54 66.43 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.548 -0.751 . . . . 74.22 111.594 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 22.5 ttt85 -60.61 -48.1 83.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.607 0.718 . . . . 52.11 110.887 177.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -66.21 -45.05 82.09 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.675 -1.148 . . . . 74.34 110.712 -176.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.8 mm? -74.18 -31.17 62.57 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.385 -1.28 . . . . 72.13 111.454 -176.506 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -60.51 -42.42 96.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.716 0.769 . . . . 70.33 109.693 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -60.03 -31.02 69.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.605 -1.18 . . . . 72.14 112.69 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.23 -44.54 71.8 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 110.011 -0.366 . . . . 73.32 110.011 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.745 -0.661 . . . . 64.42 109.307 176.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.12 -29.73 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.436 -0.802 . . . . 62.11 111.651 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.565 ' HB2' HG21 ' A' ' 72' ' ' THR . 35.2 mm-40 -68.86 -45.71 70.35 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 121.437 0.637 . . . . 62.05 109.366 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -174.42 142.1 6.23 Favored Glycine 0 N--CA 1.408 -3.185 0 CA-C-N 115.051 -0.977 . . . . 73.23 111.643 -175.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.449 ' O ' ' HZ3' ' A' ' 98' ' ' TRP . 0.0 OUTLIER -67.5 -30.18 69.8 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 105.843 -1.91 . . . . 62.34 105.843 170.396 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.93 -35.33 64.59 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.866 -1.515 . . . . 73.34 108.824 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.73 HG23 ' CD1' ' A' ' 40' ' ' PHE . 54.1 m -59.18 -45.52 90.82 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 115.434 -0.803 . . . . 65.41 110.654 175.577 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.56 ' HD1' HG23 ' A' ' 95' ' ' VAL . 66.2 t-105 -66.47 -38.61 87.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 121.095 -0.242 . . . . 73.21 110.457 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.639 ' HA ' HG21 ' A' ' 95' ' ' VAL . 89.1 mttt -56.7 -48.76 76.97 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.264 0.554 . . . . 73.52 110.603 174.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 47.2 m -62.79 -42.27 99.63 Favored 'General case' 0 N--CA 1.4 -2.969 0 CA-C-N 114.771 -1.104 . . . . 74.11 110.455 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.81 -47.98 82.64 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 115.012 -0.994 . . . . 73.23 111.69 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.414 HG22 ' HG3' ' A' ' 91' ' ' GLU . 49.7 mm -65.55 -34.75 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 119.551 -0.86 . . . . 64.23 110.903 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -63.95 -37.7 88.37 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.022 -0.535 . . . . 73.33 110.272 177.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 84.2 m-20 -74.37 -42.62 59.04 Favored 'General case' 0 C--O 1.192 -1.96 0 CA-C-N 116.517 -0.31 . . . . 71.52 110.731 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -50.13 -53.99 23.75 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.518 1.527 . . . . 64.42 109.947 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 45.0 t -66.59 -32.12 73.26 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.693 -0.685 . . . . 43.22 110.958 -179.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -76.19 -55.13 5.86 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.892 -0.595 . . . . 74.15 111.631 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 21.4 mt-10 -75.33 -25.26 57.66 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 113.132 0.79 . . . . 63.42 113.132 -170.078 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.528 HD13 HD12 ' A' ' 25' ' ' LEU . 94.4 mt -88.0 12.14 14.13 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.857 0.688 . . . . 71.13 112.857 -176.721 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.8 t70 72.58 -54.75 0.69 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.675 1.19 . . . . 65.13 113.428 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.62 116.34 39.6 Favored Pre-proline 0 C--N 1.308 -1.197 0 C-N-CA 123.129 0.572 . . . . 63.44 111.302 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -82.96 80.76 2.57 Favored 'Trans proline' 0 N--CA 1.43 -2.242 0 C-N-CA 121.674 1.583 . . . . 74.01 110.786 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.529 ' CD1' ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -67.57 -25.65 65.9 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.653 -0.703 . . . . 63.35 111.864 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.492 ' O ' HD22 ' A' ' 88' ' ' LEU . 9.4 t70 63.06 -164.14 0.26 Allowed 'General case' 0 CA--C 1.551 0.993 0 O-C-N 124.303 1.002 . . . . 74.14 109.13 175.013 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.539 ' SD ' HD21 ' A' ' 18' ' ' LEU . 41.3 ttm 60.4 34.01 20.65 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 123.085 1.422 . . . . 74.1 108.363 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.414 ' HG3' HG22 ' A' ' 77' ' ' ILE . 35.2 tt0 -53.75 -44.99 70.44 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.46 2.304 . . . . 64.41 112.703 -174.409 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.736 ' HA ' HG12 ' A' ' 95' ' ' VAL . 41.5 mm -71.33 -50.33 11.12 Favored Pre-proline 0 C--O 1.197 -1.658 0 CA-C-O 118.701 -0.666 . . . . 71.02 111.774 -177.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.501 ' HB2' ' HG2' ' A' ' 90' ' ' MET . 47.3 Cg_exo -51.8 -34.21 53.8 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 121.524 1.482 . . . . 65.44 112.147 169.267 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.437 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 3.6 mm? -65.14 -42.66 93.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.743 0.306 . . . . 72.51 110.897 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.736 HG12 ' HA ' ' A' ' 92' ' ' ILE . 2.5 p -70.51 -36.5 66.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 122.39 1.09 . . . . 72.44 111.54 176.017 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.482 ' OG ' ' HB3' ' A' ' 9' ' ' GLU . 69.7 m -71.21 5.91 1.94 Allowed 'General case' 0 C--N 1.251 -3.709 0 CA-C-N 114.26 -1.336 . . . . 71.22 113.61 176.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.445 HD11 ' HB2' ' A' ' 19' ' ' TRP . 4.0 tp -67.83 -18.95 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 123.95 0.9 . . . . 74.45 109.288 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' TRP . . . . . 0.449 ' HZ3' ' O ' ' A' ' 70' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.237 0.411 0 C-N-CA 124.617 1.167 . . . . 70.41 113.833 -176.627 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 31.5 tpp . . . . . 0 C--O 1.205 -1.256 0 CA-C-O 121.531 0.682 . . . . 60.33 109.26 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -87.84 23.7 1.96 Allowed 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.773 -0.649 . . . . 63.15 111.433 -176.881 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.4 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -79.24 -21.24 46.46 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 122.066 0.936 . . . . 73.01 109.21 174.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.511 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.8 OUTLIER -60.85 -30.53 70.18 Favored 'General case' 0 C--O 1.202 -1.407 0 CA-C-N 114.232 -1.349 . . . . 74.21 112.955 -179.26 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.617 ' HB2' HD12 ' A' ' 11' ' ' ILE . 65.9 m -58.22 -38.68 77.28 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 122.186 0.993 . . . . 71.51 110.141 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.617 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.2 mp -79.74 -37.21 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.855 0 CA-C-N 113.413 -1.721 . . . . 64.15 109.94 -175.381 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -89.84 -4.56 57.52 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.979 -0.555 . . . . 55.12 111.201 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.4 mt 65.88 140.41 0.03 OUTLIER 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.532 1.933 . . . . 63.12 115.207 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -83.64 81.76 8.61 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.597 -2.371 . . . . 75.01 104.597 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.443 ' H ' HD23 ' A' ' 18' ' ' LEU . 25.5 t-20 -103.95 154.7 19.35 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-N 115.568 -0.742 . . . . 62.32 111.998 -171.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -52.85 -29.04 25.75 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.917 1.687 . . . . 62.44 111.607 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -57.7 -42.51 83.87 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.738 0.815 . . . . 74.25 110.365 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.623 HD12 HD22 ' A' ' 94' ' ' LEU . 3.0 mm? -67.01 -40.09 87.21 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.882 -0.599 . . . . 64.41 109.835 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -66.86 -47.51 71.67 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.287 -0.87 . . . . 75.3 109.731 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.14 -37.18 86.53 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.25 -0.432 . . . . 75.41 111.543 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -64.1 -50.45 68.24 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 110.27 -0.271 . . . . 74.2 110.27 175.508 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 40.7 tp -60.31 -53.01 62.7 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.721 -0.672 . . . . 62.41 110.166 -178.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.0 t -58.93 -42.17 85.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 C-N-CA 123.299 0.64 . . . . 54.21 112.592 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 52.5 ttt180 -70.98 -45.36 64.17 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.019 -0.672 . . . . 74.41 110.73 -176.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -66.25 -39.65 89.65 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.181 -0.674 . . . . 71.32 109.181 -177.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.589 HD13 HD23 ' A' ' 33' ' ' LEU . 7.9 mt -72.14 -25.48 61.73 Favored 'General case' 0 C--N 1.307 -1.283 0 N-CA-C 112.817 0.673 . . . . 72.3 112.817 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -68.13 -21.67 64.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.245 -1.02 . . . . 51.54 108.245 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 29.5 mtmt -92.26 -5.72 51.83 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.531 0.681 . . . . 54.42 109.948 178.361 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.434 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.4 m-80 -135.65 53.81 9.14 Favored Pre-proline 0 C--O 1.242 0.693 0 CA-C-N 115.403 -0.817 . . . . 53.02 112.06 -177.202 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.7 Cg_exo -68.96 -22.28 36.05 Favored 'Trans proline' 0 C--N 1.36 1.165 0 N-CA-C 108.881 -1.238 . . . . 64.23 108.881 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -67.55 -44.87 77.23 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 113.717 -1.583 . . . . 72.33 110.006 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.451 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 66.3 t90 -74.9 -44.9 46.24 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 119.708 -0.797 . . . . 71.41 110.062 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.589 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -58.01 -48.02 81.3 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.464 -1.244 . . . . 64.22 111.452 -173.175 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.697 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 19.6 p -54.5 -53.44 54.39 Favored 'General case' 0 C--O 1.21 -1.009 0 O-C-N 123.673 0.608 . . . . 75.24 111.791 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.61 -40.9 63.18 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.528 1.131 . . . . 63.41 112.687 176.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.451 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.3 mmmt -74.07 -30.51 62.41 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 120.288 -0.565 . . . . 75.12 111.543 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 95.4 mt -62.32 -37.95 87.56 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 108.836 -0.801 . . . . 73.3 108.836 172.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.697 ' HG3' ' O ' ' A' ' 34' ' ' SER . 74.7 mtp180 -62.54 -31.34 72.1 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.41 0.624 . . . . 62.24 111.199 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 39.4 m -73.07 -33.92 65.94 Favored 'General case' 0 N--CA 1.401 -2.897 0 C-N-CA 125.014 1.326 . . . . 64.12 111.814 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.618 ' CD1' HG23 ' A' ' 72' ' ' THR . 60.7 m-85 -95.93 -51.38 4.48 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.661 -0.7 . . . . 71.2 112.589 -176.511 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.549 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -96.71 111.26 56.78 Favored Pre-proline 0 N--CA 1.429 -1.522 0 N-CA-C 108.581 -0.896 . . . . 71.22 108.581 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.61 -11.93 16.9 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.582 2.188 . . . . 72.53 112.615 -177.219 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.5 p -114.34 29.52 7.96 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 123.619 0.768 . . . . 73.14 112.161 -176.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.674 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -47.51 111.51 0.43 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 115.222 1.564 . . . . 74.34 115.222 -175.624 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.48 65.83 0.69 Allowed 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 104.758 -2.312 . . . . 71.43 104.758 170.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.674 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.9 pp -91.96 -17.28 25.38 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.628 -1.624 . . . . 71.12 111.341 -171.069 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.0 -9.08 54.01 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.352 -0.84 . . . . 71.35 112.112 -174.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.0 m -80.15 89.13 5.42 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 115.484 -0.78 . . . . 62.53 112.17 -177.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -111.82 82.87 1.69 Allowed 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.6 -0.889 . . . . 74.4 108.6 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.86 -46.2 90.45 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 122.449 1.118 . . . . 65.13 111.708 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.493 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 53.9 mm-40 -101.26 168.92 8.43 Favored Pre-proline 0 C--N 1.244 -3.996 0 N-CA-C 105.469 -2.049 . . . . 63.14 105.469 175.135 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 54' ' ' ASN . 23.4 Cg_exo -67.51 -144.33 0.02 OUTLIER 'Trans proline' 0 CA--C 1.551 1.354 0 C-N-CA 122.616 2.211 . . . . 71.54 112.826 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -76.12 36.87 0.15 Allowed 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.079 0.952 . . . . 61.43 111.409 -177.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.482 ' O ' HG12 ' A' ' 58' ' ' ILE . 5.2 m-20 -67.45 149.06 98.56 Favored Pre-proline 0 N--CA 1.432 -1.33 0 C-N-CA 126.162 1.785 . . . . 74.03 112.419 -175.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PRO . . . . . 0.538 ' HG2' ' OE2' ' A' ' 56' ' ' GLU . 16.1 Cg_endo -61.99 -28.24 80.43 Favored 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.016 2.477 . . . . 61.11 111.598 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.538 ' OE2' ' HG2' ' A' ' 55' ' ' PRO . 3.4 mp0 -67.53 -37.9 83.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.526 -0.916 . . . . 73.35 108.526 177.05 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.493 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 84.9 t -74.29 -36.64 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 114.4 -1.273 . . . . 74.22 109.574 -178.701 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 54' ' ' ASN . 48.6 mm -64.72 -44.78 96.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.527 -0.76 . . . . 63.02 109.147 174.64 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' HIS . . . . . 0.453 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 59.8 t-80 -56.79 -40.84 76.64 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 123.254 0.621 . . . . 71.12 110.437 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.474 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 3.2 tpt180 -53.66 -48.19 69.66 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 125.16 1.384 . . . . 72.32 110.954 177.425 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.524 ' HB3' HD11 ' A' ' 37' ' ' LEU . 62.8 mt-30 -70.72 -50.97 30.6 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.869 -1.06 . . . . 65.3 110.756 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.426 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.2 mm? -66.78 -30.42 70.62 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 114.562 -1.199 . . . . 71.11 112.695 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 56.9 t30 -52.95 -40.39 63.62 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 125.132 1.373 . . . . 72.12 110.717 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.549 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 29.3 mmt180 -60.43 -30.76 69.83 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 72.13 112.976 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.03 -38.14 72.58 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.347 . . . . 42.43 110.886 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -71.71 -27.83 63.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.283 -0.636 . . . . 73.34 109.283 177.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.71 -31.94 72.23 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 115.189 -0.914 . . . . 72.34 109.665 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.405 ' CB ' HG21 ' A' ' 72' ' ' THR . 8.7 mm-40 -70.84 -54.44 11.56 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 109.273 -0.64 . . . . 71.21 109.273 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -177.96 146.56 7.6 Favored Glycine 0 N--CA 1.417 -2.614 0 C-N-CA 120.447 -0.882 . . . . 70.24 113.111 -175.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -69.73 -26.76 64.48 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 106.056 -1.831 . . . . 55.0 106.056 169.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.83 -31.61 63.3 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 113.658 -1.61 . . . . 64.43 108.189 175.132 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.618 HG23 ' CD1' ' A' ' 40' ' ' PHE . 51.6 m -71.25 -39.67 71.48 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 115.538 -0.756 . . . . 64.04 111.07 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.494 ' HD1' ' O ' ' A' ' 95' ' ' VAL . 47.3 t-105 -63.9 -35.01 79.24 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 107.696 -1.224 . . . . 72.43 107.696 174.131 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.941 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 78.5 tttt -62.23 -45.85 91.5 Favored 'General case' 1 N--CA 1.366 -4.671 0 N-CA-C 114.832 1.419 . . . . 73.32 114.832 173.292 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.2 m -62.75 -34.95 78.26 Favored 'General case' 0 N--CA 1.41 -2.425 0 CA-C-O 122.081 0.943 . . . . 71.12 109.342 175.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' PHE . . . . . 0.417 ' HB3' ' O ' ' A' ' 73' ' ' TRP . 73.2 t80 -62.26 -52.44 63.72 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 113.835 -1.529 . . . . 60.4 112.623 -178.708 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.709 HG13 ' HA ' ' A' ' 95' ' ' VAL . 50.2 mm -68.04 -29.13 43.65 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 C-N-CA 119.022 -1.071 . . . . 74.21 111.094 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -63.76 -41.22 98.02 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.188 -0.46 . . . . 73.23 110.93 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -76.12 -37.04 58.57 Favored 'General case' 0 C--O 1.21 -1.015 0 C-N-CA 120.412 -0.515 . . . . 73.2 110.307 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.49 -54.21 24.03 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.989 1.315 . . . . 71.04 109.388 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.462 ' SG ' HD13 ' A' ' 88' ' ' LEU . 60.1 m -64.16 -38.36 90.77 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.405 -0.816 . . . . 71.55 111.654 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -75.57 -48.18 23.46 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.067 -0.515 . . . . 75.0 111.404 -175.83 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -76.48 -33.66 58.68 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 114.918 1.451 . . . . 74.2 114.918 -175.072 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.6 mt -83.14 -21.63 33.54 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.661 -0.815 . . . . 74.03 111.324 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 70.89 -9.06 0.87 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.321 1.048 . . . . 62.31 112.935 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.02 137.56 94.65 Favored Pre-proline 0 N--CA 1.437 -1.11 0 N-CA-C 109.092 -0.707 . . . . 75.13 109.092 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -84.41 102.81 0.9 Allowed 'Trans proline' 0 N--CA 1.436 -1.854 0 C-N-CA 121.755 1.637 . . . . 61.23 112.978 -177.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.462 HD13 ' SG ' ' A' ' 81' ' ' CYS . 4.5 mp -90.96 -41.07 11.33 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 107.936 -1.135 . . . . 61.44 107.936 173.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.9 t70 68.71 -54.33 0.55 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.531 1.532 . . . . 74.43 112.923 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 64.4 mtt -96.94 82.3 3.22 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.593 -0.892 . . . . 53.05 108.593 175.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -71.3 -34.31 70.5 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 125.735 1.614 . . . . 73.14 112.257 -176.093 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.563 ' HB ' ' HD3' ' A' ' 93' ' ' PRO . 50.1 mm -49.66 -52.07 54.04 Favored Pre-proline 0 CA--C 1.572 1.792 0 C-N-CA 125.004 1.322 . . . . 72.52 113.475 -173.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.563 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 13.8 Cg_exo -58.84 -37.94 91.12 Favored 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 121.526 1.484 . . . . 74.31 111.649 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.636 ' O ' HG22 ' A' ' 97' ' ' ILE . 4.2 mm? -64.04 -37.46 87.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.567 0.747 . . . . 42.53 111.286 176.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.941 ' CG2' ' HA ' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -85.69 -27.64 6.32 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.179 0 CA-C-O 121.877 0.846 . . . . 74.5 112.712 -171.234 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 96' ' ' SER . . . . . 0.447 ' CB ' ' HG2' ' A' ' 9' ' ' GLU . 9.4 t -101.66 5.3 41.43 Favored 'General case' 0 C--N 1.256 -3.485 0 C-N-CA 119.245 -0.982 . . . . 72.33 111.279 -177.569 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.636 HG22 ' O ' ' A' ' 94' ' ' LEU . 15.5 tt -77.14 -49.62 22.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 112.643 0.609 . . . . 73.44 112.643 -177.589 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.2 m0 . . . . . 0 CA--C 1.56 1.36 0 C-N-CA 126.23 1.812 . . . . 64.32 113.124 -176.577 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.543 ' SD ' ' HB3' ' A' ' 74' ' ' LYS . 34.6 tpp . . . . . 0 C--O 1.216 -0.673 0 CA-C-O 121.621 0.724 . . . . 73.24 110.53 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -109.03 24.96 12.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.743 -0.662 . . . . 75.32 110.606 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.514 ' HA ' HD13 ' A' ' 11' ' ' ILE . . . -79.46 -7.43 58.41 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.111 0.958 . . . . 72.0 109.721 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.408 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -69.85 -30.05 67.44 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.937 1.295 . . . . 75.3 111.791 -178.987 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.735 ' HB2' HD12 ' A' ' 11' ' ' ILE . 49.6 m -57.39 -29.32 63.99 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 125.418 1.487 . . . . 73.33 110.348 174.236 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.735 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -88.13 -34.28 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.218 0 CA-C-N 114.126 -1.397 . . . . 74.31 111.666 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -75.22 -66.63 0.74 Allowed 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.223 1.564 . . . . 74.34 115.223 -167.02 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 54.9 177.09 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 115.31 1.596 . . . . 70.11 115.31 -178.562 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 38.7 t30 68.92 126.66 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 125.317 1.447 . . . . 64.51 110.472 -176.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.534 ' HB2' HG13 ' A' ' 97' ' ' ILE . 9.1 p30 -150.84 28.21 0.69 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 114.315 1.228 . . . . 74.45 114.315 -173.575 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.48 -49.97 67.07 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.294 -0.963 . . . . 60.51 113.288 -176.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -75.52 -33.03 60.69 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.246 -1.02 . . . . 73.45 108.246 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.646 HD21 ' HA ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -55.76 -46.61 77.83 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 113.73 -1.577 . . . . 74.05 111.262 178.865 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -59.57 -48.15 82.8 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.431 -0.804 . . . . 74.51 110.986 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.71 65.91 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.2 -0.455 . . . . 73.34 111.362 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.42 ' HE1' HD21 ' A' ' 88' ' ' LEU . 42.1 t-105 -71.1 -51.4 25.33 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 110.269 -0.271 . . . . 70.11 110.269 175.203 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.91 -51.17 67.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.023 -0.535 . . . . 73.32 110.473 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.5 t -60.11 -45.14 96.15 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-N 115.602 -0.727 . . . . 75.3 112.73 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 75.7 ttt180 -71.82 -41.93 67.61 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.483 -0.487 . . . . 74.2 110.864 -177.44 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.498 HD12 HD13 ' A' ' 84' ' ' LEU . 1.9 tm? -65.66 -41.91 91.96 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.255 0.55 . . . . 73.43 109.864 -177.15 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.662 HD13 HD23 ' A' ' 33' ' ' LEU . 4.3 mt -72.17 -24.96 61.52 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.342 0.497 . . . . 73.43 112.342 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.8 t -67.04 -24.65 66.02 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 108.4 -0.963 . . . . 71.14 108.4 177.423 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 59.5 mttt -87.02 -12.95 45.85 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.612 -0.722 . . . . 44.22 109.66 178.605 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.416 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.6 m-80 -129.97 54.06 13.43 Favored Pre-proline 0 N--CA 1.444 -0.747 0 CA-C-N 115.353 -0.84 . . . . 64.24 113.208 -173.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.416 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.0 Cg_exo -69.48 -22.2 33.72 Favored 'Trans proline' 0 C--N 1.357 1.003 0 N-CA-C 108.24 -1.485 . . . . 64.45 108.24 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.83 -41.8 91.32 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.593 -1.639 . . . . 74.34 109.893 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.5 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 76.5 t90 -75.3 -43.64 49.9 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.518 -0.873 . . . . 74.45 109.934 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.662 HD23 HD13 ' A' ' 26' ' ' LEU . 1.9 tm? -60.69 -40.16 91.16 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.38 -1.282 . . . . 73.42 111.191 -173.335 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.543 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 51.0 p -53.46 -53.52 50.26 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.196 0.31 . . . . 74.1 111.21 176.915 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.432 ' HA ' ' NE ' ' A' ' 38' ' ' ARG . . . -52.1 -48.62 64.65 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.519 1.528 . . . . 74.43 112.192 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 69.0 mmtt -69.27 -32.03 70.95 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 120.424 -0.51 . . . . 34.31 111.921 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.566 HD12 HD22 ' A' ' 46' ' ' LEU . 37.4 mt -67.15 -31.05 71.22 Favored 'General case' 0 C--O 1.187 -2.212 0 C-N-CA 120.127 -0.629 . . . . 74.43 110.367 173.701 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 34' ' ' SER . 24.6 mtm180 -61.79 -33.61 74.42 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.792 0.806 . . . . 74.22 109.589 177.253 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' SER . . . . . 0.41 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 75.3 m -78.4 -29.66 47.34 Favored 'General case' 0 N--CA 1.398 -3.073 0 C-N-CA 125.126 1.37 . . . . 64.33 113.174 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.571 ' CD1' HG23 ' A' ' 72' ' ' THR . 52.5 m-85 -102.16 -46.63 4.78 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 112.863 0.69 . . . . 74.31 112.863 -178.243 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 8.7 mp -91.29 135.59 28.03 Favored Pre-proline 0 C--N 1.294 -1.84 0 C-N-CA 124.491 1.116 . . . . 52.15 110.701 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -90.86 -14.44 1.89 Allowed 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.343 2.029 . . . . 60.02 110.453 169.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.2 p -114.01 28.2 8.94 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 124.44 1.096 . . . . 71.22 111.531 -175.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.488 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -68.43 113.2 5.78 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.664 -1.153 . . . . 73.54 112.733 -177.295 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -147.14 75.55 1.38 Allowed 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 114.364 -1.289 . . . . 71.15 109.008 173.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.566 HD22 HD12 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -92.81 -12.29 31.55 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.126 -1.397 . . . . 65.44 108.744 -179.268 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.98 -16.66 63.79 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.264 -1.335 . . . . 72.45 111.538 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 51.8 t -79.72 92.95 5.47 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 106.98 -1.489 . . . . 64.43 106.98 173.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.5 m -91.32 86.34 6.09 Favored 'General case' 0 N--CA 1.411 -2.378 0 CA-C-O 121.783 0.802 . . . . 72.02 111.733 -176.094 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -41.57 82.05 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.867 1.318 . . . . 74.12 108.597 173.035 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.586 ' HG3' ' CG2' ' A' ' 57' ' ' VAL . 2.5 pt-20 -137.34 163.37 49.38 Favored Pre-proline 0 C--N 1.258 -3.386 0 CA-C-N 112.216 -2.265 . . . . 63.14 108.097 170.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 51' ' ' GLU . 57.8 Cg_endo -69.42 -156.43 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.814 2.343 . . . . 64.11 113.057 -177.301 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 m -75.59 38.75 0.15 Allowed 'General case' 0 C--O 1.251 1.157 0 C-N-CA 124.616 1.166 . . . . 71.3 112.571 -176.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.462 ' HB2' HG23 ' A' ' 57' ' ' VAL . 95.8 m-20 -58.47 152.06 46.65 Favored Pre-proline 0 N--CA 1.436 -1.17 0 C-N-CA 125.5 1.52 . . . . 72.41 111.025 177.607 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.73 -39.11 90.95 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.514 2.809 . . . . 75.45 112.732 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -72.75 -31.96 65.31 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.683 -0.69 . . . . 72.43 110.05 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.586 ' CG2' ' HG3' ' A' ' 51' ' ' GLU . 67.5 t -69.66 -46.33 75.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.298 -0.864 . . . . 61.34 108.89 178.232 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.444 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.5 mm -59.45 -46.92 92.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.037 -0.983 . . . . 75.54 109.338 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -55.93 -39.68 72.04 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.791 0.436 . . . . 73.35 111.483 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -64.07 -39.82 94.92 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.349 0.595 . . . . 64.04 111.2 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.45 HE21 HG12 ' A' ' 57' ' ' VAL . 78.2 mt-30 -70.81 -45.49 64.51 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.019 -0.992 . . . . 74.13 110.395 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -66.14 -31.08 71.71 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.254 -1.339 . . . . 51.34 111.509 -178.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -52.75 -43.06 65.51 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.869 1.268 . . . . 74.13 110.57 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.88 -30.09 63.55 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.305 -1.316 . . . . 73.24 113.076 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.439 HD12 HD13 ' A' ' 62' ' ' LEU . 90.9 mt -72.34 -42.29 65.51 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-O 120.623 0.249 . . . . 62.42 111.431 -177.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -70.55 -28.14 64.68 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.367 -0.975 . . . . 65.34 108.367 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.56 -41.07 96.54 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.079 -0.964 . . . . 44.25 109.841 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.497 ' HB2' HG21 ' A' ' 72' ' ' THR . 43.5 mm-40 -63.96 -47.19 81.4 Favored 'General case' 0 N--CA 1.426 -1.666 0 N-CA-C 109.641 -0.503 . . . . 63.23 109.641 176.201 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -176.92 143.44 6.31 Favored Glycine 0 N--CA 1.407 -3.261 0 C-N-CA 120.356 -0.926 . . . . 73.34 113.841 -176.111 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -69.87 -27.11 64.55 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 106.565 -1.643 . . . . 74.44 106.565 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.05 -37.66 58.03 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.407 -1.269 . . . . 34.33 108.473 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.571 HG23 ' CD1' ' A' ' 40' ' ' PHE . 94.0 m -59.6 -35.66 74.76 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.093 -0.958 . . . . 75.24 110.754 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.559 ' CD1' HG23 ' A' ' 95' ' ' VAL . 58.5 t-105 -63.88 -42.69 97.44 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 109.668 -0.493 . . . . 75.23 109.668 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.782 ' HA ' HG21 ' A' ' 95' ' ' VAL . 50.3 mttt -62.84 -47.09 84.9 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.198 0.599 . . . . 75.55 110.887 177.278 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.7 m -61.32 -40.8 95.55 Favored 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 115.914 -0.584 . . . . 71.12 110.882 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -60.64 -50.65 72.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.363 -0.835 . . . . 64.2 111.016 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.532 HG13 ' HA ' ' A' ' 95' ' ' VAL . 32.4 mm -66.88 -33.38 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 120.482 -0.487 . . . . 63.42 111.528 -175.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -60.63 -43.16 97.85 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.862 -0.422 . . . . 52.12 109.862 176.662 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.3 m-20 -71.66 -42.11 67.92 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.98 -0.554 . . . . 72.43 111.274 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.45 ' HA ' ' CZ2' ' A' ' 32' ' ' TRP . 2.4 tm? -50.45 -54.62 20.7 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.346 1.458 . . . . 72.35 109.774 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 88' ' ' LEU . 46.9 t -67.55 -32.21 72.83 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.806 -1.088 . . . . 73.1 111.24 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -72.85 -44.58 61.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.448 -0.796 . . . . 74.3 111.65 -176.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 9.8 mt-10 -89.24 -19.67 25.09 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 113.98 1.104 . . . . 63.55 113.98 -171.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.498 HD13 HD12 ' A' ' 25' ' ' LEU 0.255 85.3 mt -82.16 49.13 1.35 Allowed 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 115.658 1.725 . . . . 70.23 115.658 -174.579 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.464 ' OD2' HG23 ' A' ' 86' ' ' VAL . 26.6 t70 71.73 -73.11 0.1 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.684 1.364 . . . . 43.43 114.684 173.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.464 HG23 ' OD2' ' A' ' 85' ' ' ASP . 71.3 t -99.77 124.46 43.94 Favored Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 122.385 -0.197 . . . . 73.44 110.917 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.28 107.06 0.76 Allowed 'Trans proline' 0 C--O 1.252 1.202 0 C-N-CA 122.845 2.363 . . . . 74.12 111.481 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.44 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 4.8 mp -64.45 -38.87 92.55 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.312 -0.858 . . . . 70.4 109.606 179.459 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.9 t70 65.38 9.94 6.13 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-O 122.818 1.294 . . . . 45.31 111.333 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.455 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 25.5 ptm -124.43 39.95 3.85 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 107.657 -1.238 . . . . 74.2 107.657 177.706 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -40.13 95.05 Favored 'General case' 0 C--O 1.203 -1.386 0 CA-C-N 114.021 -1.445 . . . . 63.04 111.003 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.729 ' HA ' HG12 ' A' ' 95' ' ' VAL . 31.1 mm -64.53 -48.33 74.76 Favored Pre-proline 0 C--N 1.29 -2.003 0 CA-C-O 119.088 -0.482 . . . . 70.41 111.518 179.433 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.455 ' HD2' ' C ' ' A' ' 90' ' ' MET . 84.6 Cg_exo -51.23 -38.44 61.4 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 121.507 1.471 . . . . 75.23 111.01 170.077 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.646 ' HA ' HD21 ' A' ' 18' ' ' LEU . 3.2 mm? -63.48 -46.47 86.0 Favored 'General case' 0 C--O 1.188 -2.178 0 O-C-N 123.371 0.42 . . . . 74.12 112.076 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.782 HG21 ' HA ' ' A' ' 74' ' ' LYS . 5.7 p -68.79 -31.53 51.12 Favored 'Isoleucine or valine' 0 C--O 1.251 1.18 0 CA-C-O 122.377 1.084 . . . . 72.23 112.817 -178.822 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.5 t -62.36 -6.86 3.59 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 113.329 -1.759 . . . . 62.14 111.621 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.534 HG13 ' HB2' ' A' ' 15' ' ' ASN . 15.3 tt -61.21 -28.58 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 124.333 1.053 . . . . 75.35 111.869 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 34.0 t-105 . . . . . 0 C--N 1.315 -0.91 0 C-N-CA 120.539 -0.465 . . . . 72.13 111.478 -174.449 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.503 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 2.1 mpt? . . . . . 0 C--O 1.213 -0.832 0 N-CA-C 111.343 0.127 . . . . 74.23 111.343 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -81.16 24.58 0.52 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 113.055 0.761 . . . . 74.41 113.055 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.433 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.46 -17.66 56.0 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.425 -0.583 . . . . 74.31 109.425 174.116 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 6' ' ' MET . 0.3 OUTLIER -54.18 -43.63 70.85 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.078 0.951 . . . . 74.45 111.527 178.973 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -55.83 -31.54 62.81 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 124.743 1.217 . . . . 72.42 111.224 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.433 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.2 mp -87.6 -34.84 7.65 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 C-N-CA 124.825 1.25 . . . . 65.34 111.521 -176.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -91.63 -44.27 9.14 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 115.436 1.643 . . . . 75.33 115.436 -171.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 64.44 171.01 0.19 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.778 0.831 . . . . 75.22 112.989 -174.532 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ASN . . . . . 0.414 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 4.4 p-10 -108.56 -176.97 3.19 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 112.724 0.638 . . . . 65.31 112.724 -175.138 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . 0.5 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 45.2 t-20 -155.26 142.95 19.78 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.557 -0.905 . . . . 74.34 108.557 -176.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.83 -29.83 67.19 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.779 0.659 . . . . 71.53 112.779 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -68.41 -32.85 73.18 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 122.405 1.098 . . . . 62.03 108.959 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.529 HD21 ' HA ' ' A' ' 94' ' ' LEU . 7.0 tt -69.92 -35.11 74.31 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 113.158 -1.837 . . . . 74.34 109.568 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 59.2 t-105 -63.63 -44.97 92.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.596 -0.52 . . . . 75.43 109.596 175.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.46 -40.99 93.18 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.033 -0.531 . . . . 74.14 110.308 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -57.49 -50.57 72.64 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.643 -0.708 . . . . 65.53 110.704 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.48 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 57.4 tp -59.53 -51.32 70.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.059 -0.519 . . . . 74.23 110.609 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.54 -51.4 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.095 -0.502 . . . . 71.13 111.984 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 31.3 mmt180 -70.27 -38.46 75.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.964 0.357 . . . . 75.33 111.964 -174.304 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -66.47 -41.52 88.89 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.881 -0.785 . . . . 75.3 108.881 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.701 HD13 HD23 ' A' ' 33' ' ' LEU . 5.4 mt -70.71 -24.89 62.73 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.412 0.523 . . . . 71.32 112.412 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.1 m -68.46 -20.91 64.65 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.024 -0.732 . . . . 73.11 109.024 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 34.1 mtmt -92.06 -3.56 55.61 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.799 -0.637 . . . . 63.31 109.31 177.998 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.437 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 54.1 m-80 -137.53 54.08 7.48 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 115.641 -0.709 . . . . 65.42 111.945 -177.163 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 13.4 Cg_exo -70.41 -19.86 32.5 Favored 'Trans proline' 0 C--N 1.358 1.044 0 N-CA-C 108.643 -1.329 . . . . 71.53 108.643 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -69.56 -43.93 71.9 Favored 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.06 -1.427 . . . . 51.55 109.731 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.0 t90 -74.77 -43.05 56.87 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 120.133 -0.627 . . . . 74.33 110.196 177.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.701 HD23 HD13 ' A' ' 26' ' ' LEU . 2.4 tm? -59.77 -45.78 91.2 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.178 -0.919 . . . . 72.33 111.016 -173.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.407 ' HB2' HD22 ' A' ' 46' ' ' LEU . 32.1 p -62.54 -35.37 79.23 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 112.025 0.38 . . . . 25.12 112.025 178.639 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.53 99.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.469 0.652 . . . . 65.24 110.391 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.9 mmtt -72.48 -31.7 65.61 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 120.234 -0.586 . . . . 73.02 111.714 175.931 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 73.0 mt -58.43 -50.84 72.25 Favored 'General case' 0 C--O 1.201 -1.462 0 CA-C-O 119.864 -0.112 . . . . 72.34 111.229 176.79 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -60.4 -30.49 69.63 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.232 0.826 . . . . 74.52 113.232 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.4 m -72.38 -50.13 28.83 Favored 'General case' 1 N--CA 1.375 -4.214 0 CA-C-N 114.55 -1.204 . . . . 74.14 112.078 176.61 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.437 ' CD1' HG23 ' A' ' 72' ' ' THR . 55.5 m-85 -80.8 -43.89 19.37 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.507 0.929 . . . . 72.4 113.507 -175.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.6 ' HG ' ' OE1' ' A' ' 68' ' ' GLN . 6.5 mp -79.43 124.78 83.89 Favored Pre-proline 0 C--N 1.287 -2.116 0 C-N-CA 124.125 0.97 . . . . 62.11 111.605 -176.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -82.08 -10.33 11.45 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.875 1.716 . . . . 70.42 107.957 168.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 p -111.48 29.33 7.92 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 127.29 2.236 . . . . 74.31 109.987 -178.008 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.314 0.0 OUTLIER -54.0 92.41 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 116.502 2.038 . . . . 73.14 116.502 -179.401 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASP . . . . . 0.641 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 8.7 m-20 -118.44 81.65 1.72 Allowed 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.607 -1.627 . . . . 74.4 106.607 174.557 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.407 HD22 ' HB2' ' A' ' 34' ' ' SER . 3.7 pp -95.51 -6.52 40.37 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.161 -1.381 . . . . 62.45 111.52 -176.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.78 4.0 49.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.391 -0.822 . . . . 75.34 110.375 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' CYS . . . . . 0.641 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 64.3 m -88.32 30.46 0.88 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.414 0.626 . . . . 73.4 111.57 -177.173 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -80.2 89.51 5.46 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 109.236 -0.653 . . . . 64.2 109.236 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.37 -25.51 65.11 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.049 -0.978 . . . . 72.52 112.584 178.288 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -132.58 167.75 21.15 Favored Pre-proline 1 N--CA 1.378 -4.039 0 CA-C-N 113.925 -1.489 . . . . 65.44 107.176 178.098 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -63.79 -141.06 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.388 2.725 . . . . 72.03 113.285 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -76.21 37.65 0.16 Allowed 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.773 0.829 . . . . 65.33 111.963 -177.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.465 ' HB2' HG23 ' A' ' 57' ' ' VAL . 6.4 m120 -67.64 145.78 98.3 Favored Pre-proline 0 C--N 1.301 -1.519 0 C-N-CA 124.497 1.119 . . . . 55.51 111.491 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.1 -38.2 92.57 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.413 2.742 . . . . 71.2 113.187 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.08 -28.69 60.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.741 0.305 . . . . 61.42 110.359 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.465 HG23 ' HB2' ' A' ' 54' ' ' ASN . 86.1 t -66.04 -50.9 66.04 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.511 0 N-CA-C 107.835 -1.172 . . . . 74.53 107.835 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.4 mm -59.67 -42.7 89.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.329 -1.305 . . . . 63.13 109.873 177.326 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -58.44 -36.29 73.42 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.978 -0.556 . . . . 63.12 111.592 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 31.7 ttm-85 -63.16 -41.79 99.3 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.951 0.882 . . . . 71.12 110.731 177.247 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 74.6 mt-30 -67.23 -39.65 86.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.547 -1.206 . . . . 74.4 110.313 -177.056 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.462 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -74.09 -31.05 62.65 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.8 -1.091 . . . . 72.04 110.676 177.138 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.433 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 8.6 t30 -61.87 -35.51 78.51 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 124.247 1.019 . . . . 70.22 109.364 178.445 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -58.26 -55.84 29.85 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 114.98 -1.009 . . . . 74.4 110.257 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.599 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 79.6 mt -57.27 -33.83 68.02 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.929 0.491 . . . . 74.32 111.327 -177.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -57.15 -45.86 83.21 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.554 -0.748 . . . . 72.13 109.561 176.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.4 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 61.51 110.811 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.6 ' OE1' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -60.25 -47.68 84.98 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 123.842 0.857 . . . . 73.4 111.067 177.046 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 166.47 138.46 2.44 Favored Glycine 0 N--CA 1.411 -3.03 0 C-N-CA 119.867 -1.159 . . . . 55.2 112.695 -178.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.442 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -70.29 -27.07 64.11 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 105.913 -1.884 . . . . 75.41 105.913 170.42 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.4 67.59 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.111 -1.404 . . . . 54.03 108.044 175.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.495 HG21 ' HB3' ' A' ' 68' ' ' GLN . 98.7 m -64.93 -34.43 78.38 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.356 -0.838 . . . . 52.45 110.087 177.399 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.642 ' HD1' HG23 ' A' ' 95' ' ' VAL . 33.1 t-105 -66.56 -39.52 88.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.503 -0.554 . . . . 73.43 109.503 179.062 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.778 ' HA ' HG21 ' A' ' 95' ' ' VAL . 84.3 mttt -57.17 -52.0 67.06 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 122.874 0.469 . . . . 74.41 111.084 174.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.6 m -58.09 -41.82 84.31 Favored 'General case' 0 N--CA 1.411 -2.383 0 CA-C-O 121.791 0.805 . . . . 62.41 110.13 178.17 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -61.12 -49.96 75.16 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 114.497 -1.229 . . . . 74.12 111.567 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.538 HG21 ' O ' ' A' ' 91' ' ' GLU . 49.1 mm -68.15 -31.38 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 119.676 -0.809 . . . . 65.13 112.01 -175.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -62.04 -37.47 85.04 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.195 0.521 . . . . 73.21 109.745 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.21 -35.92 47.9 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.426 -0.51 . . . . 75.51 111.733 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -53.02 -54.88 28.77 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 124.657 1.183 . . . . 75.1 109.004 178.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 14.8 p -68.34 -36.82 79.82 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.839 -0.618 . . . . 63.2 112.605 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.66 -54.43 7.44 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.932 -0.576 . . . . 54.13 112.029 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -76.31 -21.31 56.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.93 1.085 . . . . 75.13 113.93 -172.593 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.33 19.21 2.83 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 112.21 0.448 . . . . 72.12 112.21 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 72.94 -63.33 0.44 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.478 1.511 . . . . 75.25 112.65 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.5 m -72.63 120.69 82.04 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-O 121.115 0.483 . . . . 74.34 112.087 -176.163 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -72.1 117.38 5.11 Favored 'Trans proline' 0 N--CA 1.44 -1.652 0 C-N-CA 121.813 1.675 . . . . 55.24 109.719 177.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.5 mt -79.97 -28.94 39.5 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 116.231 -0.44 . . . . 75.2 110.231 -178.202 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.9 t70 71.66 -44.47 0.59 Allowed 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 126.116 1.766 . . . . 74.3 111.301 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.489 ' O ' HD23 ' A' ' 94' ' ' LEU . 67.8 mtt -84.22 47.92 1.41 Allowed 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 125.192 1.397 . . . . 72.13 110.273 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.538 ' O ' HG21 ' A' ' 77' ' ' ILE . 10.7 pt-20 -70.68 -35.63 72.91 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.254 0.55 . . . . 74.42 111.147 -178.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.778 ' HA ' HG12 ' A' ' 95' ' ' VAL . 24.4 mm -63.96 -47.8 79.61 Favored Pre-proline 0 C--O 1.184 -2.354 0 CA-C-O 118.292 -0.861 . . . . 60.12 111.028 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.463 ' HD2' ' C ' ' A' ' 90' ' ' MET . 25.4 Cg_exo -48.76 -37.41 35.44 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 122.098 1.865 . . . . 73.13 112.176 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.529 ' HA ' HD21 ' A' ' 18' ' ' LEU . 4.5 mm? -67.51 -36.42 81.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.193 0.597 . . . . 74.35 111.287 175.983 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.778 HG21 ' HA ' ' A' ' 74' ' ' LYS . 7.5 p -84.58 -32.69 7.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-O 122.178 0.99 . . . . 71.24 113.026 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.5 t -63.13 -6.5 4.28 Favored 'General case' 0 C--N 1.271 -2.845 0 CA-C-N 113.935 -1.484 . . . . 73.55 112.427 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.414 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 13.8 tt -71.63 -17.36 19.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-O 121.829 0.823 . . . . 53.32 109.654 177.493 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.469 0 N-CA-C 104.899 -2.26 . . . . 70.2 104.899 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.538 ' SD ' HD12 ' A' ' 92' ' ' ILE . 47.8 tpp . . . . . 0 CA--C 1.551 0.99 0 CA-C-O 122.57 1.176 . . . . 74.41 110.005 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ASP . . . . . 0.455 ' O ' HD13 ' A' ' 11' ' ' ILE . 52.4 m-20 -118.88 24.76 10.65 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-N 114.157 -1.383 . . . . 75.02 108.524 177.587 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.52 -19.74 52.26 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.935 -0.765 . . . . 45.4 108.935 175.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.476 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -53.66 -45.5 70.28 Favored 'General case' 0 C--O 1.207 -1.148 0 N-CA-C 114.735 1.383 . . . . 75.41 114.735 -177.248 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 10' ' ' SER . . . . . 0.539 ' HB2' HD12 ' A' ' 11' ' ' ILE . 73.0 m -65.24 -35.91 82.51 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-O 121.74 0.781 . . . . 72.44 111.895 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.539 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.4 -41.06 14.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 C-N-CA 124.383 1.073 . . . . 55.55 111.852 -172.202 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmm180 -103.18 7.89 38.59 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.846 0.858 . . . . 72.43 112.008 -172.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -43.78 126.43 4.65 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.571 1.322 . . . . 71.33 114.571 -173.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -152.36 132.07 13.17 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 103.642 -2.725 . . . . 70.35 103.642 174.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -118.84 -61.37 1.66 Allowed 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.667 -0.813 . . . . 63.41 112.841 -174.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -71.11 -48.4 52.43 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.349 0.499 . . . . 62.14 112.349 -171.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -66.1 -35.83 81.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.871 0.844 . . . . 51.22 109.557 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -70.43 -42.32 71.72 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 114.304 -1.316 . . . . 74.12 110.051 -178.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -60.0 -51.37 69.95 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.575 -0.528 . . . . 72.32 109.575 175.156 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -57.71 -48.54 79.28 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.79 -0.641 . . . . 73.11 111.119 -178.917 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.693 ' CH2' ' HB2' ' A' ' 25' ' ' LEU . 7.7 t-105 -56.25 -50.91 69.98 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 123.252 0.345 . . . . 72.13 111.276 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.89 -42.73 94.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 110.358 -0.238 . . . . 63.43 110.358 -176.361 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.41 -46.04 97.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.248 -0.433 . . . . 65.34 110.787 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.594 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 67.0 mtt180 -62.85 -48.17 80.18 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 109.786 -0.45 . . . . 73.02 109.786 178.49 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.693 ' HB2' ' CH2' ' A' ' 21' ' ' TRP . 30.1 tp -55.45 -48.56 74.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.693 1.197 . . . . 72.44 111.705 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.582 HD13 HD23 ' A' ' 33' ' ' LEU . 9.8 mt -73.65 -23.98 59.93 Favored 'General case' 0 C--N 1.281 -2.393 0 CA-C-N 115.475 -0.784 . . . . 63.42 112.73 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.6 t -75.22 -16.93 60.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 107.735 -1.209 . . . . 62.2 107.735 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.594 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 39.1 mtmt -90.61 -13.81 33.65 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.361 -0.607 . . . . 64.23 109.361 174.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.482 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.0 m-80 -137.34 49.48 2.84 Favored Pre-proline 0 C--O 1.241 0.657 0 CA-C-N 115.489 -0.778 . . . . 65.01 112.187 -175.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.482 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.1 Cg_exo -71.33 -20.79 27.41 Favored 'Trans proline' 0 C--N 1.362 1.265 0 N-CA-C 108.522 -1.376 . . . . 65.15 108.522 -178.619 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.14 -39.45 78.83 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 113.851 -1.522 . . . . 74.42 109.839 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.559 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 61.4 t90 -74.08 -40.13 62.97 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 118.872 -1.131 . . . . 74.02 109.136 178.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.582 HD23 HD13 ' A' ' 26' ' ' LEU . 1.4 tm? -62.84 -39.86 95.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 114.674 -1.148 . . . . 75.5 109.783 -175.411 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.502 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 65.9 m -53.28 -49.53 66.75 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 123.468 0.48 . . . . 74.33 111.024 175.31 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.46 -46.09 73.25 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.332 1.053 . . . . 64.52 112.002 177.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.424 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 67.5 mmtt -68.6 -35.33 77.18 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 121.054 -0.258 . . . . 74.41 111.433 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.9 mt -60.24 -34.31 73.51 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 122.333 -0.229 . . . . 61.04 110.523 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ARG . . . . . 0.502 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -61.75 -35.93 79.54 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.635 0.731 . . . . 63.11 110.264 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.1 m -78.69 -28.52 45.23 Favored 'General case' 0 N--CA 1.402 -2.856 0 C-N-CA 125.362 1.465 . . . . 73.41 113.055 -177.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.602 ' CD1' HG23 ' A' ' 72' ' ' THR . 61.4 m-85 -102.44 -45.8 4.97 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.75 1.019 . . . . 54.42 113.75 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.0 125.53 70.28 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 114.359 1.244 . . . . 74.34 114.359 -173.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.64 -0.3 5.83 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 122.555 2.17 . . . . 53.25 108.396 166.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 p -106.89 17.48 23.06 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 126.297 1.839 . . . . 52.35 109.902 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.24 92.07 0.04 OUTLIER 'General case' 0 N--CA 1.41 -2.459 0 CA-C-N 114.168 -1.378 . . . . 73.24 111.269 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -129.47 56.6 1.7 Allowed 'General case' 0 CA--C 1.484 -1.588 0 N-CA-C 102.811 -3.033 . . . . 72.1 102.811 169.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 pp -90.2 -18.4 25.8 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.484 -1.689 . . . . 52.25 110.051 -171.802 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.94 -19.88 64.19 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 114.729 -1.123 . . . . 55.33 109.833 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 49.2 t -100.85 107.78 19.4 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.504 -1.225 . . . . 74.33 107.762 177.55 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.4 m -133.28 117.39 17.31 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.677 0.751 . . . . 73.34 110.799 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.97 -15.04 62.98 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.5 -1.227 . . . . 73.13 114.028 -178.346 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -137.0 165.86 31.62 Favored Pre-proline 0 N--CA 1.382 -3.848 0 N-CA-C 107.423 -1.325 . . . . 64.42 107.423 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.67 -149.51 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.241 1.961 . . . . 73.43 110.737 175.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.2 m -76.2 37.9 0.17 Allowed 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.019 0.928 . . . . 61.13 112.61 -176.367 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.41 ' HB2' HG23 ' A' ' 57' ' ' VAL . 80.3 m-20 -63.69 153.01 84.96 Favored Pre-proline 0 N--CA 1.448 -0.562 0 C-N-CA 123.968 0.907 . . . . 74.12 112.196 -177.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.79 -44.56 43.98 Favored 'Trans proline' 0 C--N 1.363 1.301 0 C-N-CA 123.828 3.019 . . . . 65.31 113.341 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -73.92 -23.1 59.49 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 112.301 0.482 . . . . 71.44 112.301 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 91.6 t -75.59 -36.87 35.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.093 -1.077 . . . . 71.4 108.093 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 mm -64.53 -45.59 95.16 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.036 -1.098 . . . . 72.21 108.036 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -54.16 -42.7 69.89 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.011 0.924 . . . . 74.4 110.462 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.639 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 36.2 ttt180 -54.5 -49.11 70.93 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.583 1.553 . . . . 73.34 110.831 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 90.4 mt-30 -64.58 -48.71 73.96 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.298 -0.865 . . . . 74.23 111.173 -177.407 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.514 HD12 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -72.13 -30.55 65.17 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.86 -1.064 . . . . 64.14 111.546 -175.202 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -53.35 -50.5 64.9 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 124.382 1.073 . . . . 71.43 111.01 175.341 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -54.92 -32.28 61.05 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.007 -1.451 . . . . 62.43 112.831 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.7 mt -72.18 -43.46 64.51 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.559 -0.291 . . . . 52.13 111.019 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' PHE . . . . . 0.52 ' CE1' ' HG2' ' A' ' 70' ' ' MET . 78.1 t80 -68.04 -30.21 69.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.768 -0.827 . . . . 70.04 108.768 177.544 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.56 68.73 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.038 -0.983 . . . . 42.12 110.777 176.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.44 ' HB2' HG21 ' A' ' 72' ' ' THR . 10.3 mm-40 -70.93 -55.43 8.4 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 108.748 -0.834 . . . . 72.34 108.748 174.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.63 145.97 9.13 Favored Glycine 0 CA--C 1.476 -2.364 0 CA-C-N 115.147 -0.933 . . . . 64.25 112.016 -175.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.52 ' HG2' ' CE1' ' A' ' 66' ' ' PHE . 66.3 mtm -70.52 -27.97 64.58 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 105.51 -2.033 . . . . 72.12 105.51 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' ALA . . . . . 0.504 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . . . -74.13 -39.4 63.35 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.342 -1.754 . . . . 72.54 108.719 175.895 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.602 HG23 ' CD1' ' A' ' 40' ' ' PHE . 66.8 m -58.87 -42.05 88.53 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.693 -0.685 . . . . 75.11 109.286 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.532 ' HD1' HG23 ' A' ' 95' ' ' VAL . 70.4 t-105 -65.88 -40.51 91.65 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 116.307 -0.406 . . . . 70.44 111.556 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.713 ' CB ' HG21 ' A' ' 95' ' ' VAL . 14.7 ptpt -67.93 -41.89 81.86 Favored 'General case' 0 CA--C 1.506 -0.72 0 O-C-N 121.518 -0.739 . . . . 71.23 112.22 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.3 m -63.69 -37.15 86.27 Favored 'General case' 0 N--CA 1.406 -2.674 0 CA-C-N 115.332 -0.849 . . . . 73.51 110.171 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.41 -50.72 71.7 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.174 -0.921 . . . . 71.13 111.557 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.511 HG21 ' O ' ' A' ' 91' ' ' GLU . 47.3 mm -62.55 -32.12 54.29 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.407 0.622 . . . . 64.55 111.013 -176.046 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -57.61 -45.75 84.94 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.826 -1.079 . . . . 70.42 110.151 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 10.5 m-20 -78.19 -38.42 43.37 Favored 'General case' 0 C--O 1.21 -0.974 0 CA-C-N 116.407 -0.36 . . . . 72.54 111.408 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.559 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.2 tm? -50.07 -55.01 16.57 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 125.492 1.517 . . . . 74.22 110.552 -178.698 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' CYS . . . . . 0.434 ' SG ' ' HG3' ' A' ' 91' ' ' GLU . 51.3 m -67.83 -32.68 73.39 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.893 -0.594 . . . . 73.44 111.701 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -70.73 -51.51 26.82 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.61 -0.723 . . . . 73.32 111.163 -177.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 13.4 mt-10 -79.23 -17.43 54.8 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 112.98 0.733 . . . . 61.24 112.98 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.4 11.11 22.54 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.168 0.509 . . . . 54.43 111.431 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 69.62 -59.71 0.49 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.142 1.534 . . . . 53.24 115.142 172.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 31.1 m -70.29 132.53 87.87 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 112.343 0.497 . . . . 63.13 112.343 -175.635 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 86' ' ' VAL . 17.3 Cg_exo -68.11 109.4 1.95 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.468 2.112 . . . . 71.24 109.252 175.218 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.5 mt -79.75 -44.17 21.21 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 116.503 -0.317 . . . . 74.34 111.435 -174.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 26.0 t0 71.18 161.99 0.24 Allowed 'General case' 0 C--O 1.243 0.76 0 C-N-CA 125.259 1.424 . . . . 74.43 109.945 -175.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 65.86 23.22 11.36 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.572 -0.529 . . . . 53.01 109.572 -171.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.629 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 33.4 tt0 -56.28 -37.75 70.25 Favored 'General case' 0 C--O 1.21 -0.992 0 C-N-CA 125.641 1.576 . . . . 71.25 111.359 -177.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.553 ' HA ' HG12 ' A' ' 95' ' ' VAL . 38.5 mm -72.16 -48.78 10.18 Favored Pre-proline 0 C--N 1.274 -2.705 0 O-C-N 120.983 -1.073 . . . . 73.33 109.996 178.653 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.476 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 68.1 Cg_exo -51.35 -29.9 32.19 Favored 'Trans proline' 0 CA--C 1.563 1.928 0 C-N-CA 121.311 1.341 . . . . 73.22 111.844 166.085 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.629 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 9.2 mp -59.63 -36.5 76.47 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.835 -0.432 . . . . 62.25 109.835 171.666 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.713 HG21 ' CB ' ' A' ' 74' ' ' LYS . 3.7 p -85.88 -41.63 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-O 122.375 1.083 . . . . 54.34 113.246 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.2 m -71.4 7.17 1.45 Allowed 'General case' 0 C--N 1.246 -3.904 0 C-N-CA 125.189 1.396 . . . . 65.44 113.845 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 15.1 tt -73.34 -17.9 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 N-CA-C 114.193 1.183 . . . . 75.5 114.193 -172.389 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 96.0 m95 . . . . . 0 C--N 1.315 -0.915 0 N-CA-C 114.738 1.385 . . . . 74.4 114.738 -174.13 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 6' ' ' MET . . . . . 0.403 ' HG3' HD11 ' A' ' 92' ' ' ILE . 22.5 ttt . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 122.005 0.907 . . . . 63.21 109.698 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -91.29 25.83 2.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.267 -0.879 . . . . 71.43 109.926 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ALA . . . . . 0.423 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -76.7 -10.35 59.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.937 -1.029 . . . . 52.02 108.882 173.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . 0.615 ' OE2' ' HE2' ' A' ' 74' ' ' LYS . 6.1 pt-20 -58.64 -38.68 78.62 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.241 -0.891 . . . . 74.4 109.697 175.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 50.0 m -57.78 -26.73 62.33 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.226 1.41 . . . . 71.44 111.165 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ILE . . . . . 0.423 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -88.04 -27.59 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.471 -1.241 . . . . 74.21 110.66 -176.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -82.55 -66.82 0.84 Allowed 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.793 1.034 . . . . 73.11 113.793 -172.688 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 43.99 -172.19 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.508 1.67 . . . . 71.11 115.508 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.9 t30 40.19 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 126.679 1.992 . . . . 74.4 115.843 171.325 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -179.48 108.24 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.57 0.7 . . . . 75.24 110.356 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -71.98 -28.42 63.4 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 124.636 1.174 . . . . 61.45 112.526 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -58.6 -27.6 64.8 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.782 0.66 . . . . 63.32 112.782 -174.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.48 ' HB2' HD12 ' A' ' 97' ' ' ILE . 3.1 mm? -64.32 -36.3 83.68 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 121.099 -0.24 . . . . 73.44 110.519 176.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TRP . . . . . 0.514 ' HB2' HD11 ' A' ' 97' ' ' ILE . 74.7 t-105 -69.63 -49.58 52.54 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.128 -0.487 . . . . 75.44 110.219 -176.818 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.27 -39.75 91.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.136 -0.484 . . . . 61.12 110.813 179.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TRP . . . . . 0.502 ' HE1' ' HG ' ' A' ' 88' ' ' LEU . 13.6 t-105 -60.85 -50.32 73.89 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.202 -0.454 . . . . 74.25 110.306 176.084 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -57.63 -53.07 62.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 124.073 0.858 . . . . 70.34 109.418 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.1 t -58.41 -47.36 88.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.873 -0.603 . . . . 60.13 112.227 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.489 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 74.7 mtp180 -69.18 -44.42 72.22 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 112.163 0.431 . . . . 63.4 112.163 -176.732 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.476 HD12 HD13 ' A' ' 84' ' ' LEU . 1.8 tm? -67.57 -39.84 84.9 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.199 -0.667 . . . . 75.23 109.199 -176.316 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 4.7 mt -73.9 -25.1 59.83 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.165 -0.471 . . . . 75.41 112.233 177.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -67.02 -20.99 65.95 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.176 -1.046 . . . . 64.42 108.176 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 33.5 mtmt -91.79 -15.21 28.61 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.548 0.69 . . . . 62.34 109.716 177.629 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.447 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -129.84 51.86 8.28 Favored Pre-proline 0 C--O 1.241 0.647 0 CA-C-N 115.375 -0.829 . . . . 61.41 112.683 -175.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.447 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.8 Cg_exo -68.56 -20.66 40.88 Favored 'Trans proline' 0 C--N 1.365 1.416 0 N-CA-C 108.546 -1.367 . . . . 64.32 108.546 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -63.25 -43.21 98.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 113.187 -1.824 . . . . 75.32 109.549 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TRP . . . . . 0.458 ' HE1' ' HG3' ' A' ' 83' ' ' GLU . 67.8 t90 -76.02 -47.7 23.82 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 121.943 0.878 . . . . 65.54 110.419 176.419 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.488 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.3 tm? -58.89 -44.29 91.12 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.181 -1.372 . . . . 62.35 112.221 -172.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.7 p -52.76 -54.15 37.98 Favored 'General case' 0 C--N 1.316 -0.879 0 O-C-N 123.54 0.525 . . . . 64.22 111.67 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.24 -45.49 76.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.108 1.363 . . . . 72.41 111.703 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -64.6 -43.9 92.32 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 112.511 0.56 . . . . 74.52 112.511 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.578 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 77.2 mt -55.54 -39.68 70.87 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 123.382 0.426 . . . . 72.14 111.135 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -62.29 -26.23 68.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.387 0.613 . . . . 73.03 112.224 -178.38 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.6 t -83.52 -22.26 32.51 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.693 -0.685 . . . . 54.52 110.311 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' PHE . . . . . 0.458 ' CD1' HG23 ' A' ' 72' ' ' THR . 48.4 m-85 -98.05 -57.42 2.22 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.281 -0.418 . . . . 64.23 111.784 -178.095 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.561 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.4 mm? -85.34 113.19 49.14 Favored Pre-proline 0 N--CA 1.423 -1.778 0 N-CA-C 109.009 -0.737 . . . . 74.31 109.009 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.17 -33.38 72.56 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.276 2.651 . . . . 72.41 115.532 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.49 28.22 8.9 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 121.912 0.863 . . . . 61.2 112.525 -176.059 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' A' ' 37' ' ' LEU . 23.2 ttm -89.25 106.55 18.51 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 115.275 1.583 . . . . 75.24 115.275 -175.791 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -111.78 79.23 1.19 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.214 -2.143 . . . . 50.14 105.214 169.44 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.19 -2.0 57.96 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.145 -0.934 . . . . 41.44 111.727 -173.153 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -78.39 45.84 0.59 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 122.818 1.294 . . . . 73.0 112.678 -174.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -117.04 97.92 6.19 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 107.118 -1.438 . . . . 63.15 107.118 174.217 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.2 m -81.86 83.72 7.11 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-O 121.86 0.838 . . . . 74.12 112.053 -175.074 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.74 -33.55 58.11 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-O 122.529 1.157 . . . . 65.2 110.837 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -137.48 167.51 20.32 Favored Pre-proline 0 N--CA 1.384 -3.769 0 C-N-CA 126.695 1.998 . . . . 72.14 106.501 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -81.93 -148.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 122.001 1.801 . . . . 72.32 110.664 174.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.4 m -76.26 37.28 0.16 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 124.291 1.036 . . . . 73.22 111.776 -176.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASN . . . . . 0.483 ' HB2' HG23 ' A' ' 57' ' ' VAL . 76.5 m-20 -64.18 148.25 95.85 Favored Pre-proline 0 N--CA 1.44 -0.975 0 C-N-CA 123.605 0.762 . . . . 73.31 112.983 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -58.31 -35.12 99.04 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 123.479 2.786 . . . . 65.41 112.68 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -72.6 -31.27 65.05 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.171 0.51 . . . . 71.4 109.96 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.483 HG23 ' HB2' ' A' ' 54' ' ' ASN . 94.6 t -67.8 -52.03 44.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.347 -0.983 . . . . 73.41 108.347 177.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 47.1 mm -55.06 -43.45 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 114.478 -1.237 . . . . 72.31 109.849 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -58.71 -40.53 83.98 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.133 -0.94 . . . . 72.34 111.039 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.416 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 37.0 ttt180 -64.81 -37.55 88.01 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.681 0.753 . . . . 72.52 110.554 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.451 ' O ' ' HB2' ' A' ' 64' ' ' ARG . 94.5 mt-30 -72.66 -48.68 37.29 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 114.492 -1.231 . . . . 72.34 111.525 -176.648 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -67.36 -30.61 70.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 115.269 -0.878 . . . . 62.34 110.885 -178.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ASN . . . . . 0.416 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 50.9 t30 -54.06 -46.08 71.86 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.658 1.183 . . . . 74.23 110.222 174.61 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ARG . . . . . 0.561 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 26.1 mmt180 -56.39 -36.65 69.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 114.626 -1.17 . . . . 62.35 112.594 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LEU . . . . . 0.511 HD12 HD13 ' A' ' 62' ' ' LEU . 97.8 mt -71.04 -31.0 67.34 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.7 0.259 . . . . 62.12 111.7 -177.61 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -59.32 -35.74 74.37 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.055 -0.72 . . . . 74.2 109.055 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.82 -27.41 60.28 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 115.072 -0.967 . . . . 73.21 112.103 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.419 ' CB ' HG21 ' A' ' 72' ' ' THR . 5.1 mm-40 -70.66 -52.7 19.47 Favored 'General case' 0 N--CA 1.423 -1.778 0 C-N-CA 120.824 -0.35 . . . . 63.11 111.36 -179.131 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.42 143.75 5.32 Favored Glycine 0 CA--C 1.477 -2.319 0 C-N-CA 118.835 -1.65 . . . . 61.44 114.537 -173.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.418 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.2 ptm -67.38 -30.67 70.51 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.887 -1.523 . . . . 71.2 106.887 168.417 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.7 -37.37 59.54 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 114.36 -1.291 . . . . 40.43 108.538 177.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' THR . . . . . 0.458 HG23 ' CD1' ' A' ' 40' ' ' PHE . 86.6 m -62.19 -38.73 90.21 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 114.912 -1.04 . . . . 65.14 111.089 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' TRP . . . . . 0.518 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 39.8 t-105 -68.25 -36.06 78.86 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.491 -0.559 . . . . 71.15 109.491 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . 0.615 ' HE2' ' OE2' ' A' ' 9' ' ' GLU . 85.5 mttt -58.17 -52.27 66.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 120.763 0.316 . . . . 74.4 110.199 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -60.34 -38.48 83.91 Favored 'General case' 0 N--CA 1.405 -2.688 0 CA-C-N 115.433 -0.803 . . . . 72.21 111.136 179.147 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -61.14 -50.58 72.63 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-N 115.112 -0.949 . . . . 74.51 110.798 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ILE . . . . . 0.509 HG21 ' O ' ' A' ' 91' ' ' GLU . 46.5 mm -70.15 -30.89 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.627 -0.829 . . . . 53.03 110.573 -177.469 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.84 -47.47 82.59 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.376 -0.829 . . . . 74.31 109.874 176.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -73.28 -37.25 66.32 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.951 -0.568 . . . . 74.32 111.239 177.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LEU . . . . . 0.417 HD12 HD21 ' A' ' 88' ' ' LEU . 1.9 tm? -50.45 -54.27 23.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.846 1.259 . . . . 74.31 109.449 178.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.6 m -66.71 -44.4 81.76 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.687 -0.688 . . . . 65.13 111.347 -178.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -61.62 -54.24 45.59 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.291 0.567 . . . . 65.42 111.097 -175.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . 0.458 ' HG3' ' HE1' ' A' ' 32' ' ' TRP . 22.5 mm-40 -70.21 -40.62 74.43 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.173 -0.921 . . . . 74.41 113.485 -175.194 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.476 HD13 HD12 ' A' ' 25' ' ' LEU . 82.6 mt -80.32 -39.8 27.98 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 120.011 -0.676 . . . . 53.35 112.63 -174.638 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -169.2 -96.62 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.03 0.377 . . . . 65.13 110.821 179.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' VAL . . . . . 0.492 ' HB ' ' HD2' ' A' ' 87' ' ' PRO . 34.8 m -141.04 173.28 5.04 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 104.945 -2.243 . . . . 63.14 104.945 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.492 ' HD2' ' HB ' ' A' ' 86' ' ' VAL . 5.6 Cg_endo -50.89 105.48 0.1 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 121.859 1.706 . . . . 71.21 110.3 171.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LEU . . . . . 0.588 HD22 ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -50.39 -53.3 30.28 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 125.314 1.446 . . . . 74.32 111.227 -172.446 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -154.2 48.81 0.62 Allowed 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 104.344 -2.465 . . . . 50.11 104.344 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' MET . . . . . 0.518 ' O ' HD23 ' A' ' 94' ' ' LEU . 65.7 mtt 74.31 146.14 0.08 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.655 -2.066 . . . . 71.34 109.84 -170.529 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLU . . . . . 0.509 ' O ' HG21 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -71.73 -35.18 70.08 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.273 1.035 . . . . 73.41 110.817 178.107 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.684 ' HA ' HG12 ' A' ' 95' ' ' VAL . 31.3 mm -59.42 -49.8 90.58 Favored Pre-proline 0 C--N 1.279 -2.487 0 CA-C-N 114.353 -1.294 . . . . 74.33 114.043 -172.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' PRO . . . . . 0.407 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 74.8 Cg_exo -54.85 -35.46 88.78 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.211 1.941 . . . . 74.51 111.259 174.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 90' ' ' MET . 4.0 mm? -71.42 -33.6 69.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.845 -1.07 . . . . 63.42 110.916 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' VAL . . . . . 0.684 HG12 ' HA ' ' A' ' 92' ' ' ILE . 4.3 p -83.59 -33.63 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 C-N-CA 119.355 -0.938 . . . . 71.24 112.3 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.3 t -55.71 -26.39 44.98 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 113.768 -1.56 . . . . 54.14 112.068 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.514 HD11 ' HB2' ' A' ' 19' ' ' TRP . 12.0 tt -69.02 -30.38 46.45 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.096 0 CA-C-N 116.505 -0.316 . . . . 45.35 110.59 -177.683 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 16.7 t90 . . . . . 0 C--O 1.244 0.812 0 C-N-CA 127.265 2.226 . . . . 72.42 116.019 -177.172 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.513 0 N-CA-C 111.002 -0.839 . . . . 74.44 111.002 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.67 126.91 12.52 Favored 'Trans proline' 0 C--O 1.237 0.436 0 C-N-CA 122.909 2.406 . . . . 52.04 110.541 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 81.7 mt -115.27 123.18 48.12 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 109.611 -0.514 . . . . 71.01 109.611 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.73 -42.65 61.48 Favored Glycine 0 N--CA 1.44 -1.044 0 N-CA-C 109.891 -1.283 . . . . 52.41 109.891 177.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.8 p -119.84 177.56 4.92 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 108.548 -0.908 . . . . 42.15 108.548 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.41 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 42.8 tpp -115.33 9.77 15.72 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 122.065 0.936 . . . . 73.2 108.98 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -74.8 24.85 0.09 Allowed 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 114.338 1.236 . . . . 75.41 114.338 -174.511 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.429 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.2 -15.1 59.63 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 122.411 1.1 . . . . 51.51 109.588 178.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 96' ' ' SER . 1.1 pt-20 -65.35 -41.71 93.57 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 113.808 -1.542 . . . . 71.22 111.52 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.2 m -74.89 -17.23 60.61 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.448 -0.797 . . . . 70.43 109.857 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.429 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.9 mm -87.48 -50.67 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-O 122.138 0.971 . . . . 60.3 108.887 -176.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.3 mmt180 -84.72 6.7 23.2 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.911 -1.495 . . . . 72.13 113.148 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -44.14 122.53 2.96 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 124.902 1.281 . . . . 71.55 112.798 -177.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.407 ' OD1' ' HG ' ' A' ' 18' ' ' LEU . 28.0 t-20 -162.86 150.73 13.73 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 104.559 -2.385 . . . . 71.32 104.559 176.096 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . 0.28 21.8 p30 -145.72 -44.5 0.21 Allowed 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 115.562 1.69 . . . . 73.24 115.562 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.52 -46.32 90.47 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 119.201 0.91 . . . . 71.32 111.833 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -67.29 -44.23 79.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.985 -0.552 . . . . 74.03 109.832 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.407 ' HG ' ' OD1' ' A' ' 14' ' ' ASN . 89.5 mt -66.07 -39.54 90.16 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.375 -0.829 . . . . 73.32 111.58 -177.669 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 73.0 t-105 -65.42 -43.84 89.29 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 110.274 -0.269 . . . . 75.35 110.274 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.98 -44.36 96.25 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 120.863 0.363 . . . . 72.34 110.666 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 17.9 t-105 -60.45 -48.59 81.1 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.587 -0.733 . . . . 75.31 110.583 175.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.463 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 33.9 tp -58.4 -53.04 62.81 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.675 -0.693 . . . . 73.4 109.862 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -53.85 -46.09 63.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 123.528 0.731 . . . . 64.13 112.441 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.552 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 3.9 mmp_? -72.4 -43.39 63.97 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 120.18 -0.608 . . . . 72.53 112.396 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.426 HD12 HD13 ' A' ' 84' ' ' LEU . 2.1 tm? -68.21 -42.34 80.0 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.047 0.451 . . . . 62.32 109.81 -176.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 33' ' ' LEU . 1.2 mt -68.56 -25.75 65.06 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 122.854 0.461 . . . . 72.42 110.936 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.4 t -71.56 -18.53 62.24 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 108.99 -0.744 . . . . 75.32 108.99 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.552 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.32 -2.29 52.44 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 121.725 0.774 . . . . 74.44 109.489 178.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.428 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.4 m-80 -137.92 50.21 3.11 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.165 -0.925 . . . . 73.11 111.78 -177.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.428 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.2 Cg_exo -65.62 -23.98 56.13 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 121.604 1.536 . . . . 65.2 109.197 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -66.1 -39.58 90.09 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 112.997 -1.911 . . . . 71.13 111.095 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.803 ' HE3' HD22 ' A' ' 33' ' ' LEU . 84.4 t90 -76.06 -44.73 37.64 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.492 -1.299 . . . . 75.24 107.492 -175.157 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.803 HD22 ' HE3' ' A' ' 32' ' ' TRP . 3.5 mm? -53.4 -56.96 12.51 Favored 'General case' 0 N--CA 1.407 -2.601 0 CA-C-N 113.015 -1.902 . . . . 64.52 113.61 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.552 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 3.4 p -53.74 -44.64 70.11 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.927 0.767 . . . . 63.31 111.133 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.92 72.23 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.673 1.589 . . . . 41.12 111.22 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.51 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.1 mmmt -69.28 -35.79 76.41 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-N 115.956 -0.565 . . . . 72.51 111.691 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 97.2 mt -60.61 -30.97 70.18 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 123.09 0.244 . . . . 52.34 110.817 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 34' ' ' SER . 10.3 mtp180 -66.85 -26.75 67.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.328 0.585 . . . . 73.55 111.906 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -78.4 -38.01 42.65 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.716 -0.674 . . . . 74.52 109.434 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.493 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 86.5 m-85 -80.31 -59.47 2.69 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.676 -0.693 . . . . 75.0 111.404 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.1 mm? -89.33 110.89 42.04 Favored Pre-proline 0 N--CA 1.432 -1.35 0 N-CA-C 109.269 -0.641 . . . . 63.22 109.269 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -70.85 -19.65 30.64 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.218 1.945 . . . . 73.23 111.851 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 p -114.13 28.58 8.65 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.086 -0.961 . . . . 71.42 109.935 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.844 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -43.33 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.941 1.4 . . . . 64.02 112.351 -175.432 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.09 60.06 4.71 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-O 123.088 1.423 . . . . 71.24 108.368 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.844 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.4 pp -81.03 -9.78 59.79 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.23 -1.805 . . . . 71.44 110.799 -176.234 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.25 -14.16 60.14 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.743 -1.117 . . . . 64.35 110.218 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.4 t -85.87 103.79 14.94 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 115.348 -0.842 . . . . 51.52 108.861 178.469 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.1 t -142.13 81.56 1.76 Allowed 'General case' 0 N--CA 1.428 -1.563 0 N-CA-C 107.878 -1.156 . . . . 70.02 107.878 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -39.58 94.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.84 -1.073 . . . . 73.22 111.743 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.25 155.85 53.26 Favored Pre-proline 0 N--CA 1.383 -3.819 0 CA-C-N 113.346 -1.752 . . . . 61.11 106.918 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.16 -145.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.558 1.677 0 C-N-CA 124.013 3.142 . . . . 52.42 112.164 174.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.0 m -74.73 38.37 0.12 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 123.864 0.866 . . . . 62.41 113.28 -175.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 57' ' ' VAL . 4.5 m-20 -62.08 149.52 86.18 Favored Pre-proline 0 N--CA 1.435 -1.196 0 C-N-CA 124.417 1.087 . . . . 72.42 110.544 177.565 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.45 -46.83 24.85 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 123.613 2.876 . . . . 65.44 113.703 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -74.34 -23.77 59.08 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.866 0.691 . . . . 64.35 112.866 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.46 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 87.0 t -72.7 -39.51 60.39 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 N-CA-C 108.289 -1.004 . . . . 70.35 108.289 177.257 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.11 -48.01 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 108.136 -1.061 . . . . 72.14 108.136 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 23.5 t-160 -52.03 -43.12 63.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.93 0.892 . . . . 74.33 110.708 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.406 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 65.2 ttt-85 -54.73 -41.37 70.29 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.084 0.953 . . . . 61.44 111.897 178.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.8 mt-30 -73.31 -39.45 65.3 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 115.225 -0.898 . . . . 71.24 110.509 -175.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -75.29 -31.09 60.59 Favored 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 114.603 -1.18 . . . . 73.34 110.883 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 28.6 t-20 -53.89 -47.03 71.52 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.691 1.196 . . . . 73.22 110.602 175.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.5 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 32.2 mmt-85 -53.84 -36.62 62.76 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 113.659 -1.61 . . . . 74.21 111.888 178.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.3 mt -72.05 -36.68 69.67 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.95 0.405 . . . . 63.43 111.051 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.43 -25.21 66.64 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.392 -0.822 . . . . 75.3 109.086 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -31.27 59.91 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.431 -0.804 . . . . 72.15 110.832 176.271 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.28 -57.17 5.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-O 121.436 0.636 . . . . 70.42 109.869 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -172.55 141.66 6.37 Favored Glycine 0 CA--C 1.466 -2.987 0 CA-C-N 115.122 -0.944 . . . . 21.25 111.387 -174.143 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.488 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 1.9 mpt? -70.45 -30.67 67.57 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.318 -1.734 . . . . 74.4 106.318 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.93 -29.01 58.19 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 113.437 -1.71 . . . . 74.41 108.11 176.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.3 m -70.47 -34.03 71.94 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.241 -0.89 . . . . 62.34 109.421 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.581 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 69.7 t-105 -63.67 -46.89 83.51 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.198 -0.668 . . . . 63.5 109.198 175.182 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 70' ' ' MET . 82.8 mttt -58.56 -36.0 73.24 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 115.968 -0.56 . . . . 65.45 111.521 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.43 ' O ' ' HB3' ' A' ' 78' ' ' ASN . 49.0 m -72.7 -47.22 48.97 Favored 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 123.147 0.579 . . . . 65.4 110.953 177.732 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.493 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 81.4 t80 -55.79 -50.44 70.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 123.328 0.651 . . . . 55.51 111.73 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.637 HG21 ' HB2' ' A' ' 94' ' ' LEU . 41.0 mm -62.87 -30.75 50.26 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.944 -0.571 . . . . 72.15 111.19 -176.709 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.43 ' HB3' ' O ' ' A' ' 75' ' ' SER . 3.6 t-20 -58.86 -46.51 87.58 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 109.422 -0.584 . . . . 64.1 109.422 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -73.16 -39.65 65.48 Favored 'General case' 0 C--O 1.198 -1.646 0 CA-C-N 115.487 -0.778 . . . . 70.32 110.445 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.428 HD21 HD21 ' A' ' 26' ' ' LEU . 2.3 tm? -50.33 -53.87 25.72 Favored 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 124.776 1.23 . . . . 74.51 109.249 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.98 -36.53 84.69 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.893 -0.594 . . . . 55.31 111.266 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -73.36 -54.2 8.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.98 0.419 . . . . 64.02 111.658 -176.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -74.98 -24.02 58.37 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.641 -0.709 . . . . 73.54 112.298 -172.01 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.426 HD13 HD12 ' A' ' 25' ' ' LEU . 85.4 mt -91.22 4.51 52.1 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.31 -0.556 . . . . 74.2 112.014 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 72.12 -46.84 0.65 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 114.221 1.193 . . . . 50.05 114.221 174.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.453 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 47.3 t -56.88 126.68 73.04 Favored Pre-proline 0 C--N 1.315 -0.909 0 C-N-CA 124.488 1.115 . . . . 73.12 112.864 -175.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 86' ' ' VAL . 5.3 Cg_endo -86.75 102.09 0.58 Allowed 'Trans proline' 0 N--CA 1.44 -1.64 0 C-N-CA 122.466 2.111 . . . . 60.44 110.426 173.173 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 mp -69.81 -53.15 19.55 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.211 -0.449 . . . . 54.14 109.84 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.1 t70 173.96 -50.77 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.557 1.143 . . . . 63.4 107.968 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.9 ttt -177.47 153.12 0.88 Allowed 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 104.89 -2.263 . . . . 53.13 104.89 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.547 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.1 pm0 -71.46 -42.37 68.23 Favored 'General case' 0 C--O 1.206 -1.216 0 CA-C-N 118.696 0.68 . . . . 73.32 112.342 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.637 ' O ' HG22 ' A' ' 95' ' ' VAL . 35.1 mm -54.23 -39.39 74.22 Favored Pre-proline 0 CA--C 1.594 2.66 0 C-N-CA 125.486 1.514 . . . . 64.25 114.118 -175.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -52.3 -41.8 64.12 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 122.126 1.884 . . . . 72.14 111.035 170.503 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.637 ' HB2' HG21 ' A' ' 77' ' ' ILE . 3.7 mm? -76.29 -25.03 54.45 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.756 -1.111 . . . . 75.22 110.128 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.637 HG22 ' O ' ' A' ' 92' ' ' ILE . 4.6 m -74.62 -29.02 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-O 122.43 1.11 . . . . 63.04 110.789 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.478 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 6.0 t -81.76 1.18 35.73 Favored 'General case' 0 C--N 1.275 -2.631 0 CA-C-N 113.846 -1.524 . . . . 64.52 111.476 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 18.2 tt -57.38 -30.84 36.77 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 N-CA-C 112.981 0.734 . . . . 73.43 112.981 -173.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 24.5 p-90 -92.97 13.71 19.84 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.362 0.504 . . . . 74.31 112.362 -177.697 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -80.99 -127.84 0.82 Allowed Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 121.19 -0.529 . . . . 62.41 112.32 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.78 130.28 33.45 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 123.434 2.756 . . . . 70.22 112.527 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . 0.297 1.5 ptm180 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 125.754 1.622 . . . . 73.13 113.462 -177.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.411 ' O ' ' HG ' ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.486 -1.759 0 N-CA-C 108.109 -1.997 . . . . 15.03 108.109 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -56.22 99.35 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.952 2.435 . . . . 74.41 113.95 -174.777 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 1' ' ' GLY . 89.0 mt -115.64 -73.59 0.64 Allowed 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 108.003 -1.11 . . . . 64.52 108.003 178.248 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.74 -56.3 4.76 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 115.922 -0.581 . . . . 31.22 111.925 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.1 m -56.27 129.14 39.09 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 124.165 0.986 . . . . 73.53 110.625 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 64.9 mtt -75.54 -6.93 52.71 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 112.227 0.455 . . . . 74.34 112.227 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -104.24 23.5 12.99 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 120.919 0.39 . . . . 72.43 110.08 174.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.444 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.95 -17.58 57.04 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.812 1.292 . . . . 73.22 108.857 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.546 ' HB2' ' HB2' ' A' ' 96' ' ' SER . 0.8 OUTLIER -59.17 -45.65 90.44 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 113.178 -1.828 . . . . 74.51 114.088 -177.745 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 65.0 m -76.22 -16.49 59.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.311 0.577 . . . . 73.31 110.663 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.444 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.0 mm -82.47 -44.26 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 121.937 0.875 . . . . 64.31 108.938 -176.214 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -102.19 7.27 40.92 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.678 -1.146 . . . . 75.54 111.984 -175.287 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -35.21 122.31 0.58 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 126.279 1.831 . . . . 51.31 115.028 -172.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -145.2 151.6 38.67 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.479 -2.786 . . . . 74.22 103.479 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -128.7 -72.58 0.6 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 118.636 0.653 . . . . 72.43 112.244 -174.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.2 -38.21 90.26 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.32 0.859 . . . . 73.41 113.32 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -66.29 -37.84 86.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-O 121.886 0.85 . . . . 55.52 110.542 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.421 HD13 HD22 ' A' ' 94' ' ' LEU . 86.4 mt -75.32 -40.79 58.09 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.639 -1.164 . . . . 73.51 110.238 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 44.5 t-105 -64.39 -42.07 96.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 75.4 110.49 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.88 93.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.355 -0.384 . . . . 53.31 110.689 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -60.89 -50.55 72.95 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.685 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.82 -53.04 62.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.505 -0.77 . . . . 43.43 109.287 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.32 -42.4 95.29 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 115.583 -0.735 . . . . 72.12 112.774 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 20.4 tpt180 -72.62 -41.68 65.28 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 121.93 -0.482 . . . . 74.21 111.411 -177.691 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.572 HD12 HD13 ' A' ' 84' ' ' LEU . 2.0 tm? -69.78 -40.89 75.78 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.601 -0.518 . . . . 74.42 109.601 -176.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.491 HD13 HD23 ' A' ' 33' ' ' LEU . 5.9 mt -69.36 -25.13 64.03 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 112.398 0.518 . . . . 54.31 112.398 176.738 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -67.58 -19.67 65.28 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.677 -0.86 . . . . 52.33 108.677 175.784 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 35.3 mtmt -99.03 -2.1 38.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.635 -0.712 . . . . 65.24 109.491 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.418 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.2 m-80 -145.49 52.85 1.7 Allowed Pre-proline 0 C--O 1.243 0.74 0 N-CA-C 112.717 0.636 . . . . 73.24 112.717 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 15.8 Cg_exo -68.16 -22.83 40.2 Favored 'Trans proline' 0 C--N 1.356 0.926 0 N-CA-C 108.864 -1.245 . . . . 54.31 108.864 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.64 -43.63 88.85 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 113.477 -1.692 . . . . 63.12 110.583 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.593 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.4 t90 -71.6 -43.18 66.71 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 108.832 -0.803 . . . . 75.44 108.832 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.632 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.6 tm? -58.28 -44.81 88.64 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 114.395 -1.275 . . . . 75.12 109.053 -176.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.514 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.0 m -60.17 -48.54 81.31 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.358 -0.383 . . . . 75.33 111.249 176.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -39.6 70.65 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.742 0.817 . . . . 64.24 111.785 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.0 mmmt -75.57 -35.95 60.51 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 121.048 -0.261 . . . . 62.25 111.217 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 66.3 mt -58.76 -30.34 67.44 Favored 'General case' 0 C--O 1.203 -1.392 0 N-CA-C 110.466 -0.198 . . . . 63.04 110.466 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 34' ' ' SER . 88.5 mtt180 -58.55 -26.56 63.69 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 123.259 0.35 . . . . 60.54 111.624 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.3 t -88.42 -50.15 6.49 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 109.641 -0.503 . . . . 73.21 109.641 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.444 ' CD1' HG23 ' A' ' 72' ' ' THR . 75.5 m-85 -70.05 -46.06 65.77 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.476 0.917 . . . . 73.34 113.476 -175.388 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.538 HD23 ' H ' ' A' ' 45' ' ' ASP . 9.3 mp -87.7 113.47 54.57 Favored Pre-proline 0 C--N 1.312 -1.062 0 C-N-CA 123.993 0.917 . . . . 73.0 110.056 -178.154 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 41' ' ' LEU . 30.0 Cg_endo -61.81 -29.9 83.61 Favored 'Trans proline' 0 N--CA 1.482 0.813 0 C-N-CA 123.712 2.941 . . . . 64.33 114.155 -174.615 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.1 p -112.55 7.04 18.76 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.39 0.614 . . . . 61.22 110.308 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.417 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 26.5 mtt 41.7 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 127.312 2.245 . . . . 63.34 112.188 -172.799 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.538 ' H ' HD23 ' A' ' 41' ' ' LEU . 35.3 t70 -98.11 59.54 1.39 Allowed 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.406 -1.331 . . . . 73.42 107.406 176.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -96.34 -11.47 25.79 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.657 -1.611 . . . . 72.34 111.78 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -80.45 37.61 0.4 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 124.436 1.094 . . . . 73.1 111.87 -175.158 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.6 m -91.85 -0.34 57.51 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.804 -0.635 . . . . 72.44 111.495 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 72.7 m -91.44 64.65 5.11 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.454 0.645 . . . . 73.02 112.23 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.413 ' HD1' ' HG3' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -82.41 -32.47 29.08 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 122.67 1.224 . . . . 73.44 109.557 173.5 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 44.6 mt-10 -93.76 172.8 5.4 Favored Pre-proline 0 C--N 1.264 -3.126 0 CA-C-N 112.487 -2.142 . . . . 53.11 106.574 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 39.8 Cg_endo -66.45 -169.87 0.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 121.27 1.314 . . . . 62.24 111.85 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.0 m -78.18 38.55 0.29 Allowed 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 123.488 0.715 . . . . 64.05 112.248 -175.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.615 ' HB2' HG23 ' A' ' 57' ' ' VAL . 96.1 m-20 -57.65 149.72 50.37 Favored Pre-proline 0 N--CA 1.438 -1.067 0 C-N-CA 123.984 0.914 . . . . 73.44 111.931 -177.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -44.79 -51.86 6.85 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 124.144 3.23 . . . . 72.33 113.011 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -73.22 -26.27 61.07 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 113.416 0.895 . . . . 53.22 113.416 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.615 HG23 ' HB2' ' A' ' 54' ' ' ASN . 72.2 t -65.65 -38.64 82.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 108.575 -0.898 . . . . 71.5 108.575 175.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.9 mm -70.53 -50.21 46.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 115.478 -0.783 . . . . 74.5 109.812 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -52.73 -39.99 62.64 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.241 1.017 . . . . 74.35 110.953 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -57.57 -40.62 79.35 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 125.079 1.352 . . . . 63.44 111.856 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 58.9 mt-30 -76.12 -39.46 55.1 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.657 -0.702 . . . . 75.01 110.602 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.46 -30.66 71.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 114.933 -1.031 . . . . 63.41 111.26 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.423 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 47.4 t30 -55.58 -34.37 64.74 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.834 1.254 . . . . 73.31 111.165 177.768 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -63.32 -30.16 71.34 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.644 -0.707 . . . . 74.34 111.969 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.0 mt -73.09 -31.89 64.64 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.086 0.469 . . . . 73.23 110.212 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.495 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 70.9 t80 -61.92 -29.83 70.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.294 -0.866 . . . . 73.55 109.117 177.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.21 -21.52 36.37 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 114.868 -1.06 . . . . 74.0 111.781 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -82.37 -47.18 12.62 Favored 'General case' 0 N--CA 1.419 -2.021 0 O-C-N 122.148 -0.345 . . . . 72.35 111.389 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.66 142.86 4.2 Favored Glycine 0 CA--C 1.473 -2.586 0 C-N-CA 120.275 -0.964 . . . . 62.45 112.56 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.548 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.64 -31.18 68.03 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 106.95 -1.5 . . . . 70.2 106.95 170.492 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.5 64.05 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.595 -1.184 . . . . 60.23 108.264 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.444 HG23 ' CD1' ' A' ' 40' ' ' PHE . 96.1 m -58.1 -40.61 81.6 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.084 -0.962 . . . . 54.22 110.217 176.226 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.446 ' HE1' HG22 ' A' ' 97' ' ' ILE . 65.4 t-105 -61.65 -46.89 87.85 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.97 -0.559 . . . . 73.04 109.906 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 70' ' ' MET . 34.7 mtmt -60.79 -42.79 98.25 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.549 -0.296 . . . . 72.4 111.359 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.4 m -66.06 -42.24 89.74 Favored 'General case' 0 N--CA 1.412 -2.36 0 C-N-CA 123.04 0.536 . . . . 74.24 111.128 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.429 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 79.0 t80 -61.49 -51.25 69.42 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.518 -0.765 . . . . 74.01 111.574 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.553 HG21 ' HB2' ' A' ' 94' ' ' LEU . 41.9 mm -61.7 -33.28 56.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.303 -0.408 . . . . 72.43 111.878 -175.895 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.57 -45.2 94.0 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.127 -0.694 . . . . 74.02 109.127 176.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.443 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 85.2 m-20 -68.1 -40.15 82.66 Favored 'General case' 0 C--O 1.195 -1.808 0 CA-C-N 115.475 -0.784 . . . . 75.54 110.704 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.497 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 1.5 tm? -50.04 -51.4 42.61 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.039 1.336 . . . . 74.41 108.894 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 72.8 m -67.39 -36.9 82.24 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.95 -1.023 . . . . 53.32 112.187 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -76.59 -40.1 50.54 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 123.398 0.679 . . . . 75.51 112.209 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 38.8 mt-10 -85.75 -29.25 24.01 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.773 1.027 . . . . 71.21 113.773 -172.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.572 HD13 HD12 ' A' ' 25' ' ' LEU . 95.8 mt -90.81 -28.26 18.33 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 113.706 1.002 . . . . 63.43 113.706 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -148.34 -169.58 3.38 Favored 'General case' 0 C--N 1.283 -2.284 0 N-CA-C 104.602 -2.37 . . . . 75.1 104.602 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.0 m -82.17 134.17 49.58 Favored Pre-proline 0 C--N 1.283 -2.284 0 N-CA-C 107.421 -1.326 . . . . 71.3 107.421 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -22.93 100.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 1 C-N-CA 126.096 4.53 . . . . 71.05 114.171 -174.619 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.8 mt -64.16 -34.26 77.66 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 115.257 -0.883 . . . . 74.33 110.48 -176.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.3 t70 58.19 37.13 26.22 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 123.126 1.441 . . . . 74.25 110.889 173.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -143.46 32.35 1.32 Allowed 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.712 -1.588 . . . . 73.21 106.712 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.584 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -70.69 -39.76 73.3 Favored 'General case' 0 C--O 1.192 -1.938 0 CA-C-N 114.38 -1.282 . . . . 73.44 112.971 -174.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.537 ' O ' HG22 ' A' ' 95' ' ' VAL . 44.5 mm -55.74 -45.73 99.84 Favored Pre-proline 0 CA--C 1.574 1.886 0 C-N-CA 123.783 0.833 . . . . 72.15 112.107 -175.396 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -50.95 -37.53 56.53 Favored 'Trans proline' 0 CA--C 1.555 1.573 0 C-N-CA 121.921 1.747 . . . . 64.32 111.566 171.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.553 ' HB2' HG21 ' A' ' 77' ' ' ILE . 4.3 mm? -76.68 -31.69 57.43 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.838 -0.619 . . . . 73.41 110.911 176.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.584 HG13 ' O ' ' A' ' 91' ' ' GLU . 6.5 m -66.54 -29.47 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.301 0 CA-C-O 122.566 1.174 . . . . 73.1 110.815 -177.484 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.546 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 31.3 t -75.47 -16.23 60.34 Favored 'General case' 0 C--N 1.27 -2.88 0 CA-C-N 113.379 -1.737 . . . . 72.32 113.077 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.459 HG22 ' O ' ' A' ' 94' ' ' LEU . 10.7 tt -72.38 -5.28 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 CA-C-O 121.362 0.601 . . . . 72.02 111.617 -172.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.495 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 47.2 t90 -51.68 -47.64 63.77 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 125.166 1.386 . . . . 71.03 110.4 -179.006 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -161.05 175.74 37.68 Favored Glycine 0 N--CA 1.425 -2.034 0 N-CA-C 109.528 -1.429 . . . . 61.42 109.528 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.41 101.51 1.33 Allowed 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.296 1.997 . . . . 74.23 110.543 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 . . . . . 0 N--CA 1.411 -2.408 0 N-CA-C 108.597 -0.89 . . . . 74.02 108.597 179.898 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.84 0 N-CA-C 110.777 -0.929 . . . . 64.14 110.777 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.7 108.75 1.5 Allowed 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.365 2.043 . . . . 71.32 111.332 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.9 mt 70.97 160.5 0.22 Allowed 'General case' 0 C--O 1.249 1.069 0 C-N-CA 125.32 1.448 . . . . 75.13 112.42 178.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.95 89.07 1.49 Allowed Glycine 0 CA--C 1.486 -1.763 0 N-CA-C 110.039 -1.224 . . . . 54.13 110.039 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.1 m 66.69 96.96 0.05 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.058 0.943 . . . . 62.01 108.905 -174.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.1 ttt -85.91 59.81 5.86 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 123.511 1.624 . . . . 73.11 111.067 -174.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.521 ' O ' HD13 ' A' ' 11' ' ' ILE . 10.2 m-20 -141.82 24.25 2.04 Favored 'General case' 0 C--N 1.273 -2.75 0 CA-C-N 111.596 -2.547 . . . . 62.44 106.099 173.294 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HG2' ' A' ' 12' ' ' ARG . . . -74.41 -34.75 63.34 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-N 113.852 -1.522 . . . . 74.1 107.641 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.558 ' HB3' HG23 ' A' ' 92' ' ' ILE . 1.7 pm0 -51.47 -45.35 62.72 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 113.68 -1.6 . . . . 74.14 112.093 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.4 m -56.62 -40.6 75.66 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.362 1.065 . . . . 71.34 111.051 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.521 HD13 ' O ' ' A' ' 7' ' ' ASP . 1.2 mp -83.92 -43.21 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.024 0 CA-C-N 113.958 -1.474 . . . . 73.22 111.022 -175.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.472 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 35.9 mmt180 -69.1 -65.52 0.7 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 116.032 1.864 . . . . 74.3 116.032 -170.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.549 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 2.5 tm? -176.45 141.1 0.39 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.114 0.87 . . . . 61.54 110.991 -172.232 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.46 ' N ' HD13 ' A' ' 13' ' ' LEU . 6.7 p30 -153.65 138.0 16.67 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 106.593 -1.632 . . . . 54.3 106.593 168.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -152.63 153.13 32.72 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.379 -0.528 . . . . 70.22 110.581 -175.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.4 -30.56 71.29 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.112 0.965 . . . . 72.32 112.073 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -65.7 -26.03 67.58 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.142 0.496 . . . . 74.14 111.692 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.81 -35.61 64.9 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.782 -0.821 . . . . 71.54 108.782 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.473 ' HB2' ' CD1' ' A' ' 97' ' ' ILE . 77.0 t-105 -65.38 -45.38 84.28 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.423 -0.808 . . . . 73.24 109.086 177.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.68 87.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 72.22 110.992 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -59.93 -50.83 72.22 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.848 0.717 . . . . 73.01 110.715 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.14 -51.43 70.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.514 -0.767 . . . . 72.15 110.075 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.2 t -60.14 -42.8 91.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.514 -0.767 . . . . 71.25 112.018 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.513 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -69.45 -45.89 67.99 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.322 -0.622 . . . . 72.44 109.322 -176.432 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.413 ' CD1' HD13 ' A' ' 84' ' ' LEU . 2.2 tm? -65.93 -42.32 90.24 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.534 -0.543 . . . . 55.43 109.534 -177.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.644 HD13 HD23 ' A' ' 33' ' ' LEU . 7.6 mt -72.5 -25.49 61.42 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 112.942 0.719 . . . . 62.35 112.942 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 42.6 t -68.03 -20.14 64.96 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.336 -0.987 . . . . 65.22 108.336 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.2 mtmt -92.78 -7.22 47.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.666 -0.697 . . . . 75.31 109.955 177.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.425 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 43.7 m-80 -136.74 54.13 8.43 Favored Pre-proline 0 C--O 1.243 0.724 0 CA-C-N 115.986 -0.552 . . . . 55.53 112.162 -174.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.425 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.4 Cg_exo -68.84 -23.71 34.95 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.309 1.339 . . . . 63.21 109.081 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.7 -44.61 95.78 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 113.93 -1.486 . . . . 75.23 109.637 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.612 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.4 t90 -74.57 -45.13 47.38 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 121.453 0.644 . . . . 74.35 109.967 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.644 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -60.21 -45.31 93.61 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.738 -1.119 . . . . 63.42 110.687 -174.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.485 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.7 m -57.39 -46.53 83.34 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 123.236 0.335 . . . . 51.22 111.19 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.94 -40.54 80.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.287 1.035 . . . . 62.12 111.573 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.612 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.6 mmmt -73.94 -29.96 62.3 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 120.822 -0.351 . . . . 74.31 111.876 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.2 mt -62.66 -30.27 71.25 Favored 'General case' 0 C--O 1.2 -1.552 0 N-CA-C 109.71 -0.478 . . . . 74.33 109.71 173.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 34' ' ' SER . 70.8 mtt180 -62.87 -31.13 72.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.947 0.403 . . . . 74.14 111.395 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 t -85.28 -39.04 18.17 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.34 0.591 . . . . 75.22 110.826 -179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.6 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.0 m-85 -84.65 -46.45 11.49 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.175 0.806 . . . . 74.41 113.175 -176.464 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 mp -89.74 119.43 69.46 Favored Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 123.328 0.651 . . . . 65.12 110.489 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.51 -41.49 19.81 Favored 'Trans proline' 0 C--N 1.324 -0.714 0 C-N-CA 122.218 1.945 . . . . 72.33 110.872 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.0 t -86.5 -8.92 57.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.494 -0.775 . . . . 60.54 112.594 -176.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.445 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 12.4 mtt 28.75 91.5 0.01 OUTLIER 'General case' 0 C--O 1.236 0.395 0 C-N-CA 126.632 1.973 . . . . 65.22 112.89 -173.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -99.65 61.62 1.16 Allowed 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 123.263 1.506 . . . . 51.13 110.309 177.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 pp -89.19 -19.64 25.19 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 113.157 -1.838 . . . . 72.45 110.494 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.55 5.39 50.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.305 1.05 . . . . 74.32 108.809 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 41.9 t -85.7 21.8 1.77 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.965 -1.016 . . . . 60.23 109.354 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.6 m -73.14 94.04 1.89 Allowed 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 122.03 0.919 . . . . 73.23 108.899 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -20.45 62.2 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.405 -1.271 . . . . 72.34 113.149 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.534 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 37.9 mt-10 -137.04 170.39 10.89 Favored Pre-proline 0 N--CA 1.38 -3.942 0 N-CA-C 107.307 -1.368 . . . . 75.31 107.307 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.04 -151.43 0.01 OUTLIER 'Trans proline' 0 CA--C 1.562 1.894 0 C-N-CA 123.605 2.87 . . . . 54.33 112.962 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.6 p -75.33 37.18 0.13 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.004 0.922 . . . . 65.22 112.663 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.414 ' O ' HG12 ' A' ' 58' ' ' ILE . 78.5 m-20 -71.65 148.69 92.9 Favored Pre-proline 0 N--CA 1.431 -1.399 0 C-N-CA 123.987 0.915 . . . . 74.23 112.591 -176.45 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -59.88 -34.26 95.53 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.296 2.664 . . . . 73.34 113.132 -177.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -75.19 -23.82 57.73 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.35 0.595 . . . . 73.13 110.996 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.534 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 95.7 t -74.01 -45.26 49.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 108.047 -1.094 . . . . 54.23 108.047 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 54' ' ' ASN . 47.5 mm -58.67 -37.64 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 114.227 -1.351 . . . . 74.1 109.787 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -54.38 -43.74 71.66 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.712 -0.676 . . . . 73.35 111.6 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.52 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 2.0 tpp180 -54.9 -54.46 42.28 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.968 0.907 . . . . 74.41 110.791 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -59.46 -42.59 92.35 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.296 -1.32 . . . . 72.53 111.79 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.452 HD12 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -79.64 -30.85 41.45 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.418 -0.81 . . . . 71.43 111.535 -177.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.52 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 22.7 t-20 -53.42 -48.25 68.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 124.896 1.278 . . . . 71.12 110.177 174.105 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -55.07 -30.91 60.63 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 113.549 -1.66 . . . . 73.35 112.978 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.1 mt -72.16 -42.47 65.89 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 120.526 0.203 . . . . 71.44 111.283 -178.356 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.582 ' CD1' ' HB3' ' A' ' 98' ' ' TRP . 55.5 t80 -71.32 -24.95 62.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.638 0.732 . . . . 73.32 109.028 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -28.38 64.58 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.159 -0.928 . . . . 71.14 109.875 175.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.557 ' HB2' HG21 ' A' ' 72' ' ' THR . 37.3 mm-40 -74.79 -56.77 4.43 Favored 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 108.217 -1.031 . . . . 71.34 108.217 173.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -168.97 145.84 9.79 Favored Glycine 0 CA--C 1.479 -2.187 0 CA-C-N 115.495 -0.775 . . . . 53.23 112.147 -175.308 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.584 ' SD ' ' HD3' ' A' ' 100' ' ' PRO . 56.7 ttp -68.8 -32.27 71.88 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 105.606 -1.998 . . . . 74.23 105.606 170.198 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.7 68.32 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.623 -1.626 . . . . 72.22 108.3 176.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.6 HG23 ' CD1' ' A' ' 40' ' ' PHE . 96.8 m -57.36 -40.76 78.78 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.577 -0.738 . . . . 61.23 110.167 175.472 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.476 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.5 t-105 -61.51 -50.62 71.97 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 110.35 -0.241 . . . . 72.31 110.35 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 70' ' ' MET . 80.6 mttt -55.38 -45.14 76.58 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.111 0.482 . . . . 74.13 111.151 178.308 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.2 m -66.97 -40.58 87.51 Favored 'General case' 0 N--CA 1.406 -2.658 0 C-N-CA 123.845 0.858 . . . . 73.12 111.495 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.444 ' HZ ' ' CD2' ' A' ' 33' ' ' LEU . 81.9 t80 -61.26 -47.77 84.51 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.876 -0.602 . . . . 75.44 110.903 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 73' ' ' TRP . 49.6 mm -62.7 -33.47 60.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 CA-C-O 121.311 0.577 . . . . 62.33 110.055 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 44.2 t-20 -63.41 -39.27 94.06 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.376 -0.829 . . . . 63.33 109.184 176.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -75.33 -42.97 53.14 Favored 'General case' 0 C--O 1.194 -1.817 0 N-CA-C 110.252 -0.277 . . . . 74.34 110.252 178.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.404 HD21 HD21 ' A' ' 26' ' ' LEU . 1.5 tm? -49.86 -53.97 22.39 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 125.495 1.518 . . . . 72.33 109.212 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.466 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 52.7 t -63.31 -35.7 81.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.456 -0.793 . . . . 75.44 111.321 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -76.2 -54.6 6.56 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.183 0.516 . . . . 73.34 111.335 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -71.05 -39.31 72.33 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.539 -0.755 . . . . 64.43 112.627 -172.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.413 HD13 ' CD1' ' A' ' 25' ' ' LEU . 96.4 mt -82.58 -8.4 59.61 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.397 -0.521 . . . . 64.32 109.912 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 t70 49.86 68.66 0.71 Allowed 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 125.503 1.521 . . . . 60.23 112.86 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.31 116.86 10.32 Favored Pre-proline 0 C--N 1.296 -1.754 0 N-CA-C 105.967 -1.864 . . . . 65.04 105.967 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -69.49 103.74 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 121.768 1.645 . . . . 75.31 109.638 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.466 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 44.1 mt -81.18 -46.98 14.05 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 120.715 -0.394 . . . . 74.22 110.815 -175.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t70 70.13 -45.14 0.58 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 124.756 1.223 . . . . 74.41 110.961 -173.174 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 25.7 mmt -87.95 40.38 0.94 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 124.453 1.101 . . . . 64.1 110.096 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.641 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -69.19 -46.32 67.74 Favored 'General case' 0 C--O 1.191 -2.006 0 C-N-CA 120.437 -0.505 . . . . 75.12 111.356 -177.144 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.558 HG23 ' HB3' ' A' ' 9' ' ' GLU . 33.2 mm -64.49 -43.37 71.2 Favored Pre-proline 0 CA--C 1.567 1.6 0 C-N-CA 124.202 1.001 . . . . 73.11 109.632 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.549 ' HA ' ' O ' ' A' ' 13' ' ' LEU . 65.0 Cg_exo -50.22 -37.16 48.66 Favored 'Trans proline' 0 CA--C 1.565 2.03 0 C-N-CA 121.346 1.364 . . . . 62.54 112.167 167.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.448 ' O ' HG22 ' A' ' 97' ' ' ILE . 3.8 mm? -70.82 -40.46 72.46 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.589 -0.278 . . . . 70.23 110.479 173.048 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.641 HG13 ' O ' ' A' ' 91' ' ' GLU . 4.4 m -65.1 -33.93 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 CA-C-O 122.629 1.204 . . . . 75.04 110.562 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.463 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 23.0 t -64.27 -19.8 65.64 Favored 'General case' 0 C--N 1.28 -2.417 0 CA-C-N 113.467 -1.697 . . . . 44.22 112.701 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.473 ' CD1' ' HB2' ' A' ' 19' ' ' TRP . 13.5 tt -68.24 -26.78 34.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 C-N-CA 120.169 -0.612 . . . . 52.2 111.043 -174.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.582 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . 57.5 m95 -118.84 90.14 3.27 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-O 121.796 0.808 . . . . 73.41 110.854 175.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -157.06 -164.16 13.29 Favored Glycine 0 N--CA 1.421 -2.323 0 N-CA-C 109.764 -1.334 . . . . 64.53 109.764 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.584 ' HD3' ' SD ' ' A' ' 70' ' ' MET . 2.9 Cg_endo -82.37 36.78 0.63 Allowed 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.642 2.895 . . . . 65.52 112.92 -178.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . 0.282 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.771 0 C-N-CA 125.172 1.389 . . . . 71.13 114.554 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.697 0 N-CA-C 110.623 -0.991 . . . . 71.23 110.623 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.16 119.34 6.33 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.484 2.123 . . . . 72.43 111.164 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.2 tp -95.37 112.35 24.08 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 120.925 0.393 . . . . 71.15 109.995 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -140.21 168.85 24.98 Favored Glycine 0 N--CA 1.427 -1.942 0 N-CA-C 110.466 -1.054 . . . . 71.13 110.466 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.0 m 64.29 97.48 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.257 1.023 . . . . 54.35 112.069 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.8 tpp -76.71 -10.87 59.69 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-O 122.021 0.915 . . . . 73.43 110.326 -177.35 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -110.99 24.81 12.47 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.034 -0.985 . . . . 73.41 110.203 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.498 ' HA ' HD13 ' A' ' 11' ' ' ILE . . . -75.79 -12.7 60.23 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.772 1.272 . . . . 72.33 109.128 175.627 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.35 71.42 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 113.191 -1.822 . . . . 72.42 112.347 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 60.0 m -59.29 -47.46 85.3 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 122.464 1.126 . . . . 63.44 110.184 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.546 ' H ' HD12 ' A' ' 11' ' ' ILE . 4.2 mp -72.84 -42.08 61.02 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.237 0 CA-C-N 114.177 -1.374 . . . . 64.33 112.426 -175.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -76.69 -34.07 58.21 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.123 0.416 . . . . 73.43 112.123 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.2 mt 67.05 171.72 0.26 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.975 1.31 . . . . 72.5 113.595 -175.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -89.23 170.19 10.81 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.568 -0.742 . . . . 73.11 110.079 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.401 ' OD1' ' HB2' ' A' ' 17' ' ' ASN . 22.0 t-20 -159.26 133.59 7.75 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.082 -0.34 . . . . 74.52 110.082 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.49 -32.68 71.71 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.028 0.751 . . . . 74.11 113.028 -176.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . 0.401 ' HB2' ' OD1' ' A' ' 15' ' ' ASN . 89.5 m-20 -64.05 -35.45 80.77 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.499 -0.556 . . . . 75.23 109.499 177.84 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.71 -36.12 81.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 41.24 110.226 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -65.45 -45.51 83.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 71.55 110.089 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.66 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 74.4 110.329 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.407 ' CZ2' HD23 ' A' ' 88' ' ' LEU . 2.6 t-105 -56.96 -50.18 73.42 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.674 -0.694 . . . . 72.5 110.2 174.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -53.15 61.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 124.191 0.932 . . . . 73.13 109.307 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.4 t -55.57 -51.61 56.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 111.922 0.341 . . . . 64.21 111.922 -178.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -71.97 -34.18 68.74 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 112.483 0.549 . . . . 74.45 112.483 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.431 HD22 ' HE2' ' A' ' 28' ' ' LYS . 1.9 tm? -73.79 -46.47 45.27 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.048 -1.093 . . . . 54.1 108.048 -176.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.466 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -65.95 -25.18 67.0 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 123.905 0.882 . . . . 72.33 110.439 -179.207 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.1 m -64.2 -17.61 63.71 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.224 0.535 . . . . 72.24 110.246 174.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.452 ' C ' ' HD3' ' A' ' 30' ' ' PRO . 30.1 mtmt -100.78 0.97 39.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.227 -0.657 . . . . 74.32 109.227 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.466 ' OD1' ' HA ' ' A' ' 26' ' ' LEU . 5.2 m120 -125.19 45.75 1.47 Allowed Pre-proline 0 CA--C 1.547 0.855 0 CA-C-N 115.629 -0.714 . . . . 70.32 110.315 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.452 ' HD3' ' C ' ' A' ' 28' ' ' LYS . 2.8 Cg_endo -71.3 -20.61 27.71 Favored 'Trans proline' 0 C--N 1.355 0.89 0 CA-C-N 121.321 1.508 . . . . 55.43 110.484 -173.465 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -75.83 -42.53 49.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.264 -1.335 . . . . 74.52 109.247 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.6 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.8 t90 -75.96 -47.75 23.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.735 -0.666 . . . . 65.34 111.1 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.505 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -56.71 -49.23 75.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.81 -1.087 . . . . 74.51 111.064 -173.61 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.634 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.5 p -54.44 -49.11 70.79 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 123.56 0.537 . . . . 75.22 111.522 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.47 -45.88 66.3 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.837 1.255 . . . . 71.25 112.501 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.6 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.8 mmmt -71.1 -30.25 66.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.567 0.222 . . . . 60.5 110.595 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.511 HD11 ' HB3' ' A' ' 61' ' ' GLN . 87.4 mt -66.91 -35.62 80.41 Favored 'General case' 0 C--O 1.202 -1.437 0 N-CA-C 109.776 -0.453 . . . . 61.01 109.776 174.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.634 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -60.45 -33.77 73.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.977 0.894 . . . . 64.14 109.825 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.437 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 59.6 m -74.32 -50.69 17.77 Favored 'General case' 0 N--CA 1.394 -3.267 0 C-N-CA 125.222 1.409 . . . . 51.33 112.626 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.564 ' CD1' HG23 ' A' ' 72' ' ' THR . 51.9 m-85 -78.43 -44.78 23.87 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.604 0.964 . . . . 71.42 113.604 -177.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 44' ' ' MET . 7.9 mp -85.69 129.03 56.34 Favored Pre-proline 0 C--N 1.301 -1.518 0 C-N-CA 123.578 0.751 . . . . 74.14 112.157 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 41' ' ' LEU . 10.0 Cg_endo -93.18 -16.15 0.83 Allowed 'Trans proline' 0 CA--C 1.556 1.606 0 C-N-CA 122.372 2.048 . . . . 60.21 110.874 169.182 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.8 p -114.4 28.61 8.62 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 124.307 1.043 . . . . 64.41 111.535 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.474 ' HA ' HD23 ' A' ' 41' ' ' LEU . 1.4 mpp? -37.66 110.0 0.11 Allowed 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 126.238 1.815 . . . . 65.34 114.181 -173.498 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -113.31 56.56 0.69 Allowed 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.791 -1.559 . . . . 75.45 106.791 170.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 pp -95.07 -15.96 23.03 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.576 -1.647 . . . . 50.15 110.846 -174.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -85.91 -2.22 58.05 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 122.003 0.906 . . . . 73.11 109.795 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.7 m -81.51 39.25 0.53 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 115.2 -0.909 . . . . 62.31 111.481 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.1 t -87.69 76.81 8.78 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-O 121.901 0.858 . . . . 62.22 108.822 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 122.732 1.253 . . . . 60.05 110.933 176.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -113.53 160.62 30.97 Favored Pre-proline 1 N--CA 1.379 -4.019 0 N-CA-C 105.478 -2.045 . . . . 64.22 105.478 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -69.22 -141.48 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 122.803 2.335 . . . . 44.01 112.353 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -75.78 38.36 0.16 Allowed 'General case' 0 C--N 1.296 -1.721 0 C-N-CA 123.999 0.92 . . . . 73.31 112.88 -175.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.49 ' HB2' HG23 ' A' ' 57' ' ' VAL . 6.3 m-20 -60.03 143.52 87.98 Favored Pre-proline 0 N--CA 1.427 -1.594 0 C-N-CA 123.997 0.919 . . . . 74.13 109.52 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.08 -40.92 79.57 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.339 2.693 . . . . 64.23 113.704 -175.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.86 -30.28 61.3 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.32 -0.237 . . . . 74.24 110.948 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.49 HG23 ' HB2' ' A' ' 54' ' ' ASN . 84.0 t -66.46 -44.86 90.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 N-CA-C 108.249 -1.019 . . . . 72.44 108.249 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.45 -49.09 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 114.564 -1.198 . . . . 72.23 109.385 176.581 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.0 t-160 -56.24 -35.4 67.34 Favored 'General case' 0 C--O 1.206 -1.214 0 CA-C-N 116.281 -0.418 . . . . 75.53 111.123 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.496 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.5 ttt180 -58.93 -44.33 91.31 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.557 0.694 . . . . 72.05 111.206 176.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.511 ' HB3' HD11 ' A' ' 37' ' ' LEU . 59.0 mt-30 -72.21 -38.42 69.0 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.211 -0.904 . . . . 74.42 110.142 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -72.05 -30.18 64.9 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.891 -1.049 . . . . 72.54 110.439 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.552 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 9.2 t30 -61.64 -32.58 72.74 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 124.648 1.179 . . . . 71.35 109.398 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -67.52 -33.36 74.92 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 115.154 -0.93 . . . . 70.12 111.899 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -72.29 -37.93 68.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 109.11 -0.7 . . . . 64.33 109.11 176.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.552 ' HB3' ' O ' ' A' ' 63' ' ' ASN . 34.9 t80 -52.88 -43.92 66.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.483 -1.235 . . . . 72.51 108.415 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.81 -16.7 60.69 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.975 -1.012 . . . . 73.23 113.345 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.459 ' HB2' HG21 ' A' ' 72' ' ' THR . 39.0 mm-40 -82.98 -44.3 15.42 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 118.671 0.668 . . . . 64.03 110.571 177.647 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 173.03 143.13 4.08 Favored Glycine 0 CA--C 1.475 -2.433 0 C-N-CA 120.019 -1.086 . . . . 53.12 112.678 -175.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.566 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.4 ptt? -70.47 -27.27 64.1 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 106.684 -1.599 . . . . 74.41 106.684 170.425 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.85 -34.36 57.85 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.391 -1.277 . . . . 75.5 108.16 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.564 HG23 ' CD1' ' A' ' 40' ' ' PHE . 93.3 m -63.6 -36.12 82.76 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.387 -0.824 . . . . 52.13 109.41 174.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -63.12 -50.88 68.72 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.636 -0.505 . . . . 72.14 109.636 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.566 ' HG3' ' O ' ' A' ' 70' ' ' MET . 84.3 mttt -54.75 -42.23 71.4 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.839 -0.619 . . . . 72.34 111.294 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -65.31 -47.68 75.73 Favored 'General case' 0 N--CA 1.411 -2.398 0 C-N-CA 123.256 0.622 . . . . 74.22 111.142 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -59.34 -51.08 71.46 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.332 -0.849 . . . . 75.0 111.104 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.2 mm -64.79 -36.91 78.81 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 O-C-N 123.411 0.444 . . . . 73.3 110.842 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -58.55 -46.31 87.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.05 -0.523 . . . . 74.03 110.083 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.502 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 72.1 m-20 -72.14 -39.33 68.86 Favored 'General case' 0 C--O 1.185 -2.306 0 C-N-CA 120.795 -0.362 . . . . 70.42 110.94 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.421 HD23 ' CH2' ' A' ' 32' ' ' TRP . 2.5 tm? -49.79 -54.2 20.64 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.963 1.305 . . . . 73.23 110.535 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.44 ' SG ' HD11 ' A' ' 88' ' ' LEU . 59.1 m -63.18 -32.26 73.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.073 -0.967 . . . . 42.24 111.246 -179.266 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -76.2 -52.86 9.18 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.631 -0.713 . . . . 74.44 111.14 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 28.9 mt-10 -66.76 -44.68 80.77 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.846 0.858 . . . . 43.24 112.582 -173.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 79.8 mt -80.28 -10.81 59.76 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 120.164 -0.614 . . . . 74.32 109.456 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.5 t70 55.74 71.15 0.57 Allowed 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.079 -1.418 . . . . 75.2 111.612 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.7 t -124.86 104.95 29.84 Favored Pre-proline 0 C--N 1.303 -1.419 0 CA-C-N 114.701 -1.136 . . . . 72.11 108.52 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -75.98 73.04 5.02 Favored 'Trans proline' 0 N--CA 1.449 -1.101 0 C-N-CA 122.011 1.807 . . . . 63.25 111.092 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.44 HD11 ' SG ' ' A' ' 81' ' ' CYS . 0.3 OUTLIER -95.87 -24.35 16.48 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.024 1.12 . . . . 64.13 114.024 -178.4 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 62.41 17.83 9.8 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 121.977 0.894 . . . . 71.22 111.247 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.521 ' O ' HD23 ' A' ' 94' ' ' LEU . 63.8 mtt -113.12 17.52 18.67 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.794 -1.093 . . . . 72.22 109.969 -177.557 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.637 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -60.9 -56.07 25.49 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.218 -0.446 . . . . 71.11 111.165 -175.7 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.535 ' O ' HG22 ' A' ' 95' ' ' VAL . 35.2 mm -66.64 -42.84 48.1 Favored Pre-proline 0 CA--C 1.571 1.764 0 C-N-CA 123.181 0.592 . . . . 72.12 110.728 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -48.05 -41.85 32.99 Favored 'Trans proline' 0 CA--C 1.557 1.638 0 C-N-CA 121.759 1.64 . . . . 62.3 111.943 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.698 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 4.3 mm? -69.45 -36.2 76.38 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 122.795 0.438 . . . . 72.0 110.804 173.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.637 HG13 ' O ' ' A' ' 91' ' ' GLU . 5.8 m -68.21 -35.02 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-O 121.986 0.898 . . . . 72.42 110.156 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.8 t -59.53 -26.42 65.32 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 125.501 1.52 . . . . 71.2 110.99 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.698 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 2.7 mt -50.09 -47.46 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 C-N-CA 123.883 0.873 . . . . 72.34 110.949 176.071 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.487 ' CD1' ' HA ' ' A' ' 66' ' ' PHE . 7.8 t-105 -124.51 84.28 2.26 Favored 'General case' 0 N--CA 1.409 -2.491 0 CA-C-O 122.813 1.292 . . . . 71.41 110.044 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -122.14 -151.15 8.36 Favored Glycine 0 N--CA 1.411 -2.98 0 CA-C-N 112.96 -1.927 . . . . 74.2 109.066 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -60.61 152.67 67.03 Favored 'Trans proline' 0 C--O 1.251 1.158 0 C-N-CA 122.793 2.329 . . . . 71.22 112.79 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 . . . . . 0 N--CA 1.422 -1.836 0 C-N-CA 125.82 1.648 . . . . 75.33 112.627 178.773 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.541 0 N-CA-C 110.92 -0.872 . . . . 72.31 110.92 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -72.55 97.22 0.86 Allowed 'Trans proline' 0 C--O 1.246 0.923 0 C-N-CA 122.501 2.134 . . . . 64.32 113.046 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 92.1 mt -103.23 136.91 42.13 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 115.363 -0.835 . . . . 75.35 109.204 178.103 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.06 -16.71 49.96 Favored Glycine 0 C--N 1.306 -1.083 0 N-CA-C 111.302 -0.719 . . . . 25.33 111.302 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.1 m -137.4 161.44 36.31 Favored 'General case' 0 N--CA 1.425 -1.678 0 CA-C-O 121.185 0.517 . . . . 54.12 109.981 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.4 ' SD ' HD11 ' A' ' 92' ' ' ILE . 6.4 tpt -95.86 -12.87 24.54 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.518 -1.289 . . . . 71.4 107.518 177.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.59 25.22 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.089 1.514 . . . . 61.5 115.089 -173.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.422 ' HB3' HG21 ' A' ' 92' ' ' ILE . . . -78.26 -17.44 56.67 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.857 1.313 . . . . 74.41 109.129 177.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.502 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -64.82 -31.49 72.75 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 113.408 -1.724 . . . . 75.15 112.925 179.047 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.534 ' HB2' HD12 ' A' ' 11' ' ' ILE . 51.7 m -61.86 -27.84 69.08 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.672 0.748 . . . . 72.34 110.483 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.534 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.62 -29.74 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.427 -1.26 . . . . 71.35 111.76 -173.302 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.431 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 37.2 mmt180 -85.91 -38.13 18.35 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.9 1.074 . . . . 75.11 113.9 -172.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.15 -51.85 0.27 Allowed 'General case' 0 CA--C 1.552 1.027 0 N-CA-C 117.407 2.373 . . . . 73.41 117.407 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 42.3 m-80 -126.42 -80.59 0.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.588 1.329 . . . . 52.12 114.588 -173.454 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 67.99 84.67 0.15 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.187 0.995 . . . . 74.31 110.92 -175.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.68 -47.17 55.96 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.379 -0.828 . . . . 72.31 113.086 -177.149 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -61.23 -33.1 72.95 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.126 0.417 . . . . 71.54 112.126 -176.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.441 HD13 HD22 ' A' ' 94' ' ' LEU . 94.3 mt -64.87 -33.95 77.21 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.056 -0.52 . . . . 74.01 111.595 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.504 ' CA ' HD11 ' A' ' 97' ' ' ILE . 65.9 t-105 -63.9 -39.96 95.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.32 -0.4 . . . . 74.31 110.289 177.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.48 -38.95 91.26 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.593 -0.276 . . . . 73.23 110.435 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 76.7 t90 -58.76 -50.38 74.15 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.861 -0.792 . . . . 75.52 108.861 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.16 -52.89 62.94 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 114.893 -1.049 . . . . 74.14 110.773 -176.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 67.2 t -53.16 -51.76 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.124 0.57 . . . . 65.45 112.117 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.43 -0.35 . . . . 62.32 111.533 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -74.44 -47.12 35.59 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 107.695 -1.224 . . . . 63.41 107.695 -176.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.527 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -68.11 -24.74 65.06 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 124.237 1.015 . . . . 73.43 111.211 -178.67 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.421 ' HA ' ' HB2' ' A' ' 53' ' ' SER . 48.0 t -63.53 -15.11 57.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.079 -0.711 . . . . 64.13 109.079 174.412 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -100.39 -4.53 28.84 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-O 121.064 0.459 . . . . 72.24 110.084 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.527 ' OD1' ' HA ' ' A' ' 26' ' ' LEU . 1.6 p-10 -133.93 48.36 3.17 Favored Pre-proline 0 N--CA 1.472 0.658 0 N-CA-C 113.362 0.875 . . . . 52.21 113.362 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.4 Cg_exo -72.36 -22.95 21.11 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.612 1.541 . . . . 52.14 111.154 -175.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -75.6 -51.32 13.13 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.857 -0.794 . . . . 60.52 108.857 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.548 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 60.9 t90 -60.72 -44.14 96.97 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.06 -0.973 . . . . 74.24 109.668 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.546 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -58.08 -43.4 86.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.627 -0.715 . . . . 75.1 109.641 -178.383 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 50.7 m -61.99 -49.44 76.06 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 116.26 -0.427 . . . . 52.33 110.964 177.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.14 -39.85 63.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.727 0.811 . . . . 64.32 111.612 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.548 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.2 mmmt -74.21 -33.48 63.4 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.979 -0.289 . . . . 73.52 111.306 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.9 mt -59.1 -34.1 71.62 Favored 'General case' 0 C--O 1.19 -2.05 0 N-CA-C 110.342 -0.244 . . . . 73.21 110.342 174.304 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.489 ' HG2' ' SD ' ' A' ' 44' ' ' MET . 90.5 mtt180 -59.33 -39.12 82.14 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.287 0.565 . . . . 61.55 110.51 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -72.26 -38.91 68.76 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 114.907 -1.042 . . . . 44.34 110.396 -176.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.544 ' CD1' HG23 ' A' ' 72' ' ' THR . 69.7 m-85 -89.29 -50.19 6.28 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 113.559 0.948 . . . . 73.02 113.559 -176.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.436 ' HB3' ' H ' ' A' ' 44' ' ' MET . 8.3 mp -79.65 128.38 74.89 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 123.591 0.756 . . . . 71.13 110.498 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -72.85 -22.12 20.48 Favored 'Trans proline' 0 C--N 1.321 -0.914 0 C-N-CA 122.23 1.953 . . . . 74.44 111.761 177.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.5 p -108.62 -30.59 8.14 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 113.871 1.063 . . . . 73.14 113.871 -176.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.489 ' SD ' ' HG2' ' A' ' 38' ' ' ARG 0.29 1.1 ptm 41.32 92.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 116.205 1.928 . . . . 52.33 116.205 -175.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -99.12 56.8 1.05 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 123.171 1.463 . . . . 72.42 108.244 177.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.406 HD22 ' HB3' ' A' ' 34' ' ' SER . 3.5 pp -92.18 -17.33 25.03 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.577 -1.647 . . . . 64.04 112.634 -173.128 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -88.74 0.21 56.7 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.025 0.917 . . . . 74.23 110.744 -176.294 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.3 m -81.78 69.46 8.46 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.615 -0.721 . . . . 65.22 109.697 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.3 m -93.15 82.89 4.58 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-O 121.896 0.855 . . . . 73.12 109.582 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.66 -28.28 30.76 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 122.698 1.237 . . . . 52.55 110.333 176.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -134.11 167.53 22.42 Favored Pre-proline 1 N--CA 1.376 -4.158 0 N-CA-C 104.948 -2.241 . . . . 62.0 104.948 176.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -76.83 -149.45 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 121.691 1.594 . . . . 75.44 110.648 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.421 ' HB2' ' HA ' ' A' ' 27' ' ' SER . 29.3 p -76.0 38.65 0.17 Allowed 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 123.666 0.786 . . . . 74.1 112.788 -177.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.94 150.98 46.86 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 125.156 1.382 . . . . 72.44 111.591 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -52.87 -43.85 53.1 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 123.529 2.819 . . . . 72.44 113.956 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.4 -28.92 61.3 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 120.977 -0.289 . . . . 73.43 111.37 -178.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 99.8 t -65.87 -52.54 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.362 -1.347 . . . . 62.41 107.362 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.0 mm -55.48 -47.41 78.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.641 -1.163 . . . . 75.43 110.148 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -54.16 -40.93 67.94 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.337 0.655 . . . . 75.21 111.462 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.0 ttm180 -68.17 -41.44 81.52 Favored 'General case' 0 C--N 1.297 -1.705 0 C-N-CA 123.412 0.685 . . . . 74.55 111.093 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.563 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 46.0 mt-30 -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.349 -0.841 . . . . 71.12 111.175 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.427 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -77.9 -30.58 50.73 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.452 -0.795 . . . . 65.32 110.678 -178.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.457 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 24.0 t-20 -54.59 -46.01 73.71 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.244 1.017 . . . . 64.24 110.622 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -54.03 -33.83 58.34 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.114 -1.403 . . . . 71.3 112.075 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.9 mt -72.45 -42.92 64.47 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.734 0.302 . . . . 62.45 111.026 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -64.83 -32.51 74.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.815 -0.63 . . . . 74.25 109.581 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.9 -24.8 63.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.287 -0.87 . . . . 72.13 111.624 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.563 ' HB2' HG21 ' A' ' 72' ' ' THR . 32.2 mm-40 -74.29 -37.37 63.69 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 108.615 -0.883 . . . . 73.42 108.615 175.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.489 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . 170.81 138.78 2.59 Favored Glycine 0 N--CA 1.415 -2.737 0 CA-C-N 114.678 -1.146 . . . . 64.23 110.909 -176.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.534 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.48 -26.55 63.67 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 106.864 -1.532 . . . . 72.22 106.864 171.385 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.44 -37.54 65.81 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 113.986 -1.461 . . . . 72.31 108.374 174.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.563 HG21 ' HB2' ' A' ' 68' ' ' GLN . 53.1 m -58.99 -42.47 90.12 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.488 -0.778 . . . . 74.15 109.707 173.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.477 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -61.27 -46.0 92.15 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.03 -0.532 . . . . 72.33 110.639 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 70' ' ' MET . 95.2 mttt -53.76 -46.39 70.91 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 122.581 0.352 . . . . 71.45 110.852 175.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.7 m -65.63 -42.28 91.67 Favored 'General case' 0 N--CA 1.407 -2.593 0 C-N-CA 123.033 0.533 . . . . 62.2 111.756 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 94.5 t80 -58.37 -49.22 78.01 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.042 -0.527 . . . . 73.33 111.584 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.485 HG22 ' HG3' ' A' ' 91' ' ' GLU . 49.3 mm -61.13 -33.92 58.16 Favored 'Isoleucine or valine' 0 C--O 1.244 0.792 0 O-C-N 123.336 0.397 . . . . 70.31 111.177 -177.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.444 ' HA ' ' OE1' ' A' ' 91' ' ' GLU . 5.7 t30 -57.96 -49.02 78.21 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.857 -0.611 . . . . 65.5 110.156 175.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.6 m-20 -72.85 -40.12 65.97 Favored 'General case' 0 C--O 1.194 -1.846 0 CA-C-N 114.928 -1.033 . . . . 72.22 110.666 -178.204 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.509 HD21 HD21 ' A' ' 26' ' ' LEU . 2.5 tm? -50.95 -54.47 24.02 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 125.229 1.412 . . . . 72.2 109.732 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.7 m -65.95 -40.67 91.55 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.151 -0.477 . . . . 62.52 110.281 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -65.38 -49.02 70.89 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 73.15 111.986 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 33.9 mt-10 -81.11 -17.71 49.01 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 112.942 0.719 . . . . 72.4 112.942 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -103.17 -39.39 6.88 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 112.501 0.556 . . . . 75.44 112.501 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -138.3 -151.64 0.39 Allowed 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.871 -1.159 . . . . 71.45 107.871 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.2 m -105.04 166.45 11.43 Favored Pre-proline 0 C--N 1.295 -1.771 0 N-CA-C 107.35 -1.352 . . . . 70.02 107.35 175.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.9 86.69 0.73 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.501 1.467 . . . . 71.44 111.577 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.612 HD13 ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -77.48 -13.43 59.92 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-N 115.905 -0.589 . . . . 61.23 112.003 178.058 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.6 t70 53.48 83.63 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 116.1 1.889 . . . . 71.33 116.1 174.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.498 ' HG2' ' CD2' ' A' ' 88' ' ' LEU . 26.2 ptm -156.12 32.25 0.34 Allowed 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.04 -2.578 . . . . 75.03 104.04 168.74 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.606 ' O ' HG13 ' A' ' 95' ' ' VAL . 35.2 tt0 -60.4 -50.84 72.0 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 111.547 -2.569 . . . . 71.43 111.759 -172.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.547 ' O ' HG22 ' A' ' 95' ' ' VAL . 42.4 mm -60.56 -45.4 97.2 Favored Pre-proline 0 CA--C 1.559 1.29 0 C-N-CA 123.011 0.525 . . . . 72.21 111.536 -177.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -47.89 -37.25 28.67 Favored 'Trans proline' 0 CA--C 1.553 1.454 0 C-N-CA 121.911 1.741 . . . . 74.45 111.812 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.441 HD22 HD13 ' A' ' 18' ' ' LEU . 4.4 mm? -76.26 -34.98 59.14 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 122.797 0.439 . . . . 72.35 110.972 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.606 HG13 ' O ' ' A' ' 91' ' ' GLU . 5.2 m -68.53 -30.59 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-O 122.799 1.285 . . . . 75.31 110.748 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.431 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 30.0 t -83.5 2.86 34.81 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 113.635 -1.62 . . . . 61.15 112.39 -178.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.566 ' HA ' ' O ' ' A' ' 14' ' ' ASN . 9.7 tt -62.67 -25.86 39.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 114.143 1.164 . . . . 73.31 114.143 -170.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -101.33 -22.08 14.69 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 121.777 -0.577 . . . . 71.22 111.533 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.06 75.66 1.18 Allowed Glycine 0 C--N 1.305 -1.157 0 N-CA-C 109.236 -1.546 . . . . 43.12 109.236 -173.046 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -66.27 113.54 2.69 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.223 2.615 . . . . 60.23 113.488 -173.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 . . . . . 0 N--CA 1.405 -2.716 0 N-CA-C 106.763 -1.569 . . . . 60.24 106.763 176.484 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.461 0 N-CA-C 110.443 -1.063 . . . . 73.01 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -64.1 -46.92 7.21 Favored 'Trans proline' 0 C--O 1.24 0.617 0 C-N-CA 122.591 2.194 . . . . 73.11 112.335 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.3 tp -70.26 98.96 1.45 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 121.129 0.49 . . . . 74.44 111.039 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.95 -20.78 29.93 Favored Glycine 0 N--CA 1.437 -1.261 0 N-CA-C 111.048 -0.821 . . . . 31.32 111.048 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.3 m -65.67 116.0 6.43 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 122.92 0.488 . . . . 64.01 110.738 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.32 1.42 55.78 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-O 122.048 0.928 . . . . 65.42 111.165 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -106.34 25.68 10.78 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 114.903 -1.044 . . . . 71.22 110.897 177.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.02 -17.25 57.3 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-O 121.396 0.617 . . . . 64.04 109.355 174.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.24 -40.4 64.52 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 126.049 1.74 . . . . 74.21 115.222 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 33.5 t -58.35 -41.52 84.88 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 124.457 1.103 . . . . 63.52 110.261 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.545 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.5 mp -87.2 -36.69 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.147 0 CA-C-N 114.711 -1.131 . . . . 71.44 111.648 -176.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -72.66 -49.48 31.41 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 114.405 1.261 . . . . 72.51 114.405 -176.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 63.1 -168.91 0.19 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.862 0.726 . . . . 61.32 110.054 -171.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -138.85 178.59 7.05 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 121.631 -0.668 . . . . 73.24 111.279 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -114.2 145.02 42.25 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.9 -1.148 . . . . 75.21 107.9 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -64.17 -29.38 70.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.096 0.558 . . . . 72.5 110.516 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.4 m-20 -60.46 -39.01 86.03 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 109.082 -0.71 . . . . 72.43 109.082 176.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.436 HD21 HD13 ' A' ' 94' ' ' LEU . 6.7 tt -72.31 -38.4 68.72 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.152 -1.386 . . . . 72.55 109.182 -177.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.431 ' HA ' HD11 ' A' ' 97' ' ' ILE . 66.8 t-105 -60.77 -51.14 70.6 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.312 -0.404 . . . . 73.32 109.968 175.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.49 -38.23 86.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 115.689 -0.687 . . . . 70.4 110.558 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.7 t-105 -61.48 -50.89 70.94 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.302 0.376 . . . . 75.01 111.074 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.85 -50.15 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.529 -0.545 . . . . 53.42 109.529 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -61.16 -46.32 96.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.947 -0.569 . . . . 55.12 111.811 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.472 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 78.3 ttt180 -69.12 -42.48 75.99 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.7 -0.227 . . . . 73.42 111.606 -176.151 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.424 HD22 ' HE3' ' A' ' 28' ' ' LYS . 2.4 tm? -67.31 -43.73 80.96 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.446 -0.576 . . . . 62.43 109.446 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.442 HD13 HD13 ' A' ' 33' ' ' LEU . 1.5 mt -70.02 -25.18 63.46 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 122.444 0.298 . . . . 71.21 111.673 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -70.2 -12.91 61.92 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.794 -0.817 . . . . 73.12 108.794 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 7.0 mtmp? -101.17 -5.15 26.0 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.512 -0.551 . . . . 65.33 109.512 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.473 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 92.3 m-20 -136.72 52.06 5.52 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.411 -0.813 . . . . 74.32 111.172 -175.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.473 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 6.1 Cg_exo -71.97 -21.78 23.89 Favored 'Trans proline' 0 C--N 1.358 1.04 0 N-CA-C 108.687 -1.313 . . . . 64.43 108.687 -177.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.49 -36.93 68.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.49 -1.686 . . . . 73.54 109.914 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.592 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 69.2 t90 -75.11 -45.16 42.96 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.571 -0.852 . . . . 75.12 109.098 173.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.475 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 60.3 tp -56.46 -48.82 76.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.367 -1.288 . . . . 62.23 112.346 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.7 m -55.99 -36.74 68.24 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 123.575 0.547 . . . . 72.21 111.641 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.81 -38.84 87.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.382 0.611 . . . . 53.42 110.184 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.592 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.8 mmmt -76.53 -37.25 56.98 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.685 -0.406 . . . . 71.31 111.392 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 88.0 mt -54.37 -49.71 69.19 Favored 'General case' 0 C--O 1.186 -2.251 0 O-C-N 123.574 0.546 . . . . 75.11 110.264 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.498 ' HA ' ' HB3' ' A' ' 44' ' ' MET . 28.4 ptt180 -65.22 -30.49 71.39 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 113.463 0.912 . . . . 74.24 113.463 -178.07 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 72.1 m -69.93 -23.47 63.22 Favored 'General case' 0 N--CA 1.385 -3.709 0 CA-C-N 115.314 -0.857 . . . . 53.54 111.793 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.43 ' CD1' HG23 ' A' ' 72' ' ' THR . 57.7 m-85 -100.66 -44.11 5.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 123.825 0.85 . . . . 62.03 112.639 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.461 HD21 ' HG2' ' A' ' 64' ' ' ARG . 9.5 mp -76.59 120.48 81.85 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 124.438 1.095 . . . . 72.43 110.67 178.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -62.98 -34.5 70.64 Favored 'Trans proline' 0 CA--C 1.535 0.575 0 C-N-CA 122.953 2.436 . . . . 74.14 113.533 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.6 p -114.34 -5.37 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.18 0.514 . . . . 74.51 112.062 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.498 ' HB3' ' HA ' ' A' ' 38' ' ' ARG 0.286 6.4 ptt? 41.96 92.12 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 115.532 1.679 . . . . 71.43 115.532 -174.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -100.92 58.22 0.9 Allowed 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 107.908 -1.145 . . . . 62.42 107.908 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 pp -96.17 -5.18 41.17 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.743 -1.117 . . . . 74.21 112.915 -175.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -80.7 -13.34 59.09 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.767 0.794 . . . . 75.42 111.326 -176.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -75.53 91.09 2.78 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.195 -0.911 . . . . 75.4 110.153 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.1 t -141.74 76.53 1.55 Allowed 'General case' 0 N--CA 1.419 -1.975 0 N-CA-C 108.352 -0.981 . . . . 65.5 108.352 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.31 -28.56 69.29 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-N 113.83 -1.532 . . . . 74.03 112.475 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HB2' HG21 ' A' ' 57' ' ' VAL . 50.0 mt-10 -122.73 169.44 9.8 Favored Pre-proline 0 C--N 1.247 -3.864 0 N-CA-C 106.187 -1.783 . . . . 63.54 106.187 178.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -68.04 -156.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.558 1.685 0 C-N-CA 121.321 1.347 . . . . 71.33 111.517 173.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.0 m -75.72 39.12 0.16 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 124.154 0.982 . . . . 75.04 113.197 -174.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -57.08 149.6 44.83 Favored Pre-proline 0 N--CA 1.432 -1.354 0 C-N-CA 126.186 1.794 . . . . 63.32 111.295 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -46.65 -45.89 18.96 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.35 3.367 . . . . 70.15 114.243 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -74.6 -25.98 59.61 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.178 0.513 . . . . 74.13 110.966 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' A' ' 51' ' ' GLU . 95.5 t -73.97 -47.73 41.43 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.572 -0.899 . . . . 52.25 108.572 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.4 mm -59.02 -41.81 84.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.962 -1.017 . . . . 72.4 109.861 176.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -55.62 -46.58 77.36 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 115.643 -0.708 . . . . 62.4 110.025 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -58.89 -43.34 90.95 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.365 0.603 . . . . 74.15 111.209 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.33 -46.45 76.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.012 -0.995 . . . . 74.53 111.603 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.401 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -74.44 -30.59 61.96 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.465 -0.788 . . . . 75.42 111.918 -177.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -63.13 -38.45 91.23 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 123.706 0.802 . . . . 63.22 109.854 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.461 ' HG2' HD21 ' A' ' 41' ' ' LEU . 9.5 tpp85 -59.5 -29.46 67.88 Favored 'General case' 1 N--CA 1.375 -4.181 0 C-N-CA 124.924 1.29 . . . . 73.42 111.877 178.582 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -71.09 -38.07 72.42 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.795 -0.446 . . . . 73.4 109.795 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -69.08 -31.23 69.83 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.899 -0.778 . . . . 71.54 108.899 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.88 -26.72 66.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.436 -0.802 . . . . 55.1 110.944 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.525 ' HB2' HG21 ' A' ' 72' ' ' THR . 35.8 mm-40 -70.83 -48.56 53.42 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 107.782 -1.192 . . . . 75.24 107.782 174.243 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.407 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -174.92 139.69 4.95 Favored Glycine 0 CA--C 1.474 -2.499 0 CA-C-N 114.635 -1.166 . . . . 55.14 110.739 -176.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.619 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -66.08 -29.73 70.12 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 106.211 -1.774 . . . . 75.55 106.211 171.666 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.22 -35.54 59.0 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.789 -1.55 . . . . 63.5 108.718 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.525 HG21 ' HB2' ' A' ' 68' ' ' GLN . 91.1 m -58.75 -41.16 85.87 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.742 -0.663 . . . . 74.11 110.03 175.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.575 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -63.33 -49.37 74.2 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.441 -0.345 . . . . 65.04 110.424 176.982 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 70' ' ' MET . 86.7 mttt -54.7 -35.39 63.57 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.325 0.65 . . . . 74.33 111.545 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.1 m -72.17 -49.94 31.73 Favored 'General case' 0 N--CA 1.409 -2.507 0 N-CA-C 109.69 -0.485 . . . . 72.52 109.69 176.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -50.51 -48.51 56.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 124.125 0.97 . . . . 75.55 112.189 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.41 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 41.1 mm -57.4 -37.07 55.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 N-CA-C 112.644 0.609 . . . . 75.3 112.644 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -65.92 -34.06 77.26 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.288 0.566 . . . . 74.33 110.169 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.404 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 1.2 m-20 -78.21 -42.77 30.35 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.712 -0.676 . . . . 73.53 110.174 175.171 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.412 HD21 HD21 ' A' ' 26' ' ' LEU . 2.4 tm? -50.19 -54.52 20.29 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.869 1.668 . . . . 74.42 110.542 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 13.2 p -64.48 -33.36 75.71 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.379 -0.828 . . . . 71.42 111.643 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -75.93 -54.64 6.58 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.063 -0.971 . . . . 72.53 111.778 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 40.5 mt-10 -70.93 -31.35 67.93 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.504 0.927 . . . . 72.54 113.504 -170.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.5 -49.34 19.05 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 119.993 -0.683 . . . . 71.33 111.857 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -161.69 -97.3 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.13 0.269 . . . . 74.21 110.514 -176.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -140.64 165.02 32.72 Favored Pre-proline 0 C--N 1.3 -1.573 0 N-CA-C 105.445 -2.057 . . . . 74.32 105.445 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -43.5 107.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 122.967 2.444 . . . . 64.34 112.101 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -8.86 59.61 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.835 -1.075 . . . . 62.35 112.823 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -175.12 -161.64 0.1 Allowed 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 103.179 -2.897 . . . . 73.42 103.179 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.506 ' O ' HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -86.59 141.62 28.88 Favored 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 106.926 -1.509 . . . . 71.15 106.926 178.448 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.566 ' O ' HG13 ' A' ' 95' ' ' VAL . 36.2 tt0 -52.78 -52.25 57.44 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 124.977 1.311 . . . . 65.43 112.94 -175.059 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 95' ' ' VAL . 39.3 mm -64.44 -45.6 77.46 Favored Pre-proline 0 C--O 1.169 -3.154 0 CA-C-O 117.534 -1.222 . . . . 70.21 113.136 -172.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -49.38 -35.13 34.71 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 CA-C-N 122.837 2.049 . . . . 72.51 112.097 172.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.506 HD23 ' O ' ' A' ' 90' ' ' MET . 3.4 mm? -72.2 -36.59 69.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.691 -0.686 . . . . 71.54 109.385 175.553 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.575 ' HA ' ' CD1' ' A' ' 73' ' ' TRP . 2.9 m -69.87 -36.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-O 122.385 1.088 . . . . 74.31 109.993 177.047 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.6 m -70.42 5.24 1.86 Allowed 'General case' 0 C--N 1.293 -1.858 0 C-N-CA 127.694 2.398 . . . . 72.22 113.007 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.431 HD11 ' HA ' ' A' ' 19' ' ' TRP . 10.3 tp -66.61 -28.56 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.088 0.47 . . . . 55.34 111.163 -175.631 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -164.47 116.82 1.3 Allowed 'General case' 0 N--CA 1.421 -1.887 0 N-CA-C 108.126 -1.064 . . . . 72.31 108.126 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 177.6 70.6 0.06 OUTLIER Glycine 0 C--N 1.277 -2.742 0 N-CA-C 108.027 -2.029 . . . . 70.2 108.027 178.505 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -67.25 98.46 0.45 Allowed 'Trans proline' 0 C--N 1.358 1.033 0 C-N-CA 123.14 2.56 . . . . 70.2 112.076 -174.265 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 . . . . . 0 N--CA 1.401 -2.903 0 N-CA-C 106.801 -1.555 . . . . 72.03 106.801 -178.679 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.208 0 N-CA-C 109.899 -1.28 . . . . 71.53 109.899 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -57.72 109.0 0.42 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 122.824 2.35 . . . . 71.51 111.922 176.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 93.2 mt -99.3 -30.01 12.48 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.703 -0.68 . . . . 53.52 110.771 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 155.88 -49.12 0.47 Allowed Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 111.893 -0.483 . . . . 64.0 111.893 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.1 m -84.74 122.22 28.79 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.501 -0.926 . . . . 51.45 108.501 177.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 tpt -71.18 -11.58 61.01 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.201 0.524 . . . . 72.43 110.162 -176.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -78.32 25.09 0.24 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.933 0.893 . . . . 70.34 112.205 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.56 -13.27 60.09 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.22 -1.03 . . . . 64.3 108.22 174.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.432 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -60.88 -38.24 84.96 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.376 -1.284 . . . . 63.44 112.142 178.627 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.602 ' HB2' HD12 ' A' ' 11' ' ' ILE . 68.0 m -54.92 -32.17 60.89 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 124.679 1.192 . . . . 74.33 111.727 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.602 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -83.88 -25.91 7.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 C-N-CA 124.91 1.284 . . . . 74.31 110.322 -173.499 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -110.16 7.4 23.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.646 -0.707 . . . . 62.24 111.964 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.4 tt -51.35 121.43 6.27 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.576 1.151 . . . . 74.41 112.586 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.405 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 26.4 t-20 -152.42 149.43 28.58 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 105.093 -2.188 . . . . 71.01 105.093 177.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -122.17 -73.77 0.64 Allowed 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 118.815 -1.154 . . . . 65.42 113.122 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.97 -34.34 75.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.958 1.466 . . . . 72.12 114.958 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -70.26 -40.21 74.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 120.259 -0.576 . . . . 73.13 110.966 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.8 mt -74.44 -34.86 63.3 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.242 -0.436 . . . . 71.21 110.241 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.438 ' HB2' HD11 ' A' ' 97' ' ' ILE . 49.0 t-105 -61.15 -50.12 74.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.278 -0.419 . . . . 65.42 110.769 178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.11 85.73 Favored 'General case' 0 C--O 1.243 0.74 0 O-C-N 123.225 0.328 . . . . 43.55 110.902 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.439 ' HE1' HD22 ' A' ' 88' ' ' LEU . 22.2 t-105 -63.88 -51.03 66.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.739 -0.664 . . . . 73.32 110.948 176.004 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.8 tp -60.08 -49.2 78.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.998 -0.546 . . . . 62.03 110.076 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.406 ' HA ' HG21 ' A' ' 58' ' ' ILE . 42.3 t -57.42 -46.38 85.64 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 CA-C-N 115.681 -0.69 . . . . 73.35 111.446 179.072 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.521 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 19.7 tpt180 -68.52 -44.26 75.02 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 116.644 -0.253 . . . . 55.22 110.728 -176.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.415 HD12 HD13 ' A' ' 84' ' ' LEU . 1.9 tm? -67.93 -42.96 80.22 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 109.674 -0.491 . . . . 73.5 109.674 -176.405 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.409 HD21 HD21 ' A' ' 80' ' ' LEU . 2.3 mt -71.61 -24.53 61.9 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 112.008 0.373 . . . . 74.14 112.008 177.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.6 t -67.09 -23.28 65.83 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 107.723 -1.214 . . . . 71.24 107.723 175.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 31.1 mtmt -90.94 -10.2 43.32 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.66 -0.7 . . . . 70.44 110.084 178.133 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -135.4 52.3 6.86 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 122.883 0.473 . . . . 74.2 111.33 -177.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.01 -17.88 24.6 Favored 'Trans proline' 0 C--N 1.368 1.556 0 N-CA-C 108.759 -1.285 . . . . 72.22 108.759 -178.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -71.55 -38.58 71.0 Favored 'General case' 0 N--CA 1.417 -2.099 0 CA-C-N 113.386 -1.734 . . . . 73.03 109.455 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.444 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.1 t90 -74.67 -47.98 28.75 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.657 -0.817 . . . . 71.35 109.554 176.291 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.55 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 52.8 tp -54.05 -51.48 63.92 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.009 -1.45 . . . . 70.31 112.418 -175.091 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.531 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.9 p -50.34 -51.79 42.63 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 123.878 0.736 . . . . 75.01 112.127 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.73 -43.48 76.63 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 125.083 1.353 . . . . 74.33 112.081 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.444 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.0 mmmt -74.05 -30.03 62.19 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.325 -0.235 . . . . 73.33 110.436 178.284 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 98.0 mt -63.77 -35.88 82.03 Favored 'General case' 0 C--O 1.187 -2.205 0 N-CA-C 109.256 -0.646 . . . . 73.21 109.256 173.434 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -61.51 -33.56 74.02 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.269 0.557 . . . . 73.35 110.562 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.3 m -74.56 -41.59 60.28 Favored 'General case' 0 N--CA 1.402 -2.855 0 C-N-CA 124.981 1.312 . . . . 72.03 112.324 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.57 ' CD1' HG23 ' A' ' 72' ' ' THR . 67.1 m-85 -88.99 -48.31 7.52 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 113.091 0.775 . . . . 74.45 113.091 -177.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 8.4 mp -89.85 139.0 27.57 Favored Pre-proline 0 C--N 1.295 -1.777 0 C-N-CA 124.425 1.09 . . . . 50.04 112.139 -177.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 41' ' ' LEU . 3.7 Cg_endo -91.04 -13.0 2.14 Favored 'Trans proline' 0 CA--C 1.551 1.326 0 C-N-CA 122.241 1.96 . . . . 73.43 109.284 166.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.9 p -114.37 26.59 10.13 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 125.668 1.587 . . . . 60.35 111.567 -172.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.454 ' HB3' ' HB2' ' A' ' 41' ' ' LEU 0.257 0.0 OUTLIER -59.11 96.08 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 115.946 1.832 . . . . 75.21 115.946 -173.943 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.413 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 16.4 m-20 -83.72 74.06 10.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.004 -1.48 . . . . 74.41 107.004 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 34' ' ' SER . 4.6 pp -95.81 -27.35 15.26 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-N 115.24 -0.891 . . . . 74.1 111.456 -178.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -103.66 6.13 36.85 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 122.265 1.031 . . . . 73.1 109.668 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 63.6 m -81.72 74.33 8.72 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 122.407 1.099 . . . . 41.32 109.464 177.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.4 t -90.52 83.33 5.84 Favored 'General case' 0 N--CA 1.403 -2.793 0 CA-C-N 114.36 -1.291 . . . . 64.11 110.142 -176.03 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.411 ' CE1' HG22 ' A' ' 57' ' ' VAL . 0.6 OUTLIER -79.76 -28.79 40.36 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 123.166 1.46 . . . . 75.31 108.696 170.026 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -135.0 161.87 61.11 Favored Pre-proline 1 N--CA 1.373 -4.313 0 CA-C-N 112.03 -2.35 . . . . 63.03 105.191 177.44 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.2 Cg_exo -67.81 -143.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.846 2.364 . . . . 73.52 111.917 175.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.9 m -76.91 37.64 0.19 Allowed 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 124.1 0.96 . . . . 71.4 110.489 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 52' ' ' PRO . 7.2 m-20 -65.32 152.23 92.39 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 126.795 2.038 . . . . 74.34 113.258 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -54.32 -41.67 74.36 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 123.954 3.103 . . . . 64.2 114.272 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.47 -29.69 61.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.225 0.536 . . . . 73.35 110.478 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 86.8 t -66.38 -51.65 55.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.207 -1.034 . . . . 71.4 108.207 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.406 HG21 ' HA ' ' A' ' 23' ' ' VAL . 46.9 mm -59.65 -41.56 85.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.561 -1.199 . . . . 71.43 109.709 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 77.2 t60 -56.42 -42.15 77.55 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.838 0.455 . . . . 74.22 111.251 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.529 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 21.2 ttt180 -61.21 -42.0 97.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.599 0.714 . . . . 75.41 110.953 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 84.6 mt-30 -71.39 -42.24 68.63 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.942 -1.026 . . . . 51.11 111.764 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.406 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -75.51 -31.11 60.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 115.347 -0.842 . . . . 72.34 110.547 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.529 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 23.7 t-20 -53.33 -49.77 66.4 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.957 1.303 . . . . 52.35 110.23 173.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.431 ' CB ' HD21 ' A' ' 41' ' ' LEU . 30.0 mmt180 -54.69 -33.6 61.14 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.553 -1.658 . . . . 54.11 113.071 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -67.02 -40.66 87.29 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.641 0.258 . . . . 71.25 110.575 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -67.17 -32.95 74.39 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.812 -0.81 . . . . 74.42 108.812 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.09 -18.96 63.27 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.321 -0.854 . . . . 64.25 111.281 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -79.52 -55.85 4.74 Favored 'General case' 0 N--CA 1.413 -2.277 0 N-CA-C 107.137 -1.431 . . . . 64.14 107.137 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -166.51 140.29 6.25 Favored Glycine 0 N--CA 1.42 -2.372 0 CA-C-N 114.132 -1.395 . . . . 73.1 111.036 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.445 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 45.8 ttm -65.13 -30.88 71.85 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 106.137 -1.801 . . . . 62.4 106.137 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.15 -35.52 59.16 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.641 -1.618 . . . . 61.52 109.123 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.57 HG23 ' CD1' ' A' ' 40' ' ' PHE . 54.9 m -59.96 -36.95 78.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.813 -0.631 . . . . 72.34 110.007 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.506 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 75.1 t-105 -61.94 -53.0 61.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.678 -0.49 . . . . 72.43 109.678 176.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.507 ' HA ' HG12 ' A' ' 95' ' ' VAL . 92.4 mttt -51.28 -46.58 62.5 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.89 0.876 . . . . 74.52 111.727 177.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.66 -44.11 74.79 Favored 'General case' 0 N--CA 1.41 -2.444 0 C-N-CA 123.035 0.534 . . . . 43.13 112.168 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -57.06 -46.02 82.79 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 122.816 0.446 . . . . 74.11 110.382 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.646 HG21 ' HB2' ' A' ' 94' ' ' LEU . 45.4 mm -63.71 -31.35 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.019 0 CA-C-N 115.751 -0.659 . . . . 74.12 111.565 -177.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.22 -40.77 94.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.5 -0.556 . . . . 73.42 109.5 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 82.7 m-20 -68.44 -42.28 79.06 Favored 'General case' 0 C--O 1.187 -2.221 0 CA-C-N 116.017 -0.538 . . . . 72.23 109.756 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.468 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -50.52 -53.91 26.49 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.085 1.354 . . . . 75.22 109.767 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.4 m -64.24 -35.14 79.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 45.34 111.403 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -76.33 -54.29 6.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.206 0.526 . . . . 73.3 112.105 -178.252 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 31.0 mt-10 -74.78 -22.57 58.68 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.734 1.013 . . . . 73.04 113.734 -169.353 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.415 HD13 HD12 ' A' ' 25' ' ' LEU . 94.6 mt -79.71 -42.13 25.29 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 119.046 -1.061 . . . . 62.01 111.823 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . 0.25 4.3 p30 -171.19 -90.48 0.01 OUTLIER 'General case' 0 C--O 1.241 0.641 0 N-CA-C 112.677 0.621 . . . . 74.34 112.677 174.274 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 69.4 t -130.51 148.04 68.37 Favored Pre-proline 0 C--N 1.301 -1.507 0 N-CA-C 106.297 -1.742 . . . . 74.32 106.297 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -39.22 109.0 0.08 OUTLIER 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 123.393 2.729 . . . . 74.45 112.207 173.27 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.439 HD22 ' HE1' ' A' ' 21' ' ' TRP . 0.7 OUTLIER -74.29 -15.58 60.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.026 -0.988 . . . . 71.2 112.91 -178.297 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.86 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 105.207 -2.146 . . . . 74.13 105.207 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.1 mmt -168.5 163.66 12.51 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 102.886 -3.005 . . . . 54.34 102.886 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.585 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.9 OUTLIER -72.01 -43.66 64.68 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 118.489 0.586 . . . . 75.14 111.105 -179.548 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.521 ' O ' HG22 ' A' ' 95' ' ' VAL . 29.5 mm -50.47 -44.14 81.95 Favored Pre-proline 0 CA--C 1.572 1.796 0 C-N-CA 125.7 1.6 . . . . 70.42 114.132 -171.642 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.03 -43.38 58.75 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.494 1.463 . . . . 65.41 110.793 174.56 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.646 ' HB2' HG21 ' A' ' 77' ' ' ILE . 2.8 mm? -75.15 -31.88 61.17 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.586 -1.188 . . . . 74.03 109.78 -179.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.585 HG13 ' O ' ' A' ' 91' ' ' GLU . 4.1 m -67.74 -31.36 52.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-O 122.176 0.989 . . . . 72.31 110.49 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.4 t -80.79 5.8 14.84 Favored 'General case' 0 C--N 1.281 -2.386 0 CA-C-N 113.708 -1.587 . . . . 33.03 112.408 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.438 HD11 ' HB2' ' A' ' 19' ' ' TRP . 15.4 tt -60.46 -27.81 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 CA-C-O 121.478 0.656 . . . . 64.52 110.448 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -160.64 161.87 32.54 Favored 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 106.913 -1.514 . . . . 64.01 106.913 173.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 179.7 -115.21 0.47 Allowed Glycine 0 C--N 1.288 -2.127 0 C-N-CA 120.134 -1.031 . . . . 65.32 111.542 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.11 104.59 0.14 Allowed 'Trans proline' 0 C--O 1.243 0.735 0 C-N-CA 123.612 2.875 . . . . 72.5 111.675 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . 0.379 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.113 0 N-CA-C 115.631 1.715 . . . . 63.02 115.631 -177.783 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.335 0 N-CA-C 109.628 -1.389 . . . . 55.51 109.628 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -90.32 3.2 4.94 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.646 2.231 . . . . 71.12 113.61 -177.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.6 mp -97.91 -18.89 18.42 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.369 0.507 . . . . 52.22 112.369 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 90.82 141.75 9.59 Favored Glycine 0 N--CA 1.444 -0.801 0 N-CA-C 110.06 -1.216 . . . . 25.31 110.06 -177.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.0 m 64.88 -168.86 0.21 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.45 0.7 . . . . 75.15 110.502 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.8 tmm? -122.11 89.71 3.17 Favored 'General case' 0 CA--C 1.487 -1.479 0 N-CA-C 108.369 -0.974 . . . . 74.35 108.369 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -168.19 23.46 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 114.352 -1.294 . . . . 73.4 109.495 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.455 ' HB3' ' HB ' ' A' ' 92' ' ' ILE . . . -77.63 -12.03 59.93 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.765 1.269 . . . . 52.24 108.788 178.197 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.413 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -66.65 -30.57 70.86 Favored 'General case' 0 N--CA 1.415 -2.224 0 CA-C-N 112.917 -1.947 . . . . 71.35 111.892 178.814 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.4 m -67.38 -37.79 83.7 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.638 0.732 . . . . 63.42 111.699 177.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.1 mp -84.63 -49.26 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.285 0 CA-C-N 115.168 -0.924 . . . . 73.31 112.015 -176.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -77.91 -36.16 49.84 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.977 -0.689 . . . . 74.14 112.302 -176.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt 60.09 106.91 0.02 OUTLIER 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.39 1.076 . . . . 72.33 113.856 -177.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -69.12 155.57 40.15 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.762 -0.653 . . . . 65.31 110.872 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -157.22 179.88 8.85 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.855 -0.612 . . . . 60.31 109.829 -174.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 mp0 -61.91 -34.68 76.5 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.441 0.697 . . . . 75.32 112.794 -175.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -59.7 -46.92 87.63 Favored 'General case' 0 CA--C 1.474 -1.978 0 CA-C-O 123.0 1.381 . . . . 75.34 109.513 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.448 HD21 HD12 ' A' ' 94' ' ' LEU . 3.2 tm? -65.84 -39.51 90.88 Favored 'General case' 0 N--CA 1.407 -2.625 0 CA-C-N 111.667 -2.515 . . . . 63.53 110.361 -174.696 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.475 ' CE3' HG12 ' A' ' 97' ' ' ILE . 61.3 t-105 -68.72 -45.75 70.74 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.824 0.345 . . . . 72.43 110.366 174.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.39 85.41 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.634 -0.712 . . . . 64.43 111.309 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.59 -47.34 70.22 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.019 0.528 . . . . 64.32 111.406 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -60.9 -49.99 75.24 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.005 -0.543 . . . . 71.52 110.076 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.797 -0.638 . . . . 64.14 111.443 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.551 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 40.1 mmt180 -72.01 -42.92 65.83 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 112.213 0.449 . . . . 74.35 112.213 -175.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.485 HD12 HD13 ' A' ' 84' ' ' LEU . 2.6 tm? -67.99 -38.23 82.44 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.407 -0.59 . . . . 72.25 109.407 -177.509 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.503 HD13 HD13 ' A' ' 33' ' ' LEU . 3.3 mt -71.98 -25.45 61.86 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 112.248 0.462 . . . . 61.41 112.248 176.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 t -69.38 -20.98 63.82 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.054 -1.091 . . . . 72.14 108.054 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.551 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.44 -2.56 51.65 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.584 -0.735 . . . . 64.34 109.956 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.437 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -138.32 52.39 4.69 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 115.686 -0.688 . . . . 73.25 111.682 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.1 Cg_exo -68.6 -22.36 38.2 Favored 'Trans proline' 0 C--N 1.364 1.346 0 N-CA-C 108.342 -1.446 . . . . 73.32 108.342 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -67.2 -44.62 79.14 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.01 -1.45 . . . . 72.25 110.375 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.419 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 64.3 t90 -74.31 -44.22 53.46 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 119.387 -0.925 . . . . 71.31 109.251 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.597 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.8 tp -57.74 -52.45 65.4 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.082 -1.417 . . . . 64.01 111.799 -175.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.479 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 15.0 p -51.52 -48.02 63.11 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 124.014 0.821 . . . . 72.52 111.807 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.36 85.01 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.878 0.871 . . . . 72.02 111.691 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 36' ' ' LYS . 24.7 mmmt -68.9 -38.47 79.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.71 -0.396 . . . . 71.24 111.638 177.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.631 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 99.0 mt -58.61 -30.95 67.64 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 123.335 0.654 . . . . 74.51 111.118 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 34' ' ' SER . 51.5 mtm180 -61.87 -30.97 71.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.743 0.417 . . . . 73.12 111.841 -178.126 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.7 t -84.08 -27.07 28.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.645 0.736 . . . . 62.5 110.185 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.459 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.6 m-85 -89.75 -54.74 3.93 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.631 -0.713 . . . . 75.13 112.518 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.565 HD22 ' SD ' ' A' ' 44' ' ' MET . 9.9 mp -87.49 121.22 71.23 Favored Pre-proline 0 C--N 1.311 -1.088 0 N-CA-C 112.627 0.603 . . . . 71.24 112.627 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -84.14 -15.9 6.43 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 C-N-CA 122.105 1.87 . . . . 74.23 110.49 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 t -115.15 27.83 9.12 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.292 -0.867 . . . . 64.11 110.004 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.637 ' HG2' HD23 ' A' ' 46' ' ' LEU . 5.3 tpt -58.2 111.4 1.19 Allowed 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 113.828 1.047 . . . . 73.21 113.828 -174.289 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -99.6 68.63 1.58 Allowed 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 107.663 -1.236 . . . . 70.33 107.663 174.25 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.637 HD23 ' HG2' ' A' ' 44' ' ' MET . 3.0 pp -95.1 -20.64 19.12 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 114.888 -1.051 . . . . 75.41 111.068 -174.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.51 -17.9 50.16 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.124 -0.944 . . . . 74.52 110.696 -174.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.9 m -93.32 74.87 4.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.771 -1.104 . . . . 54.44 112.06 -175.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 p -89.91 84.73 6.23 Favored 'General case' 0 N--CA 1.412 -2.369 0 CA-C-O 121.944 0.878 . . . . 74.23 110.009 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -28.64 68.72 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 114.713 -1.13 . . . . 72.33 111.563 177.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -123.53 164.34 29.03 Favored Pre-proline 1 N--CA 1.369 -4.481 0 N-CA-C 105.215 -2.142 . . . . 74.12 105.215 177.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.492 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 29.0 Cg_endo -65.68 -155.19 0.03 OUTLIER 'Trans proline' 0 CA--C 1.551 1.345 0 C-N-CA 122.562 2.175 . . . . 72.33 112.592 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.7 m -75.52 37.45 0.14 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.453 0.701 . . . . 72.24 110.739 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.492 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 5.0 m-20 -60.59 147.54 83.31 Favored Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 124.822 1.249 . . . . 74.42 113.227 -176.629 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -43.52 -50.52 6.82 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 124.411 3.407 . . . . 74.54 113.688 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -74.89 -18.96 60.34 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 113.407 0.892 . . . . 71.42 113.407 -178.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.473 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 90.5 t -75.43 -42.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 N-CA-C 107.611 -1.255 . . . . 71.22 107.611 175.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.4 mm -66.2 -42.03 90.35 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-N 115.09 -0.959 . . . . 72.43 108.854 175.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -54.52 -45.74 73.42 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 124.878 1.271 . . . . 73.41 112.854 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 57' ' ' VAL . 6.7 ptm180 -64.59 -31.55 72.82 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-N 118.549 0.613 . . . . 65.32 111.792 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.0 mt-30 -72.52 -44.01 62.79 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.574 0.702 . . . . 73.34 109.435 -177.287 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.11 -33.09 65.37 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.859 -1.064 . . . . 72.02 110.429 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.414 ' HA ' ' CD2' ' A' ' 66' ' ' PHE . 26.1 t-20 -56.83 -52.4 65.25 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 124.095 0.958 . . . . 74.14 109.854 175.027 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.517 ' CB ' HD21 ' A' ' 41' ' ' LEU . 21.8 mmt180 -56.71 -29.55 62.55 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.36 -1.291 . . . . 74.54 113.474 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.419 HD21 HD23 ' A' ' 37' ' ' LEU . 56.2 mt -68.79 -45.07 72.27 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 121.125 -0.23 . . . . 73.42 110.863 176.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.414 ' CD2' ' HA ' ' A' ' 63' ' ' ASN . 0.5 OUTLIER -70.3 -25.21 63.22 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 119.807 -0.757 . . . . 71.12 109.62 -179.54 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.19 -30.38 67.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.437 -0.801 . . . . 51.41 110.719 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.48 ' HB2' HG21 ' A' ' 72' ' ' THR . 42.1 mm-40 -66.35 -38.72 88.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 109.003 -0.74 . . . . 44.25 109.003 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -179.59 139.56 3.91 Favored Glycine 0 N--CA 1.404 -3.449 0 CA-C-N 114.575 -1.193 . . . . 53.5 111.29 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.579 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -66.01 -31.47 72.39 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.022 -1.844 . . . . 74.43 106.022 171.166 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.64 -41.84 44.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.059 -1.428 . . . . 63.51 108.975 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.48 HG21 ' HB2' ' A' ' 68' ' ' GLN . 89.6 m -53.35 -41.27 65.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.845 0.458 . . . . 65.15 110.276 175.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.9 t-105 -62.63 -50.98 69.1 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.693 -0.685 . . . . 73.42 110.358 177.263 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.579 ' HG3' ' O ' ' A' ' 70' ' ' MET . 87.5 mttt -55.42 -42.76 74.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.616 0.366 . . . . 65.33 111.374 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.9 m -66.12 -46.99 75.6 Favored 'General case' 0 N--CA 1.409 -2.5 0 C-N-CA 123.355 0.662 . . . . 75.5 110.674 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -57.14 -50.83 71.59 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.746 -0.661 . . . . 74.31 110.624 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.445 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 32.1 mm -59.76 -32.77 50.31 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.439 -0.8 . . . . 74.44 111.607 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -64.71 -43.53 93.16 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.568 -0.53 . . . . 74.33 109.568 177.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -72.24 -37.9 69.02 Favored 'General case' 0 C--O 1.189 -2.096 0 CA-C-N 116.403 -0.362 . . . . 73.04 110.385 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.0 tm? -49.53 -54.59 17.16 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 125.402 1.481 . . . . 75.12 110.135 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.8 m -67.82 -35.21 78.21 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 115.942 -0.572 . . . . 44.24 111.09 -178.016 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -75.81 -48.77 20.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.838 -0.619 . . . . 71.23 111.393 -176.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -71.33 -27.06 63.11 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 122.906 0.482 . . . . 75.32 111.755 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.485 HD13 HD12 ' A' ' 25' ' ' LEU . 85.8 mt -92.26 -3.54 55.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 116.192 -0.458 . . . . 63.25 109.955 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 t70 59.24 38.72 23.29 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.021 1.328 . . . . 61.31 111.551 174.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 m -120.0 105.44 42.64 Favored Pre-proline 0 C--N 1.304 -1.375 0 CA-C-N 115.245 -0.889 . . . . 71.4 111.241 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.75 102.64 1.34 Allowed 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 121.963 1.776 . . . . 64.42 108.959 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.2 mt -96.79 -14.94 21.6 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.437 0.532 . . . . 73.12 112.437 -173.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.7 t70 70.69 -64.84 0.36 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 124.709 1.204 . . . . 62.41 110.572 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.425 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . 23.9 ptp -77.31 35.11 0.17 Allowed 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.68 1.592 . . . . 63.02 112.411 -175.435 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.7 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 17.8 tt0 -58.9 -36.12 74.17 Favored 'General case' 0 C--O 1.186 -2.246 0 C-N-CA 125.831 1.652 . . . . 74.4 110.039 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.522 ' O ' HG22 ' A' ' 95' ' ' VAL . 47.1 mm -70.88 -45.29 15.72 Favored Pre-proline 0 C--O 1.176 -2.791 0 O-C-N 121.268 -0.895 . . . . 70.52 109.484 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.425 ' HG2' ' HB2' ' A' ' 90' ' ' MET . 21.4 Cg_exo -47.62 -38.21 28.31 Favored 'Trans proline' 0 CA--C 1.554 1.498 0 CA-C-N 121.2 1.464 . . . . 71.14 111.855 164.83 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 8.9 mp -59.6 -47.74 84.39 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 108.688 -0.856 . . . . 73.2 108.688 171.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 91' ' ' GLU . 3.7 m -64.91 -35.63 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 CA-C-O 122.267 1.032 . . . . 72.21 111.381 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.0 t -83.94 6.05 23.23 Favored 'General case' 0 C--N 1.276 -2.62 0 C-N-CA 125.715 1.606 . . . . 63.03 111.87 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.475 HG12 ' CE3' ' A' ' 19' ' ' TRP . 3.0 tp -65.47 -18.56 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 108.336 -0.987 . . . . 74.13 108.336 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 75.3 t90 -62.96 104.49 0.56 Allowed 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 125.541 1.536 . . . . 70.22 108.194 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 172.75 -168.09 41.08 Favored Glycine 0 C--N 1.286 -2.233 0 N-CA-C 110.039 -1.224 . . . . 43.1 110.039 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -90.82 38.99 0.34 Allowed 'Trans proline' 0 C--O 1.246 0.885 0 C-N-CA 123.241 2.627 . . . . 54.31 111.544 -178.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 . . . . . 0 N--CA 1.401 -2.882 0 CA-C-N 114.632 -1.167 . . . . 62.22 108.054 -178.109 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.173 0 N-CA-C 110.918 -0.873 . . . . 13.42 110.918 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -78.15 165.7 25.58 Favored 'Trans proline' 0 C--O 1.258 1.478 0 C-N-CA 121.94 1.76 . . . . 73.13 112.181 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.8 mt -92.22 -43.22 9.43 Favored 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 106.439 -1.689 . . . . 71.22 106.439 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.88 -92.04 0.24 Allowed Glycine 0 CA--C 1.499 -0.946 0 CA-C-N 114.897 -1.047 . . . . 73.41 110.644 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.3 m 71.55 -9.0 0.97 Allowed 'General case' 0 C--O 1.239 0.509 0 C-N-CA 124.858 1.263 . . . . 72.54 113.694 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.9 ttm 62.77 34.38 14.65 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 123.305 1.526 . . . . 64.3 107.466 -171.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -157.41 26.08 0.29 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.335 -2.211 . . . . 61.34 108.312 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.666 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -61.81 -13.34 23.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.286 -0.87 . . . . 70.34 112.955 -178.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.63 -37.62 84.63 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.652 0.781 . . . . 75.22 109.745 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.1 m -75.78 -17.66 59.79 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-N 114.051 -1.432 . . . . 70.22 110.541 -174.425 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.666 HG12 ' HA ' ' A' ' 8' ' ' ALA . 6.6 mm -87.6 -44.31 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 CA-C-N 115.412 -0.813 . . . . 71.24 110.247 -174.608 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -104.13 -45.33 4.75 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 114.431 1.271 . . . . 74.45 114.431 -174.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 54.91 83.64 0.08 Allowed 'General case' 0 C--N 1.344 0.368 0 N-CA-C 108.896 -0.779 . . . . 73.33 108.896 -166.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.474 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 5.5 t-20 -120.31 -168.51 1.64 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.122 -0.49 . . . . 72.34 110.109 -170.353 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.628 ' O ' HD12 ' A' ' 18' ' ' LEU . 5.6 t-20 -148.98 -173.05 4.26 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 109.19 -0.671 . . . . 74.35 109.19 -176.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -48.14 -27.48 2.39 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 128.192 2.597 . . . . 72.15 114.099 -171.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -57.98 -28.97 64.86 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 123.09 0.556 . . . . 73.41 110.975 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.643 ' HB2' ' SD ' ' A' ' 90' ' ' MET . 0.0 OUTLIER -62.17 -33.33 74.32 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.533 -0.758 . . . . 71.32 110.653 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.492 ' N ' HD13 ' A' ' 18' ' ' LEU . 75.9 t-105 -68.43 -32.43 72.46 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-N 115.672 -0.695 . . . . 72.31 110.117 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.95 -31.18 70.73 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.093 0.473 . . . . 45.34 109.971 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.581 ' CZ2' ' HG ' ' A' ' 25' ' ' LEU . 73.4 t90 -63.09 -50.07 71.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.635 -0.876 . . . . 73.51 108.635 173.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.06 -53.23 58.52 Favored 'General case' 0 CA--C 1.516 -0.361 0 O-C-N 124.509 1.13 . . . . 73.43 110.415 -176.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.8 t -53.82 -53.64 25.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 O-C-N 123.8 0.688 . . . . 72.25 112.052 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.503 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 26.6 mmt180 -74.57 -32.01 62.25 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 113.233 0.827 . . . . 64.1 113.233 -176.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.581 ' HG ' ' CZ2' ' A' ' 21' ' ' TRP . 1.8 tm? -70.59 -42.64 70.75 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.699 -0.852 . . . . 63.13 108.699 -178.521 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.513 HD13 HD23 ' A' ' 33' ' ' LEU . 1.2 mt -70.76 -24.63 62.64 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.924 -0.58 . . . . 22.13 111.185 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 p -69.71 -11.95 61.25 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.907 0.86 . . . . 64.24 108.854 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.9 mtmt -99.56 -9.87 22.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.307 -0.627 . . . . 62.41 109.307 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.441 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.3 m-80 -133.62 53.39 10.2 Favored Pre-proline 0 C--O 1.24 0.578 0 CA-C-N 115.664 -0.698 . . . . 72.53 111.934 -175.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -70.07 -22.19 31.01 Favored 'Trans proline' 0 C--N 1.363 1.335 0 N-CA-C 108.472 -1.395 . . . . 72.22 108.472 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.11 -41.86 85.49 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 113.325 -1.762 . . . . 72.25 109.929 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.493 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 73.5 t90 -73.83 -43.04 59.95 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 119.646 -0.822 . . . . 73.44 109.47 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.513 HD23 HD13 ' A' ' 26' ' ' LEU . 2.0 tm? -60.36 -43.26 96.71 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.105 -0.952 . . . . 74.1 110.344 -174.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 m -63.98 -35.16 79.77 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 120.799 0.333 . . . . 71.21 111.625 178.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.26 80.49 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 121.261 0.553 . . . . 32.24 110.172 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.5 mmtt -76.74 -40.61 47.95 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.117 -0.633 . . . . 74.53 112.609 173.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 78.0 mt -51.56 -41.7 61.32 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.189 0.596 . . . . 51.43 111.938 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.475 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 0.1 OUTLIER -59.54 -28.06 66.76 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.383 1.253 . . . . 74.43 114.383 -177.673 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.4 t -77.06 -40.45 46.22 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 115.745 -0.661 . . . . 64.41 110.133 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -81.84 -47.25 13.04 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 123.655 0.782 . . . . 74.54 112.637 -176.167 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 mp -80.9 124.89 81.17 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 123.379 0.672 . . . . 73.35 109.867 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -72.01 -36.47 5.88 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.045 2.497 . . . . 75.31 114.014 -177.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.5 p -106.12 -5.59 19.26 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.775 0.798 . . . . 71.23 110.316 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.475 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 2.0 mpp? 40.68 92.18 0.01 OUTLIER 'General case' 0 N--CA 1.408 -2.572 0 C-N-CA 127.69 2.396 . . . . 64.34 115.735 -175.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -101.62 70.03 1.25 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 122.733 1.254 . . . . 63.54 108.459 168.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -95.79 -5.13 42.59 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 113.146 -1.843 . . . . 63.21 110.607 -176.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -75.84 47.35 0.42 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.388 1.475 . . . . 71.24 110.436 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.4 m -86.08 -3.47 58.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.629 -0.714 . . . . 74.35 112.715 -176.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 50.7 m -82.95 65.39 8.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.769 0.795 . . . . 63.31 112.733 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.41 -28.22 37.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-O 122.921 1.343 . . . . 75.42 109.931 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.447 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 54.1 mt-10 -116.22 173.39 3.06 Favored Pre-proline 1 N--CA 1.375 -4.185 0 N-CA-C 104.919 -2.252 . . . . 73.44 104.919 175.91 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 50.8 Cg_endo -66.85 -156.52 0.03 OUTLIER 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 121.296 1.331 . . . . 64.14 112.074 175.115 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.6 m -76.1 38.4 0.17 Allowed 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.194 0.998 . . . . 62.11 112.417 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 57' ' ' VAL . 86.2 m-20 -60.08 148.39 77.96 Favored Pre-proline 0 N--CA 1.438 -1.054 0 C-N-CA 125.156 1.382 . . . . 74.52 112.308 -179.062 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.61 -32.93 97.74 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 123.129 2.553 . . . . 65.11 112.781 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.2 mp0 -68.95 -40.39 78.96 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.591 -0.892 . . . . 61.03 108.591 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.412 HG23 ' HB2' ' A' ' 54' ' ' ASN . 78.1 t -63.59 -48.57 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 CA-C-N 114.191 -1.368 . . . . 54.51 109.234 178.531 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.4 mm -59.81 -46.58 93.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.223 -0.899 . . . . 61.51 110.443 177.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -57.15 -38.8 74.08 Favored 'General case' 0 C--O 1.202 -1.406 0 CA-C-O 119.404 -0.331 . . . . 60.13 111.59 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 46.5 ttt180 -61.39 -40.56 94.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.851 0.834 . . . . 74.34 111.281 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -67.23 -47.15 71.67 Favored 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.434 -1.257 . . . . 74.31 110.317 -177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.94 -31.04 67.52 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.553 -1.203 . . . . 73.44 111.151 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 59.5 t30 -54.78 -51.13 66.72 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 124.616 1.166 . . . . 71.42 110.015 176.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -55.14 -31.33 61.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.66 -1.154 . . . . 70.35 113.077 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.8 mt -72.64 -43.73 62.84 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 112.273 0.472 . . . . 64.14 112.273 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -69.96 -25.61 63.72 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.717 -0.846 . . . . 74.1 108.717 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.02 -31.27 68.83 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.338 -0.846 . . . . 73.04 110.832 174.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.44 ' HB2' HG21 ' A' ' 72' ' ' THR . 48.5 mm-40 -68.21 -41.6 81.08 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 109.049 -0.723 . . . . 72.42 109.049 176.078 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.79 142.34 4.79 Favored Glycine 0 N--CA 1.421 -2.328 0 CA-C-N 114.986 -1.006 . . . . 64.24 112.365 -177.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.2 ptm -69.17 -26.57 64.92 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 106.498 -1.667 . . . . 64.12 106.498 170.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.415 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . . . -75.67 -46.9 28.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 113.684 -1.598 . . . . 74.34 108.004 175.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.44 HG21 ' HB2' ' A' ' 68' ' ' GLN . 84.9 m -53.55 -41.72 66.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.836 0.71 . . . . 75.31 110.339 177.153 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.574 ' O ' HG12 ' A' ' 77' ' ' ILE . 75.9 t-105 -60.17 -49.43 77.67 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.424 -0.807 . . . . 74.23 111.466 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.415 ' HE3' ' HA ' ' A' ' 71' ' ' ALA . 9.4 ptpt -69.59 -35.02 74.94 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 121.134 0.492 . . . . 53.2 111.479 -174.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.0 m -67.58 -42.45 82.49 Favored 'General case' 0 N--CA 1.405 -2.712 0 CA-C-N 115.632 -0.713 . . . . 35.11 110.361 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.4 -49.62 75.62 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.601 0.761 . . . . 73.14 111.522 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.599 HG21 ' HB2' ' A' ' 94' ' ' LEU . 47.2 mm -59.0 -33.87 51.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.466 -0.788 . . . . 74.25 111.852 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.1 -39.02 93.15 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.965 0.412 . . . . 70.23 110.266 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.447 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 2.4 m-20 -74.51 -36.01 63.2 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.942 0.401 . . . . 65.43 110.474 176.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.496 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.0 tm? -54.4 -54.54 39.2 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.715 1.206 . . . . 71.54 110.225 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 29.9 p -66.9 -32.67 74.07 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.81 -0.632 . . . . 74.23 111.394 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -71.27 -54.75 9.79 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.04 -0.982 . . . . 74.12 111.926 -176.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 19.8 mt-10 -73.31 -22.28 60.37 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 112.52 0.563 . . . . 71.41 112.52 -171.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.9 mt -86.97 -2.26 58.48 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.492 -0.483 . . . . 63.24 111.548 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 t70 72.9 -32.02 0.24 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 114.546 1.313 . . . . 70.52 114.546 174.754 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.46 ' O ' HD23 ' A' ' 88' ' ' LEU . 61.4 t -48.68 124.43 12.24 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 124.367 1.067 . . . . 65.4 111.891 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -80.27 44.01 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.462 2.774 . . . . 75.4 111.696 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.539 ' H ' HD23 ' A' ' 88' ' ' LEU . 2.0 pt? -62.88 -48.47 78.83 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.506 -0.315 . . . . 54.13 111.326 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.471 ' O ' ' HB1' ' A' ' 8' ' ' ALA . 48.2 m-20 56.3 31.27 18.25 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.139 0.971 . . . . 65.32 111.856 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.643 ' SD ' ' HB2' ' A' ' 18' ' ' LEU . 50.4 mtt -99.76 13.99 31.78 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.116 -1.068 . . . . 64.13 108.116 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.669 ' O ' HG13 ' A' ' 95' ' ' VAL . 3.3 tt0 -47.14 -60.92 2.15 Favored 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 125.184 1.394 . . . . 51.5 113.35 -174.149 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -64.14 -44.03 75.9 Favored Pre-proline 0 C--O 1.201 -1.48 0 CA-C-N 119.111 0.869 . . . . 61.11 111.717 -178.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -48.37 -35.49 27.98 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 121.476 1.451 . . . . 70.55 111.763 170.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.599 ' HB2' HG21 ' A' ' 77' ' ' ILE . 3.3 mm? -67.98 -51.97 41.23 Favored 'General case' 0 C--O 1.202 -1.406 0 N-CA-C 109.078 -0.712 . . . . 71.54 109.078 169.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.669 HG13 ' O ' ' A' ' 91' ' ' GLU . 2.7 m -60.44 -37.57 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-O 122.062 0.934 . . . . 73.12 113.204 -171.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.1 t -93.52 6.17 49.11 Favored 'General case' 0 C--N 1.26 -3.312 0 CA-C-N 114.146 -1.388 . . . . 71.43 111.774 -174.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.433 HG22 ' O ' ' A' ' 94' ' ' LEU . 8.3 tt -55.24 -39.73 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 112.833 0.679 . . . . 64.24 112.833 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 43.7 m95 -112.21 163.86 13.86 Favored 'General case' 0 N--CA 1.411 -2.377 0 N-CA-C 107.608 -1.256 . . . . 73.51 107.608 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.51 143.17 10.02 Favored Glycine 0 C--N 1.272 -2.995 0 CA-C-N 115.584 -0.734 . . . . 73.21 111.279 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.31 44.3 1.02 Allowed 'Trans proline' 0 N--CA 1.484 0.944 0 C-N-CA 123.724 2.949 . . . . 73.54 112.495 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 . . . . . 0 N--CA 1.402 -2.835 0 N-CA-C 106.971 -1.492 . . . . 73.22 106.971 -179.673 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.698 0 N-CA-C 111.759 -0.537 . . . . 60.24 111.759 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -57.89 129.11 31.73 Favored 'Trans proline' 0 N--CA 1.479 0.633 0 C-N-CA 123.579 2.852 . . . . 52.33 113.873 -177.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.5 mt -125.62 173.59 8.87 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.935 -0.575 . . . . 65.24 109.89 177.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 78.09 -70.82 2.51 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.931 -0.868 . . . . 73.32 110.931 -176.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 43.3 m -108.86 122.07 46.42 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 107.644 -1.243 . . . . 61.21 107.644 176.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.521 ' O ' ' HG3' ' A' ' 9' ' ' GLU . 2.2 mpt? -118.37 12.38 13.33 Favored 'General case' 0 C--O 1.206 -1.223 0 N-CA-C 111.961 0.356 . . . . 65.01 111.961 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.33 25.33 1.21 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 113.328 0.862 . . . . 71.43 113.328 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.505 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.21 -15.7 58.56 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-O 121.821 0.82 . . . . 60.24 108.987 172.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.541 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -56.68 -41.36 77.16 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.643 1.177 . . . . 74.21 114.001 -179.251 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.572 ' HB2' HD12 ' A' ' 11' ' ' ILE . 74.7 m -55.06 -36.64 65.81 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 125.058 1.343 . . . . 64.15 110.36 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.572 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -81.73 -29.71 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.969 0 C-N-CA 125.164 1.386 . . . . 64.45 109.672 -175.394 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -76.6 -64.88 1.02 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.87 -0.604 . . . . 73.53 112.486 -177.243 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -175.42 -75.98 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 110.048 -0.353 . . . . 73.33 110.048 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.6 t30 65.31 109.12 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.377 1.071 . . . . 73.11 111.644 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.471 ' H ' HD23 ' A' ' 18' ' ' LEU . 28.0 t-20 -172.78 163.4 5.07 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 122.358 -0.214 . . . . 74.23 110.463 -176.537 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.04 -27.88 35.03 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.519 1.528 . . . . 73.02 111.472 177.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.2 -28.13 62.59 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 112.599 0.592 . . . . 61.12 112.599 177.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.632 HD12 HD22 ' A' ' 94' ' ' LEU . 3.6 mm? -71.1 -34.59 71.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.219 0.533 . . . . 71.02 109.741 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.454 ' HB2' HD11 ' A' ' 97' ' ' ILE . 74.2 t-105 -65.98 -42.34 89.98 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.401 -0.818 . . . . 75.13 110.236 -178.026 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.72 -42.65 97.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.061 -0.518 . . . . 72.43 110.35 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -59.41 -50.44 73.93 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.103 -0.499 . . . . 74.21 110.531 176.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.446 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -57.3 -53.31 59.61 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.94 0.775 . . . . 75.43 109.551 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.36 -46.96 94.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 112.849 0.685 . . . . 62.2 112.849 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -72.3 -36.79 69.03 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 112.301 0.482 . . . . 72.1 112.301 -174.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.67 -40.8 63.41 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.943 -0.762 . . . . 62.13 108.943 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.569 HD13 HD23 ' A' ' 33' ' ' LEU . 3.6 mt -71.36 -24.14 62.04 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 112.656 0.613 . . . . 73.2 112.656 178.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.0 t -62.81 -20.96 65.54 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.275 -1.009 . . . . 61.21 108.275 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -97.46 -0.05 46.8 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.061 0.458 . . . . 62.11 110.218 177.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.415 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.2 m-80 -139.36 54.66 6.22 Favored Pre-proline 0 C--O 1.245 0.825 0 C-N-CA 122.886 0.474 . . . . 73.51 111.352 -177.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.415 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -71.22 -21.66 26.67 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.247 1.298 . . . . 74.3 108.808 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -71.71 -36.61 70.59 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 113.625 -1.625 . . . . 72.21 110.437 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.468 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 82.0 t90 -75.0 -48.09 25.85 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 119.518 -0.873 . . . . 72.32 110.016 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.569 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -56.76 -45.65 81.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.822 -1.081 . . . . 70.54 111.172 -172.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.516 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 10.6 p -57.81 -44.93 86.71 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.126 -0.488 . . . . 74.11 112.21 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.87 -44.35 78.03 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 124.106 0.963 . . . . 51.42 111.598 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 70.7 mmtt -71.38 -29.67 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.933 -0.307 . . . . 74.23 111.548 176.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.6 mt -62.7 -36.07 81.74 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 110.263 -0.273 . . . . 73.43 110.263 174.474 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -63.39 -35.22 79.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.63 0.729 . . . . 51.05 109.769 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.8 m -71.91 -47.47 52.33 Favored 'General case' 0 N--CA 1.392 -3.374 0 C-N-CA 124.883 1.273 . . . . 71.13 111.902 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.529 ' CD1' HG23 ' A' ' 72' ' ' THR . 52.8 m-85 -84.61 -46.48 11.48 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 114.059 1.133 . . . . 73.14 114.059 -174.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 1.9 mm? -95.85 112.83 60.61 Favored Pre-proline 0 N--CA 1.424 -1.739 0 C-N-CA 122.317 0.247 . . . . 74.51 110.423 -175.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.83 -37.9 18.97 Favored 'Trans proline' 0 C--O 1.217 -0.542 0 C-N-CA 122.303 2.002 . . . . 72.44 111.193 178.411 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.8 t -103.95 30.15 5.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.613 -0.722 . . . . 73.3 110.787 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.555 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -43.61 131.78 5.06 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 115.294 1.59 . . . . 71.25 115.294 178.343 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -124.81 59.77 1.2 Allowed 'General case' 0 C--N 1.276 -2.598 0 CA-C-N 114.499 -1.228 . . . . 73.22 109.198 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.2 pp -84.55 -16.53 41.93 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.336 -1.302 . . . . 65.14 110.079 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.35 -18.14 62.39 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 114.927 -1.033 . . . . 73.22 110.124 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.9 m -80.69 84.4 6.25 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 114.511 -1.222 . . . . 52.21 108.87 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 m -117.19 78.41 1.22 Allowed 'General case' 0 N--CA 1.424 -1.769 0 CA-C-O 121.915 0.864 . . . . 74.04 109.792 -177.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -63.89 1.14 Allowed 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 113.543 -1.662 . . . . 62.4 111.334 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.41 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 10.4 mm-40 -99.78 162.02 22.49 Favored Pre-proline 1 C--N 1.237 -4.313 0 CA-C-N 113.823 -1.535 . . . . 74.52 109.372 -179.492 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 17.8 Cg_endo -62.66 -150.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.561 1.84 0 C-N-CA 124.085 3.19 . . . . 73.34 113.154 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 m -75.34 37.79 0.13 Allowed 'General case' 0 CA--C 1.572 1.795 0 C-N-CA 123.655 0.782 . . . . 64.21 112.365 -175.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.493 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 6.0 m-20 -65.54 150.25 96.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 C-N-CA 125.926 1.69 . . . . 73.45 112.687 -178.162 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.3 -47.48 27.19 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.717 2.944 . . . . 71.1 113.382 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.428 ' HA ' ' HB3' ' A' ' 59' ' ' HIS . 70.8 mm-40 -71.76 -25.73 62.15 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 112.971 0.73 . . . . 72.44 112.971 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.528 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 95.7 t -66.21 -42.97 92.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.196 0 N-CA-C 108.485 -0.932 . . . . 53.34 108.485 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.411 ' O ' HD23 ' A' ' 62' ' ' LEU . 49.4 mm -67.14 -46.01 85.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.051 -0.977 . . . . 64.0 109.215 175.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 56' ' ' GLU . 20.2 t-160 -54.22 -40.1 67.34 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.114 0.966 . . . . 72.44 110.981 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -54.98 -55.69 27.99 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.768 0.794 . . . . 73.13 110.712 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 60.4 mt-30 -62.26 -34.69 77.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.256 -1.338 . . . . 74.45 110.932 -176.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.508 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -77.04 -35.6 56.76 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-N 114.903 -1.044 . . . . 73.15 111.926 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.426 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 46.1 t-20 -57.46 -35.88 70.72 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.227 1.011 . . . . 50.2 108.695 177.321 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.55 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 12.5 mmt180 -55.37 -42.72 74.33 Favored 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.486 -1.233 . . . . 70.35 111.534 175.764 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.508 HD12 HD13 ' A' ' 62' ' ' LEU . 78.6 mt -72.22 -33.7 67.77 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.026 0.441 . . . . 72.23 110.085 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.543 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 90.5 t80 -58.34 -31.17 67.33 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.839 -1.073 . . . . 71.41 109.482 174.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.59 -34.19 53.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.445 -0.798 . . . . 40.25 111.54 177.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -67.39 -56.7 8.63 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.116 0.413 . . . . 74.12 112.116 -178.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.67 143.46 5.26 Favored Glycine 0 CA--C 1.474 -2.519 0 C-N-CA 120.005 -1.093 . . . . 44.52 113.299 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.53 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.6 ptt? -70.61 -28.48 64.88 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 107.106 -1.442 . . . . 72.01 107.106 169.794 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.73 -35.78 65.1 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 114.41 -1.268 . . . . 74.23 107.949 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.529 HG23 ' CD1' ' A' ' 40' ' ' PHE . 98.9 m -65.8 -38.9 90.21 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.616 -1.175 . . . . 75.32 109.747 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.624 ' HD1' HG23 ' A' ' 95' ' ' VAL . 36.9 t-105 -64.37 -42.11 96.36 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 108.921 -0.77 . . . . 75.41 108.921 177.923 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.835 ' HA ' HG21 ' A' ' 95' ' ' VAL . 93.5 mttt -55.76 -51.78 66.21 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.583 0.353 . . . . 65.52 110.87 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.4 m -61.89 -39.75 93.06 Favored 'General case' 0 N--CA 1.408 -2.539 0 C-N-CA 123.761 0.824 . . . . 51.22 110.719 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -62.8 -52.96 61.15 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.826 -1.079 . . . . 74.24 111.618 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 73' ' ' TRP . 27.0 mm -69.13 -32.07 52.59 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 119.843 -0.743 . . . . 63.41 110.352 -175.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -57.04 -52.15 66.4 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.893 -1.049 . . . . 72.32 108.807 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 4.7 m-20 -67.42 -38.44 84.6 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 115.312 -0.858 . . . . 70.12 111.648 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.469 HD21 HD21 ' A' ' 26' ' ' LEU . 2.6 tm? -51.16 -55.62 16.94 Favored 'General case' 0 C--N 1.311 -1.096 0 C-N-CA 124.711 1.204 . . . . 75.45 110.502 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.565 ' SG ' ' HB3' ' A' ' 91' ' ' GLU . 56.1 m -68.54 -32.93 73.21 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.872 -0.603 . . . . 64.41 111.204 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -70.98 -46.27 62.61 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.557 -0.747 . . . . 75.22 112.048 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 15.1 mt-10 -83.8 -19.62 34.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 113.175 0.806 . . . . 74.43 113.175 -173.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 72.7 mt -79.93 33.32 0.27 Allowed 'General case' 0 C--O 1.243 0.728 0 N-CA-C 113.145 0.794 . . . . 75.22 113.145 -177.128 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 76.32 -27.12 0.18 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.906 1.682 . . . . 51.32 114.27 171.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.8 p -136.93 105.8 8.85 Favored Pre-proline 0 C--N 1.296 -1.75 0 CA-C-O 120.953 0.406 . . . . 72.52 111.503 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.8 83.7 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.014 1.809 . . . . 70.32 109.675 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.17 -6.96 54.93 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.627 1.343 . . . . 45.21 114.627 -175.853 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.9 t70 54.46 81.19 0.11 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.983 1.475 . . . . 74.14 114.983 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.457 ' O ' HD23 ' A' ' 94' ' ' LEU . 24.1 ptm -153.11 22.37 0.56 Allowed 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 105.546 -2.02 . . . . 62.23 105.546 172.828 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.565 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 9.2 pt-20 -70.54 -36.32 73.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 112.77 -2.014 . . . . 55.53 111.512 -173.439 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.77 ' HA ' HG12 ' A' ' 95' ' ' VAL . 47.2 mm -69.39 -49.13 23.98 Favored Pre-proline 0 C--N 1.277 -2.567 0 CA-C-N 115.977 -0.556 . . . . 73.04 110.793 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -50.72 -44.47 40.61 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.091 1.861 . . . . 65.41 111.54 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.632 HD22 HD12 ' A' ' 18' ' ' LEU . 4.2 mm? -62.76 -39.19 93.4 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.642 0.608 . . . . 55.01 112.642 175.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.835 HG21 ' HA ' ' A' ' 74' ' ' LYS . 5.7 p -75.5 -32.64 25.52 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.122 0 CA-C-O 122.131 0.967 . . . . 45.21 113.105 -177.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.535 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . 21.9 t -58.67 -20.21 46.19 Favored 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 114.075 -1.42 . . . . 63.44 111.521 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 19' ' ' TRP . 3.6 tt -67.58 -16.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 116.183 -0.462 . . . . 62.54 111.664 -175.91 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.543 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 61.4 t90 -60.98 105.5 0.48 Allowed 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.311 -0.626 . . . . 73.51 109.311 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 126.56 89.57 0.72 Allowed Glycine 0 N--CA 1.416 -2.694 0 N-CA-C 110.654 -0.978 . . . . 71.52 110.654 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.72 85.45 1.73 Allowed 'Trans proline' 0 N--CA 1.437 -1.85 0 C-N-CA 122.366 2.044 . . . . 71.02 110.151 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 3.9 ppt_? . . . . . 0 N--CA 1.424 -1.77 0 CA-C-N 114.857 -1.065 . . . . 73.21 110.349 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.467 0 N-CA-C 110.199 -1.16 . . . . 54.23 110.199 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -67.18 151.47 81.21 Favored 'Trans proline' 0 C--O 1.246 0.885 0 C-N-CA 122.911 2.408 . . . . 73.51 111.7 177.192 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.82 101.44 12.82 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.05 0.452 . . . . 71.14 111.093 -176.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.86 -85.01 1.29 Allowed Glycine 0 N--CA 1.436 -1.302 0 C-N-CA 121.04 -0.6 . . . . 75.43 112.364 178.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.2 m -75.74 94.9 3.34 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-O 121.69 0.757 . . . . 53.31 110.39 -178.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.6 ptp -119.91 -6.96 10.02 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 114.587 -1.188 . . . . 55.41 109.135 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.65 71.99 1.43 Allowed 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 126.208 1.803 . . . . 73.12 112.749 -171.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.24 -34.41 49.18 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 114.422 -1.263 . . . . 65.35 110.188 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.517 ' CD ' ' HB3' ' A' ' 96' ' ' SER . 0.0 OUTLIER -57.53 -31.46 66.1 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 124.079 0.951 . . . . 74.4 111.288 -178.036 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.6 m -60.29 -30.14 69.29 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 125.043 1.337 . . . . 73.35 111.089 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.1 mp -87.36 -20.43 7.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 114.512 -1.222 . . . . 72.3 109.824 -176.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.582 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.6 mmm180 -107.38 -66.69 1.01 Allowed 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 112.706 0.632 . . . . 74.52 112.706 -177.005 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 12' ' ' ARG . 11.4 mt 170.63 173.84 0.07 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.089 1.756 . . . . 63.41 110.562 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.7 p30 -160.19 170.29 21.47 Favored 'General case' 0 C--O 1.252 1.231 0 N-CA-C 107.208 -1.404 . . . . 75.02 107.208 172.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.465 ' H ' HD23 ' A' ' 18' ' ' LEU . 28.3 t-20 -160.45 167.86 26.37 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 118.096 0.407 . . . . 73.42 110.839 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.59 -28.07 12.99 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 126.073 1.749 . . . . 72.45 112.717 178.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 -57.03 -29.33 63.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.192 -0.458 . . . . 73.04 111.588 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.465 HD23 ' H ' ' A' ' 15' ' ' ASN . 4.0 mm? -65.33 -43.15 91.87 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.185 0.517 . . . . 62.23 110.362 177.032 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -69.22 -46.44 67.38 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.305 -0.861 . . . . 75.2 110.706 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.79 97.97 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 44.12 111.443 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 -56.48 -49.31 75.03 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.025 -0.534 . . . . 71.43 110.537 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.4 tm? -60.8 -53.29 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 123.834 0.709 . . . . 62.4 110.211 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.14 -50.3 78.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 112.612 0.597 . . . . 75.44 112.612 -176.521 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.522 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 5.1 tpm_? -72.65 -33.73 66.8 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.973 -0.291 . . . . 73.14 110.54 -175.044 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.443 HD22 ' HE2' ' A' ' 28' ' ' LYS . 1.9 tm? -69.81 -44.88 69.12 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.548 -0.908 . . . . 64.33 108.548 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.673 HD13 HD23 ' A' ' 33' ' ' LEU . 3.6 mt -71.44 -24.48 62.03 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.604 -0.725 . . . . 55.55 112.118 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 p -67.81 -15.67 63.74 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 108.766 -0.827 . . . . 75.35 108.766 177.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 34.6 mtmt -97.39 -4.1 39.02 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 121.729 0.776 . . . . 74.24 109.39 179.154 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.442 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.1 m-80 -138.78 54.92 7.12 Favored Pre-proline 0 C--O 1.243 0.73 0 CA-C-N 115.128 -0.942 . . . . 65.23 110.638 -176.077 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 9.2 Cg_exo -72.29 -21.22 23.49 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 121.437 1.425 . . . . 54.41 108.698 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -71.68 -39.76 70.04 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 114.224 -1.353 . . . . 52.53 109.944 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.61 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 72.2 t90 -74.2 -42.7 59.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.242 -0.983 . . . . 74.01 109.823 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.673 HD23 HD13 ' A' ' 26' ' ' LEU . 2.2 tm? -62.93 -44.57 95.7 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.074 -0.966 . . . . 75.01 110.654 -174.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.57 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 15.8 p -57.89 -47.68 82.07 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.652 0.263 . . . . 73.3 111.524 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.63 67.98 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 124.315 1.046 . . . . 64.52 111.468 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.61 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 32.8 mmmt -72.09 -32.82 67.37 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 120.642 -0.423 . . . . 73.12 111.058 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.3 mt -61.88 -32.9 73.3 Favored 'General case' 0 C--O 1.191 -1.976 0 N-CA-C 109.894 -0.41 . . . . 64.32 109.894 174.366 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.57 ' HG3' ' O ' ' A' ' 34' ' ' SER . 39.8 mtt180 -64.67 -28.64 69.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.08 0.467 . . . . 74.33 110.885 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.6 t -84.72 -41.38 16.28 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.463 -0.79 . . . . 71.3 110.563 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.526 ' CD1' HG23 ' A' ' 72' ' ' THR . 66.7 m-85 -82.22 -46.24 13.99 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.781 0.66 . . . . 75.04 112.781 -177.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 7.0 mp -88.6 120.49 70.26 Favored Pre-proline 0 C--N 1.305 -1.345 0 C-N-CA 124.02 0.928 . . . . 75.14 110.107 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.14 -24.39 12.64 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 121.914 1.743 . . . . 64.35 111.113 177.308 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.4 p -114.97 28.51 8.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 123.809 0.844 . . . . 71.42 110.945 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.523 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.4 98.81 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.693 1.368 . . . . 63.33 114.693 -174.95 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -103.33 72.87 1.18 Allowed 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.899 1.333 . . . . 65.03 107.44 176.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.408 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 4.1 pp -96.14 -12.5 24.64 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 113.375 -1.738 . . . . 62.05 113.538 -173.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -83.4 -11.15 57.91 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.468 0.651 . . . . 74.24 111.131 -174.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.6 t -72.78 106.75 4.87 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 115.023 -0.989 . . . . 71.24 109.216 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.8 p -139.23 87.13 2.17 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.913 0.863 . . . . 70.3 112.001 -177.217 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.32 -25.85 60.81 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.645 -1.161 . . . . 70.22 112.116 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -129.63 161.86 56.64 Favored Pre-proline 0 N--CA 1.381 -3.889 0 CA-C-N 113.629 -1.623 . . . . 61.52 107.446 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.44 ' HB2' ' H ' ' A' ' 53' ' ' SER . 36.3 Cg_endo -68.37 -148.85 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.928 2.419 . . . . 70.23 111.617 173.39 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.44 ' H ' ' HB2' ' A' ' 52' ' ' PRO . 6.1 m -75.27 37.86 0.13 Allowed 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 124.419 1.088 . . . . 60.21 112.705 -175.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.555 ' HB2' HG23 ' A' ' 57' ' ' VAL . 7.3 m-20 -58.05 147.04 66.72 Favored Pre-proline 0 N--CA 1.436 -1.166 0 C-N-CA 125.025 1.33 . . . . 73.02 111.27 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -53.35 -34.9 72.82 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 123.892 3.062 . . . . 52.33 112.377 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -73.23 -39.95 65.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.79 -0.641 . . . . 75.32 109.341 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.555 HG23 ' HB2' ' A' ' 54' ' ' ASN . 96.3 t -67.46 -44.69 86.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.618 -1.174 . . . . 75.11 109.248 -178.598 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.412 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.3 mm -63.44 -43.45 98.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.457 -0.792 . . . . 70.22 109.669 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 12.8 t-160 -58.13 -37.28 74.32 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 116.229 -0.442 . . . . 75.31 111.128 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.94 -44.84 96.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.315 0.578 . . . . 74.33 111.109 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.423 HE21 HG12 ' A' ' 57' ' ' VAL . 70.3 mt-30 -64.52 -47.08 80.2 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.144 -0.935 . . . . 52.45 110.115 -178.299 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 58' ' ' ILE . 4.3 mm? -68.83 -30.77 69.39 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.326 -1.306 . . . . 54.11 111.656 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 4.7 t30 -61.26 -37.39 82.96 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 123.853 0.861 . . . . 74.21 109.62 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -59.37 -31.36 69.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.868 -1.06 . . . . 44.22 112.041 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.18 -43.73 64.11 Favored 'General case' 0 CA--C 1.501 -0.916 0 N-CA-C 109.635 -0.506 . . . . 63.22 109.635 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -61.04 -39.54 90.2 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.409 -0.96 . . . . 62.41 108.409 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.42 66.12 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.918 -1.037 . . . . 74.42 111.957 177.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.478 ' HB2' HG21 ' A' ' 72' ' ' THR . 9.1 mm-40 -81.45 -50.24 9.67 Favored 'General case' 0 N--CA 1.415 -2.175 0 N-CA-C 108.605 -0.887 . . . . 70.12 108.605 173.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.421 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -179.02 143.23 5.69 Favored Glycine 0 CA--C 1.477 -2.29 0 CA-C-N 115.508 -0.769 . . . . 72.33 112.563 -175.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -26.77 64.01 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 106.772 -1.566 . . . . 74.41 106.772 170.256 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.39 -36.96 68.8 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.121 -1.4 . . . . 72.34 108.201 174.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.526 HG23 ' CD1' ' A' ' 40' ' ' PHE . 53.0 m -62.39 -33.94 75.74 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.916 -1.038 . . . . 60.33 110.733 177.216 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -66.48 -38.58 87.62 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.323 -0.621 . . . . 74.4 109.323 178.152 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.967 ' HA ' HG21 ' A' ' 95' ' ' VAL . 8.8 mtmt -68.31 -32.23 72.21 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 113.205 0.817 . . . . 65.34 113.205 176.64 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.3 m -68.33 -38.15 81.26 Favored 'General case' 0 N--CA 1.402 -2.837 0 CA-C-O 121.953 0.882 . . . . 74.21 109.063 171.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -65.52 -53.84 36.66 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 114.365 -1.289 . . . . 53.24 112.966 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -64.04 -32.14 56.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.993 0 CA-C-N 118.611 0.642 . . . . 74.23 111.245 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.15 -42.39 99.21 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.4 -0.818 . . . . 70.25 109.331 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.478 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 83.1 m-20 -74.94 -41.19 60.12 Favored 'General case' 0 C--O 1.193 -1.878 0 CA-C-N 115.959 -0.564 . . . . 72.41 111.175 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.448 HD21 HD21 ' A' ' 26' ' ' LEU . 2.4 tm? -50.12 -53.98 23.71 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 125.454 1.502 . . . . 64.14 110.505 -179.204 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.407 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 50.8 t -66.76 -34.43 77.82 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.207 -0.906 . . . . 52.22 110.702 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -75.75 -50.19 15.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.333 -0.849 . . . . 74.03 112.381 -175.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 36.1 mt-10 -75.32 -28.36 59.62 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 112.196 0.443 . . . . 71.01 112.196 -173.039 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.8 mt -85.16 -13.64 49.48 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.261 -0.644 . . . . 70.23 109.261 176.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.7 t70 54.01 57.84 5.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.261 1.424 . . . . 74.11 110.743 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 6.0 m -134.52 108.09 11.05 Favored Pre-proline 0 C--N 1.301 -1.529 0 CA-C-N 114.012 -1.449 . . . . 61.43 109.392 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -63.43 111.0 1.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.279 1.986 . . . . 70.21 109.66 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.407 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 41.2 mt -82.91 -39.8 21.02 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.852 -0.739 . . . . 74.14 109.272 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 62.19 12.25 4.98 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.228 1.011 . . . . 63.21 110.688 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.41 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 18.8 ttt -157.25 34.26 0.28 Allowed 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 106.949 -1.5 . . . . 74.34 106.949 -176.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.97 -34.5 71.48 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-N 114.458 -1.246 . . . . 74.01 109.632 -179.041 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.54 ' HA ' HG12 ' A' ' 95' ' ' VAL . 49.0 mm -63.35 -50.5 73.93 Favored Pre-proline 0 C--N 1.288 -2.074 0 CA-C-N 115.319 -0.855 . . . . 54.14 111.989 -177.304 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.501 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 50.4 Cg_exo -58.7 -24.38 70.7 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 121.782 1.654 . . . . 65.34 111.756 172.303 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.401 ' O ' HG22 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -74.4 -31.95 62.52 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.898 -1.149 . . . . 71.11 107.898 177.409 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.967 HG21 ' HA ' ' A' ' 74' ' ' LYS . 9.0 p -88.2 -46.72 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.949 0 N-CA-C 113.949 1.092 . . . . 62.04 113.949 -178.361 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.517 ' HB3' ' CD ' ' A' ' 9' ' ' GLU . 4.0 t -78.73 3.44 16.56 Favored 'General case' 0 C--N 1.27 -2.871 0 CA-C-N 115.627 -0.715 . . . . 65.42 110.846 -175.439 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.434 HG23 ' CD1' ' A' ' 98' ' ' TRP . 17.2 tt -56.81 -40.01 68.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.347 0.659 . . . . 70.54 109.952 176.765 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.434 ' CD1' HG23 ' A' ' 97' ' ' ILE . 46.6 m95 -127.49 14.11 7.08 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.924 -0.769 . . . . 75.32 108.924 178.208 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -92.71 -134.69 6.87 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.695 -0.684 . . . . 62.25 112.341 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -71.71 153.2 59.41 Favored 'Trans proline' 0 C--N 1.328 -0.509 0 C-N-CA 122.87 2.38 . . . . 75.53 111.835 177.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 . . . . . 0 N--CA 1.426 -1.633 0 N-CA-C 108.063 -1.088 . . . . 74.21 108.063 178.018 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.444 0 N-CA-C 110.593 -1.003 . . . . 65.02 110.593 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -86.0 1.5 7.9 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.383 2.055 . . . . 73.43 113.458 -178.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.6 mp 65.34 93.05 0.07 Allowed 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.155 0.982 . . . . 74.41 111.509 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.57 -46.1 4.72 Favored Glycine 0 N--CA 1.436 -1.301 0 N-CA-C 110.902 -0.879 . . . . 74.22 110.902 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.4 m -85.14 91.14 8.04 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.881 -0.785 . . . . 61.42 108.881 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 53.1 tpp -89.68 -13.48 36.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.785 0.803 . . . . 75.13 110.639 -174.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.08 24.99 12.34 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.729 -0.669 . . . . 62.11 109.674 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.522 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.64 -9.54 59.42 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 114.966 -1.015 . . . . 44.04 109.768 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.469 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -60.22 -44.34 95.25 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.4 1.08 . . . . 72.31 112.173 -179.512 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.468 ' HB2' HD12 ' A' ' 11' ' ' ILE . 75.2 m -54.48 -31.73 56.4 Favored 'General case' 0 C--N 1.288 -2.108 0 C-N-CA 125.354 1.462 . . . . 71.13 111.302 174.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.522 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -85.13 -38.2 12.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 C-N-CA 125.026 1.331 . . . . 75.04 110.367 -174.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.74 -38.41 28.76 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.996 0.739 . . . . 73.22 112.996 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.5 mt 61.51 -175.27 0.13 Allowed 'General case' 0 C--O 1.242 0.679 0 C-N-CA 124.38 1.072 . . . . 64.04 113.221 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.507 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 9.7 p30 -125.02 -177.79 3.97 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.84 -0.537 . . . . 55.53 111.562 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.531 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.7 t30 -154.39 153.11 31.05 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.382 -0.97 . . . . 74.14 108.382 -174.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -69.79 -34.53 73.87 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.146 0.43 . . . . 72.21 112.002 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -62.05 -35.95 80.14 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 122.122 0.963 . . . . 75.43 109.041 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 7.3 tt -65.84 -39.06 90.45 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.34 -1.755 . . . . 74.43 110.062 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.44 ' HB2' HD11 ' A' ' 97' ' ' ILE . 20.8 t-105 -71.42 -46.71 59.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.78 0.324 . . . . 63.53 110.245 174.964 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.01 -40.86 74.03 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-N 115.857 -0.611 . . . . 73.22 110.884 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -53.04 -50.44 64.3 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 124.134 0.896 . . . . 73.05 110.847 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mt -66.49 -45.15 80.61 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 112.741 0.645 . . . . 63.42 112.741 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -51.71 -53.73 15.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 123.738 0.649 . . . . 63.34 111.467 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.452 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 98.2 mtt180 -73.13 -33.7 65.67 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 112.13 0.418 . . . . 62.02 112.13 -176.22 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.408 HD12 HD13 ' A' ' 84' ' ' LEU . 0.9 OUTLIER -73.67 -46.5 46.13 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 73.32 109.598 -177.229 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.557 HD13 HD23 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -66.24 -25.36 66.86 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 123.679 0.792 . . . . 70.1 110.553 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' ' 53' ' ' SER . 57.7 m -72.58 -10.17 59.47 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.256 0.55 . . . . 52.33 110.838 176.879 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 70.9 mttt -98.44 -11.43 22.36 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 108.31 -0.996 . . . . 73.25 108.31 177.243 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.46 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 47.5 m-80 -132.44 51.35 7.03 Favored Pre-proline 0 N--CA 1.436 -1.169 0 CA-C-N 114.499 -1.228 . . . . 52.4 110.822 -175.088 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.46 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 2.8 Cg_exo -72.75 -19.37 24.09 Favored 'Trans proline' 0 C--N 1.361 1.191 0 N-CA-C 108.65 -1.327 . . . . 52.02 108.65 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -74.89 -37.23 62.18 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 114.189 -1.369 . . . . 72.11 109.641 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -73.21 -42.97 62.03 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.467 -0.893 . . . . 73.2 109.002 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.661 HD13 HD13 ' A' ' 37' ' ' LEU . 2.6 tm? -59.32 -47.16 86.45 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.616 -1.175 . . . . 74.24 110.226 -176.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.1 p -62.27 -38.44 89.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.686 0.279 . . . . 61.42 111.478 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.49 96.75 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.045 0.538 . . . . 72.44 111.272 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HE3' ' HB3' ' A' ' 79' ' ' ASP . 42.9 mmtt -74.52 -52.41 11.99 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 112.6 0.592 . . . . 73.32 112.6 177.073 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.661 HD13 HD13 ' A' ' 33' ' ' LEU . 10.7 mp -53.41 -31.22 44.1 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 113.999 1.111 . . . . 73.11 113.999 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.645 ' HB2' ' SD ' ' A' ' 44' ' ' MET . 31.5 ptt180 -66.69 -30.84 71.18 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.394 0.887 . . . . 74.05 113.394 179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 t -72.88 -31.99 65.07 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.495 0.664 . . . . 70.41 109.704 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.524 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.2 m-85 -83.11 -58.61 2.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.706 -0.679 . . . . 73.22 111.497 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mp -72.52 121.69 85.52 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 123.977 0.911 . . . . 75.32 110.439 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.56 -33.73 21.57 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 122.562 2.174 . . . . 75.42 112.617 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 p -94.07 -5.48 47.29 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.206 -0.452 . . . . 65.25 110.609 -178.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.645 ' SD ' ' HB2' ' A' ' 38' ' ' ARG . 8.9 mtt 36.48 91.51 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 127.643 2.377 . . . . 75.42 112.309 -175.265 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -101.92 72.87 1.37 Allowed 'General case' 0 C--N 1.287 -2.116 0 CA-C-O 122.485 1.136 . . . . 74.31 108.852 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.501 HD11 ' HB3' ' A' ' 38' ' ' ARG . 10.7 mt -92.55 -40.32 10.86 Favored 'General case' 0 CA--C 1.487 -1.464 0 CA-C-N 112.945 -1.934 . . . . 73.42 107.633 -175.542 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.14 3.35 10.77 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 112.948 -1.933 . . . . 75.1 110.994 -176.005 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.04 -15.29 63.63 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 125.039 1.336 . . . . 64.33 111.429 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.8 m -75.85 69.28 2.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.657 0.741 . . . . 52.34 111.895 -179.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.47 -9.05 57.03 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.128 0.965 . . . . 73.51 111.609 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.655 ' OE2' HG22 ' A' ' 57' ' ' VAL . 2.6 pt-20 -111.09 160.23 29.76 Favored Pre-proline 0 C--N 1.28 -2.42 0 CA-C-N 114.323 -1.308 . . . . 72.42 109.075 175.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -62.37 -170.74 0.09 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.874 2.382 . . . . 74.31 113.696 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.439 ' HB3' ' OG ' ' A' ' 27' ' ' SER . 13.2 m -76.46 36.91 0.16 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 115.169 -0.923 . . . . 74.23 112.005 -175.06 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.544 ' HB2' HG23 ' A' ' 57' ' ' VAL . 5.1 m-20 -68.39 147.55 98.18 Favored Pre-proline 0 N--CA 1.434 -1.275 0 O-C-N 122.253 -0.28 . . . . 75.54 110.955 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -56.51 -40.1 86.84 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.206 2.604 . . . . 64.01 113.275 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -74.92 -24.08 58.45 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.114 0.483 . . . . 65.55 110.731 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.655 HG22 ' OE2' ' A' ' 51' ' ' GLU . 89.8 t -69.96 -47.68 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 107.871 -1.159 . . . . 63.41 107.871 175.894 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -61.03 -45.36 98.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 114.23 -1.35 . . . . 71.13 109.725 177.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -55.2 -39.73 69.95 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.823 0.849 . . . . 72.22 111.633 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.35 -41.52 97.19 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.728 0.811 . . . . 64.14 111.365 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.401 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 18.9 mt-30 -71.81 -43.87 64.89 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.145 -0.934 . . . . 63.51 110.374 -176.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.421 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -72.41 -29.91 64.15 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.827 -1.079 . . . . 72.0 111.47 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -53.27 -42.17 66.26 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 75.45 110.335 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.2 mmt85 -55.04 -32.87 62.21 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.653 -1.158 . . . . 75.4 112.707 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.3 mt -72.35 -39.24 68.24 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 120.604 0.24 . . . . 65.2 110.81 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -64.38 -37.67 88.34 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.636 -0.876 . . . . 73.42 108.636 174.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.01 -28.25 69.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.668 -1.151 . . . . 65.14 111.439 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.402 ' HB2' HG21 ' A' ' 72' ' ' THR . 9.7 mm-40 -74.56 -57.49 3.9 Favored 'General case' 0 N--CA 1.409 -2.491 0 N-CA-C 107.772 -1.196 . . . . 72.32 107.772 174.725 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . 0.437 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -170.5 142.42 7.14 Favored Glycine 0 CA--C 1.466 -3.005 0 CA-C-N 114.917 -1.038 . . . . 24.52 112.369 -175.302 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.61 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.6 tpp -67.14 -33.11 74.73 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.378 -1.712 . . . . 41.34 106.378 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.95 -37.31 84.05 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 114.594 -1.184 . . . . 51.24 108.483 176.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.524 HG23 ' CD1' ' A' ' 40' ' ' PHE . 99.2 m -61.9 -42.63 99.3 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.677 -1.147 . . . . 70.54 110.442 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.654 ' HD1' HG23 ' A' ' 95' ' ' VAL . 70.0 t-105 -67.32 -41.23 85.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 110.345 -0.243 . . . . 74.2 110.345 179.067 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.714 ' HA ' HG21 ' A' ' 95' ' ' VAL . 73.5 mttt -56.99 -39.52 74.81 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.391 0.615 . . . . 74.22 111.278 175.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.7 m -70.95 -44.15 66.67 Favored 'General case' 0 N--CA 1.4 -2.936 0 CA-C-N 115.663 -0.698 . . . . 42.43 110.015 177.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.31 -46.12 89.45 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 123.868 0.867 . . . . 45.02 112.475 -178.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.566 HG22 ' HB2' ' A' ' 91' ' ' GLU . 43.7 mm -66.34 -31.17 52.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.155 0 C-N-CA 119.223 -0.991 . . . . 72.03 111.611 -176.472 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -64.76 -40.78 95.85 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.514 -0.55 . . . . 75.01 109.514 174.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.5 ' HB3' ' HE3' ' A' ' 36' ' ' LYS . 6.4 m-20 -65.19 -42.16 93.85 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 116.459 -0.337 . . . . 73.15 110.322 175.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.465 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -51.97 -55.02 23.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.839 1.256 . . . . 71.24 109.585 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 26.0 p -67.89 -40.46 83.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.279 0.474 . . . . 61.21 112.279 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -63.56 -54.33 37.78 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 123.389 0.676 . . . . 71.44 110.504 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -72.84 -37.12 67.55 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 113.915 1.08 . . . . 74.32 113.915 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.408 HD13 HD12 ' A' ' 25' ' ' LEU . 89.3 mt -85.2 -31.92 22.94 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.976 -0.69 . . . . 72.32 111.985 -177.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -146.36 -100.55 0.09 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.268 -0.973 . . . . 71.22 111.924 -178.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.414 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 76.3 t -141.16 151.44 61.84 Favored Pre-proline 0 C--N 1.307 -1.279 0 N-CA-C 106.853 -1.536 . . . . 74.33 106.853 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -51.31 108.05 0.21 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 121.846 1.697 . . . . 62.3 108.93 168.016 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 86' ' ' VAL . 86.7 mt -90.95 -22.89 20.63 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 113.973 1.101 . . . . 73.44 113.973 -168.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.98 17.2 9.58 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 123.665 1.698 . . . . 72.23 108.82 -172.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.455 ' O ' HD23 ' A' ' 94' ' ' LEU . 63.8 mtt -120.13 12.92 11.98 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 113.434 -1.712 . . . . 74.23 107.479 175.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.566 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -71.41 -36.14 71.25 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.313 -0.858 . . . . 74.32 111.002 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.742 ' HA ' HG12 ' A' ' 95' ' ' VAL . 35.7 mm -61.18 -46.46 95.81 Favored Pre-proline 0 C--N 1.287 -2.137 0 CA-C-N 115.648 -0.706 . . . . 71.51 112.275 -178.345 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.446 ' HD2' ' C ' ' A' ' 90' ' ' MET . 76.3 Cg_exo -51.49 -38.57 64.37 Favored 'Trans proline' 0 C--N 1.359 1.113 0 C-N-CA 122.232 1.955 . . . . 63.35 112.134 170.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.508 ' HA ' HD21 ' A' ' 18' ' ' LEU . 4.5 mm? -72.04 -33.28 67.88 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.809 -0.632 . . . . 65.45 111.564 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.742 HG12 ' HA ' ' A' ' 92' ' ' ILE . 3.3 p -78.25 -29.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 122.395 1.093 . . . . 75.12 112.147 177.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.6 t -73.24 4.28 4.73 Favored 'General case' 0 C--N 1.259 -3.336 0 CA-C-N 113.899 -1.5 . . . . 74.33 111.665 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.507 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 14.5 tt -64.33 -28.85 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 75.15 111.197 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -92.7 94.88 9.24 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 105.054 -2.202 . . . . 74.52 105.054 171.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -37.17 107.8 0.06 OUTLIER Glycine 0 N--CA 1.461 0.3 0 O-C-N 125.176 1.548 . . . . 71.04 116.399 -171.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -99.99 36.43 0.08 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.382 0 C-N-CA 123.592 2.861 . . . . 53.23 110.033 175.254 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 . . . . . 0 N--CA 1.419 -1.994 0 CA-C-N 114.513 -1.221 . . . . 74.24 108.609 -177.898 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.34 0 N-CA-C 110.544 -1.023 . . . . 54.21 110.544 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -64.32 -37.65 39.0 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.338 2.692 . . . . 72.4 114.417 -176.14 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 pp -87.92 139.14 30.82 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 113.389 0.885 . . . . 74.44 113.389 -175.855 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -136.32 -79.06 0.09 OUTLIER Glycine 0 N--CA 1.434 -1.443 0 CA-C-N 115.977 -0.556 . . . . 62.41 112.02 -178.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.535 ' O ' HG13 ' A' ' 92' ' ' ILE . 49.2 m 61.57 84.47 0.13 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-O 122.128 0.966 . . . . 41.4 110.441 -177.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -79.56 4.13 16.76 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 114.073 1.138 . . . . 70.54 114.073 -170.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -110.14 23.79 13.85 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.297 -0.961 . . . . 75.43 111.131 177.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.99 -14.56 59.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.8 0.81 . . . . 64.33 109.776 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.441 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.5 OUTLIER -65.13 -33.01 74.99 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.033 -0.985 . . . . 65.42 113.175 -178.588 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.9 t -61.78 -37.31 83.88 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.949 0.881 . . . . 73.14 109.897 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.461 ' H ' HD12 ' A' ' 11' ' ' ILE . 2.9 mp -87.5 -43.77 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 114.625 -1.171 . . . . 70.01 112.415 -177.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 12' ' ' ARG . 11.5 mmt180 -81.94 -30.78 31.59 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.028 0.751 . . . . 72.51 113.028 -175.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 64.82 133.39 0.02 OUTLIER 'General case' 0 C--O 1.247 0.952 0 C-N-CA 125.976 1.711 . . . . 75.4 115.374 -178.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -72.89 156.3 39.02 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 115.495 -0.775 . . . . 73.2 108.938 175.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.433 ' H ' HD12 ' A' ' 18' ' ' LEU . 44.8 t-20 -157.76 143.39 17.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.092 -1.077 . . . . 74.44 108.092 -174.087 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -52.84 -28.51 23.19 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.304 1.041 . . . . 52.42 111.442 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -56.63 -39.6 73.92 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.124 0.969 . . . . 62.54 110.158 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.433 HD12 ' H ' ' A' ' 15' ' ' ASN . 34.1 mt -70.67 -36.71 73.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.779 -1.101 . . . . 65.35 110.551 -175.264 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -69.44 -42.22 75.23 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.408 -0.59 . . . . 75.15 109.408 177.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.04 -48.19 82.93 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.503 -0.317 . . . . 71.05 110.222 177.746 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.454 ' HE1' HD22 ' A' ' 88' ' ' LEU . 2.3 t-105 -54.5 -50.28 68.18 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.782 -0.645 . . . . 74.14 110.77 175.246 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -59.79 -53.05 62.5 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 123.74 0.65 . . . . 62.35 109.286 -177.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.4 t -56.48 -50.57 72.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 116.233 -0.439 . . . . 75.02 112.131 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.574 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 97.3 mtt180 -69.63 -41.56 75.48 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.285 0.476 . . . . 73.42 112.285 -174.067 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.57 -42.91 86.34 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.262 -0.644 . . . . 75.14 109.262 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.561 HD21 HD21 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -70.34 -25.1 63.13 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.961 -0.563 . . . . 62.21 110.437 -179.255 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.9 m -71.56 -18.9 62.22 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.287 -0.634 . . . . 61.13 109.287 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 40.3 mtmt -91.84 1.37 57.22 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.814 0.816 . . . . 44.11 109.188 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -141.03 55.64 5.65 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 114.81 -1.086 . . . . 73.24 110.267 -178.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -67.98 -26.01 37.86 Favored 'Trans proline' 0 C--N 1.363 1.34 0 C-N-CA 121.389 1.393 . . . . 63.45 108.986 -176.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -66.85 -42.07 86.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-N 113.55 -1.659 . . . . 72.32 110.131 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.597 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 80.1 t90 -74.57 -45.47 45.13 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 119.809 -0.757 . . . . 74.12 109.664 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.613 ' O ' HD13 ' A' ' 37' ' ' LEU . 2.9 tm? -57.4 -52.52 65.02 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.392 -1.276 . . . . 65.41 110.537 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.487 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 12.9 p -54.28 -42.59 70.21 Favored 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 112.371 0.508 . . . . 65.21 112.371 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.65 86.91 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 124.254 1.021 . . . . 73.22 112.447 177.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.597 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.2 mmmt -72.13 -31.26 65.83 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.891 0.377 . . . . 72.12 110.394 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.613 HD13 ' O ' ' A' ' 33' ' ' LEU . 5.2 mp -61.49 -31.08 71.05 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 122.679 0.392 . . . . 70.1 111.701 173.313 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 34' ' ' SER . 28.6 mtm180 -66.23 -35.4 80.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.986 0.898 . . . . 64.2 109.537 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.44 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 50.2 m -75.47 -36.07 60.74 Favored 'General case' 0 N--CA 1.399 -3.0 0 C-N-CA 125.734 1.614 . . . . 73.35 112.648 -178.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.592 ' CD1' HG23 ' A' ' 72' ' ' THR . 66.1 m-85 -94.51 -47.43 6.55 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 113.192 0.812 . . . . 73.43 113.192 -178.555 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.616 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.0 OUTLIER -101.0 115.92 64.66 Favored Pre-proline 0 N--CA 1.436 -1.157 0 O-C-N 122.315 -0.241 . . . . 53.23 110.699 -176.146 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.14 -25.61 9.97 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.823 1.682 . . . . 71.21 111.248 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.5 m -99.12 23.89 8.53 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.511 1.148 . . . . 73.33 110.875 -174.227 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.498 ' HB2' ' HB2' ' A' ' 41' ' ' LEU . 4.0 tpt -74.95 104.19 5.45 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 113.846 1.054 . . . . 62.21 113.846 -176.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -94.01 77.02 4.12 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 106.369 -1.715 . . . . 63.31 106.369 170.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.484 HD23 ' HG2' ' A' ' 44' ' ' MET . 3.9 pp -89.22 -17.49 28.96 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.165 -1.38 . . . . 53.41 112.305 -174.358 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -72.39 -18.43 61.73 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.532 0.682 . . . . 74.53 111.73 -175.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.7 m -100.74 95.03 6.38 Favored 'General case' 0 C--N 1.276 -2.595 0 CA-C-N 115.649 -0.705 . . . . 75.1 110.625 -176.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.8 m -91.76 95.39 9.84 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.547 0.689 . . . . 75.31 109.669 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.21 -48.44 81.48 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.864 -1.062 . . . . 70.14 110.939 176.287 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.423 ' HB2' HG21 ' A' ' 57' ' ' VAL . 45.4 mt-10 -116.97 164.62 18.02 Favored Pre-proline 0 C--N 1.245 -3.936 0 CA-C-N 113.281 -1.781 . . . . 72.22 106.877 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.8 -150.87 0.04 OUTLIER 'Trans proline' 0 CA--C 1.553 1.453 0 C-N-CA 122.221 1.948 . . . . 75.23 110.812 174.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -75.47 38.08 0.14 Allowed 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 124.189 0.996 . . . . 72.44 112.334 -176.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.17 146.81 91.91 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 123.637 0.775 . . . . 72.32 111.019 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.21 -27.92 78.89 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.724 2.283 . . . . 64.5 111.933 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -68.74 -40.28 79.94 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.533 -0.914 . . . . 75.24 108.533 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.493 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 58.4 t -66.47 -50.36 67.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.717 -1.129 . . . . 73.3 109.042 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.44 ' O ' HD23 ' A' ' 62' ' ' LEU . 47.3 mm -55.15 -39.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-N 114.792 -1.094 . . . . 70.02 109.776 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.497 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 36.1 t60 -61.89 -28.98 69.9 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.604 -0.725 . . . . 63.32 111.461 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.414 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 25.3 mmt180 -74.22 -40.75 62.24 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 122.317 1.056 . . . . 74.43 108.251 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.565 ' HB3' HD21 ' A' ' 37' ' ' LEU . 41.1 mt-30 -70.25 -43.88 69.61 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 113.555 -1.657 . . . . 65.42 110.534 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.494 HD13 HD12 ' A' ' 65' ' ' LEU . 3.9 mm? -73.42 -30.5 63.27 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.875 -1.057 . . . . 73.15 111.232 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 53.6 t-20 -56.42 -43.37 79.34 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.467 1.107 . . . . 54.15 108.858 175.449 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.616 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 34.0 mmt180 -58.48 -37.01 74.63 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.758 -1.11 . . . . 74.33 112.343 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.494 HD12 HD13 ' A' ' 62' ' ' LEU . 88.5 mt -71.82 -44.68 63.48 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 116.552 -0.295 . . . . 62.51 111.571 -177.171 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -67.38 -27.77 67.38 Favored 'General case' 0 C--O 1.245 0.851 0 N-CA-C 108.851 -0.796 . . . . 72.31 108.851 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.24 81.0 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.245 -0.889 . . . . 73.25 110.709 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.455 ' HB2' HG21 ' A' ' 72' ' ' THR . 12.6 mm100 -60.4 -47.94 83.89 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.054 -0.721 . . . . 73.12 109.054 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.81 141.02 5.43 Favored Glycine 0 N--CA 1.403 -3.539 0 CA-C-N 114.772 -1.104 . . . . 72.23 111.143 -178.269 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.624 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 21.7 ptp -69.67 -26.61 64.47 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.025 -1.843 . . . . 72.14 106.025 169.662 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.5 67.01 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.37 -1.286 . . . . 74.12 108.262 173.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.592 HG23 ' CD1' ' A' ' 40' ' ' PHE . 81.2 m -55.39 -40.82 71.85 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 123.399 0.68 . . . . 64.01 110.129 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.5 t-105 -61.26 -49.29 77.68 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 115.765 -0.652 . . . . 72.22 110.247 176.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.624 ' HG3' ' O ' ' A' ' 70' ' ' MET . 91.5 mttt -55.82 -42.48 75.75 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.959 0.409 . . . . 64.53 110.754 176.525 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 42.3 m -65.88 -44.93 83.88 Favored 'General case' 0 N--CA 1.406 -2.636 0 C-N-CA 123.334 0.654 . . . . 75.11 110.773 179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -58.33 -49.52 76.9 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.718 -0.673 . . . . 73.23 111.006 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.493 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 49.5 mm -64.47 -38.31 82.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 O-C-N 123.349 0.406 . . . . 74.44 110.738 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -69.67 -32.93 71.85 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.198 0.523 . . . . 74.34 110.781 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 67.9 m-20 -74.01 -39.61 63.48 Favored 'General case' 0 C--O 1.193 -1.875 0 C-N-CA 119.867 -0.733 . . . . 70.25 110.163 171.983 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.561 HD21 HD21 ' A' ' 26' ' ' LEU . 2.8 tm? -50.76 -53.96 27.38 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.924 1.29 . . . . 61.3 111.073 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 25.3 p -63.29 -33.7 76.08 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.623 -0.717 . . . . 75.43 111.662 -178.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -73.47 -54.35 8.46 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 123.554 0.742 . . . . 71.13 111.129 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 42.3 mt-10 -68.61 -36.73 79.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.396 -0.82 . . . . 62.35 112.814 -172.047 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.6 -10.24 44.06 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.936 -0.706 . . . . 43.32 110.032 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.5 t70 55.95 69.48 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.194 0.998 . . . . 63.01 110.219 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -132.88 129.08 21.01 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 115.082 -0.963 . . . . 61.35 110.666 -177.524 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -75.89 109.55 2.91 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.115 1.877 . . . . 63.11 110.076 176.412 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.454 HD22 ' HE1' ' A' ' 21' ' ' TRP . 65.9 mt -86.05 -31.1 22.14 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 120.175 -0.61 . . . . 55.3 109.634 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.7 t70 71.31 -49.68 0.68 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.854 1.261 . . . . 63.33 111.559 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.511 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . 20.6 ptp -116.43 68.56 0.73 Allowed 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.098 0.951 . . . . 61.02 108.55 175.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 36.2 tt0 -70.36 -46.04 64.9 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.354 -1.293 . . . . 63.44 112.13 -172.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.588 ' O ' HG22 ' A' ' 95' ' ' VAL . 44.4 mm -64.43 -42.8 68.88 Favored Pre-proline 0 C--O 1.175 -2.852 0 C-N-CA 123.358 0.663 . . . . 72.2 111.034 -178.04 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.511 ' HG2' ' HB2' ' A' ' 90' ' ' MET . 3.1 Cg_exo -48.37 -33.33 22.35 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.937 1.758 . . . . 61.22 112.89 167.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 4.5 mm? -68.32 -44.06 76.23 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 108.952 -0.759 . . . . 64.55 108.952 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 92' ' ' ILE . 2.8 m -63.77 -34.47 68.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.278 0 CA-C-O 123.051 1.405 . . . . 72.24 110.712 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.3 m -89.21 7.23 36.45 Favored 'General case' 0 C--N 1.274 -2.713 0 C-N-CA 127.667 2.387 . . . . 53.25 113.453 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.5 tp -60.91 -24.95 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.078 0.551 . . . . 62.31 111.598 -176.081 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 23.9 m0 52.83 85.45 0.05 OUTLIER 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 124.961 1.304 . . . . 75.13 112.278 -174.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -85.29 -174.05 49.98 Favored Glycine 0 N--CA 1.432 -1.579 0 CA-C-N 115.361 -0.836 . . . . 72.01 111.277 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -79.65 159.11 25.16 Favored 'Trans proline' 0 C--N 1.319 -0.974 0 C-N-CA 122.311 2.008 . . . . 75.4 111.8 179.043 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 . . . . . 0 N--CA 1.412 -2.34 0 N-CA-C 108.758 -0.83 . . . . 71.52 108.758 178.674 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.516 0 N-CA-C 110.85 -0.9 . . . . 72.2 110.85 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -71.79 112.5 3.4 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.962 2.441 . . . . 71.15 113.01 -178.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.1 mt -117.27 -4.66 11.36 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.727 -0.67 . . . . 65.32 109.843 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 94.63 85.08 1.65 Allowed Glycine 0 N--CA 1.428 -1.842 0 N-CA-C 108.676 -1.769 . . . . 75.01 108.676 -175.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . 0.262 44.4 p 66.7 123.1 0.02 OUTLIER 'General case' 0 C--O 1.249 1.044 0 C-N-CA 126.558 1.943 . . . . 62.24 113.335 -174.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 28.5 ttt -79.49 80.95 5.81 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 122.913 1.34 . . . . 72.23 109.531 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.524 ' O ' HD13 ' A' ' 11' ' ' ILE . 28.7 t70 -161.85 25.12 0.12 Allowed 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 112.119 -2.31 . . . . 72.23 108.175 -177.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.94 -31.94 64.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.9 1.333 . . . . 60.23 107.468 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.8 pm0 -55.93 -38.88 70.89 Favored 'General case' 0 N--CA 1.422 -1.858 0 CA-C-N 112.768 -2.014 . . . . 71.44 112.216 175.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -66.92 -26.74 67.0 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.779 0.799 . . . . 63.03 111.19 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.524 HD13 ' O ' ' A' ' 7' ' ' ASP . 1.0 OUTLIER -83.51 -24.91 7.85 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.836 0 CA-C-N 115.143 -0.935 . . . . 75.02 110.453 -175.296 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.488 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 38.2 mmt180 -84.68 -65.03 1.06 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.373 -0.376 . . . . 73.22 110.19 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LEU . . . . . 0.423 ' HA ' ' O ' ' A' ' 96' ' ' SER . 41.5 mt 50.83 166.08 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 117.196 2.295 . . . . 63.23 117.196 -179.332 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.6 t30 51.46 87.61 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.907 1.683 . . . . 51.14 113.231 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.538 ' HB3' HD23 ' A' ' 18' ' ' LEU . 46.7 m-80 -125.32 89.86 3.12 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.893 -0.594 . . . . 44.13 110.942 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.82 -39.24 69.94 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.251 -0.431 . . . . 64.33 111.63 -177.719 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.02 -34.07 76.78 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.274 0.559 . . . . 73.14 110.127 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.627 HD12 HD22 ' A' ' 94' ' ' LEU . 4.6 mm? -67.12 -37.99 84.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.167 -0.924 . . . . 72.34 110.914 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.4 t-105 -66.24 -46.76 76.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.348 -0.387 . . . . 74.31 110.307 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.77 -32.54 74.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.005 -0.543 . . . . 64.24 111.133 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -67.74 -50.17 58.66 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.347 -0.612 . . . . 62.23 109.347 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.1 -52.77 63.1 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.727 0.811 . . . . 63.45 110.077 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.3 t -57.51 -48.62 82.6 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 C-N-CA 122.898 0.479 . . . . 75.44 111.575 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -72.3 -31.68 65.92 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.271 -0.422 . . . . 71.34 111.483 -175.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -72.98 -43.97 61.62 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 107.964 -1.124 . . . . 51.52 107.964 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.471 HD13 HD23 ' A' ' 33' ' ' LEU . 4.8 mt -73.43 -24.23 60.22 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 113.304 0.853 . . . . 74.11 113.304 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . 0.54 ' HA ' ' HB3' ' A' ' 53' ' ' SER . 53.2 p -59.15 -22.04 60.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.515 0.674 . . . . 72.41 109.792 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.6 mtmt -92.43 -15.2 27.48 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.483 -0.781 . . . . 72.24 109.522 -178.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -133.96 51.5 6.6 Favored Pre-proline 0 C--O 1.242 0.701 0 CA-C-N 114.902 -1.044 . . . . 61.23 111.849 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.38 -22.31 29.42 Favored 'Trans proline' 0 C--N 1.366 1.49 0 N-CA-C 108.939 -1.216 . . . . 75.22 108.939 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -66.71 -39.62 88.1 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-N 113.352 -1.749 . . . . 64.34 110.09 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.527 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 70.6 t90 -74.34 -45.49 46.9 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 119.605 -0.838 . . . . 52.23 109.378 178.272 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.596 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 3.1 tm? -59.05 -49.52 77.57 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.61 -1.177 . . . . 61.11 110.947 -174.269 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.52 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 21.1 p -58.94 -45.27 90.85 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.029 0.381 . . . . 63.2 112.029 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.95 70.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.109 0.964 . . . . 62.0 111.416 176.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.521 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 26.3 mmmt -72.56 -35.8 68.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.99 -0.284 . . . . 70.41 110.668 178.794 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.4 mt -59.41 -31.13 68.98 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.969 -0.56 . . . . 73.4 110.855 177.084 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 34' ' ' SER . 59.7 mtp180 -61.5 -34.82 76.14 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.04 -0.527 . . . . 72.33 112.234 -176.707 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -87.58 -38.97 15.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.273 -0.421 . . . . 64.13 110.476 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.446 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 76.4 m-85 -73.85 -47.89 35.1 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.066 0.765 . . . . 73.31 113.066 -178.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.533 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.5 mm? -102.43 112.54 65.65 Favored Pre-proline 0 N--CA 1.432 -1.34 0 CA-C-O 120.758 0.313 . . . . 73.25 110.957 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -81.15 3.06 8.11 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.511 2.141 . . . . 74.03 111.373 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 27.6 p -111.53 -2.0 15.64 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.061 -0.972 . . . . 75.43 111.193 -177.295 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.505 ' HB2' ' HB2' ' A' ' 41' ' ' LEU . 36.9 tpp -65.22 110.07 2.44 Favored 'General case' 0 N--CA 1.413 -2.315 0 N-CA-C 115.489 1.663 . . . . 74.32 115.489 -174.465 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -108.79 82.92 1.68 Allowed 'General case' 0 N--CA 1.428 -1.532 0 N-CA-C 105.243 -2.132 . . . . 73.41 105.243 165.307 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.492 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 4.6 pp -81.75 5.01 19.88 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-N 114.58 -1.191 . . . . 73.2 111.486 -173.158 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -80.34 -9.35 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.999 -1.0 . . . . 63.45 111.452 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.3 p -89.35 77.59 7.36 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.966 0.889 . . . . 71.22 111.931 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.5 m -95.02 83.07 3.87 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.315 -0.857 . . . . 72.53 109.217 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -22.96 57.84 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.74 1.257 . . . . 72.43 111.846 178.441 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -137.03 161.6 60.48 Favored Pre-proline 1 N--CA 1.374 -4.273 0 N-CA-C 105.678 -1.971 . . . . 63.32 105.678 178.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.408 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.1 Cg_exo -69.57 -143.47 0.02 OUTLIER 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 122.975 2.45 . . . . 73.25 110.923 175.102 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.54 ' HB3' ' HA ' ' A' ' 27' ' ' SER . 13.0 m -80.59 38.33 0.43 Allowed 'General case' 0 C--N 1.293 -1.853 0 CA-C-O 122.18 0.99 . . . . 43.12 110.66 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.408 ' H ' ' C ' ' A' ' 52' ' ' PRO . 6.7 m-20 -62.35 151.41 82.41 Favored Pre-proline 0 C--N 1.317 -0.823 0 C-N-CA 126.298 1.839 . . . . 75.13 112.802 -178.169 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -54.07 -43.45 58.17 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 124.011 3.141 . . . . 52.41 114.158 -175.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -73.86 -31.52 63.21 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-O 120.65 0.262 . . . . 55.42 110.372 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -63.7 -52.1 61.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.356 -0.979 . . . . 73.13 108.356 176.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.466 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.0 mm -56.97 -41.44 77.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.708 -1.133 . . . . 75.4 109.259 176.727 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.456 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 48.7 t-80 -58.92 -36.46 74.76 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-N 115.74 -0.664 . . . . 74.22 112.092 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -64.21 -44.42 92.01 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 108.118 -1.067 . . . . 54.12 108.118 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -67.39 -47.47 70.22 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.208 -1.814 . . . . 73.44 110.885 -172.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.466 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -74.17 -32.04 62.94 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 114.321 -1.309 . . . . 74.33 111.453 -177.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 67.1 t30 -63.16 -44.62 94.95 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.95 0.881 . . . . 54.14 109.847 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.533 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 19.0 mmt180 -57.56 -29.82 64.72 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.193 -1.367 . . . . 63.43 112.943 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.46 -39.18 85.3 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.658 0.266 . . . . 53.42 110.981 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.534 ' CG ' ' HD2' ' A' ' 100' ' ' PRO . 37.9 t80 -70.96 -29.8 65.91 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.566 -0.901 . . . . 74.43 108.566 178.442 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -19.94 65.1 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.738 -0.664 . . . . 70.54 110.529 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -79.84 -49.09 12.47 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 108.517 -0.92 . . . . 63.14 108.517 173.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.44 141.61 6.52 Favored Glycine 0 CA--C 1.479 -2.179 0 CA-C-N 115.001 -0.999 . . . . 71.02 111.526 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.521 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 59.5 ttp -67.74 -29.5 68.74 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.15 -1.796 . . . . 71.1 106.15 171.209 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.92 -32.95 34.48 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 113.707 -1.588 . . . . 63.31 109.026 177.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.412 HG23 ' CD1' ' A' ' 40' ' ' PHE . 98.7 m -60.4 -38.56 84.35 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.254 -0.647 . . . . 61.31 109.254 175.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.613 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.2 t-105 -61.57 -54.2 46.24 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 123.609 0.568 . . . . 72.12 109.739 175.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 70' ' ' MET . 85.9 mttt -53.97 -45.25 71.31 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.146 0.578 . . . . 71.05 111.935 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -65.34 -45.74 83.0 Favored 'General case' 0 N--CA 1.408 -2.558 0 C-N-CA 123.095 0.558 . . . . 74.44 111.104 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.446 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 81.0 t80 -57.49 -45.36 84.99 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.555 -0.748 . . . . 74.33 110.739 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.568 HG21 ' HB2' ' A' ' 94' ' ' LEU . 49.2 mm -63.5 -33.11 59.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 116.103 -0.499 . . . . 72.12 111.347 -178.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -66.16 -42.61 88.75 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.627 -0.829 . . . . 73.51 109.368 175.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 2.2 m-20 -64.12 -38.23 90.3 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 120.731 0.3 . . . . 64.42 110.427 175.998 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.6 tm? -53.66 -55.56 24.96 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 124.66 1.184 . . . . 72.31 109.863 177.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 87' ' ' PRO . 26.8 p -68.53 -40.24 80.84 Favored 'General case' 0 N--CA 1.42 -1.948 0 CA-C-N 116.15 -0.477 . . . . 72.21 111.674 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -65.86 -48.04 72.89 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.856 -0.611 . . . . 73.54 112.558 -174.668 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 6.1 mt-10 -80.69 -26.89 37.24 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.126 -0.63 . . . . 73.33 112.06 -174.194 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.3 mt -85.97 -37.39 19.05 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 120.442 -0.503 . . . . 64.42 111.098 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -148.82 -100.3 0.08 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 121.042 -0.263 . . . . 71.13 110.969 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -141.19 164.21 37.07 Favored Pre-proline 0 C--N 1.314 -0.962 0 N-CA-C 108.108 -1.071 . . . . 64.22 108.108 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.482 ' HA ' ' SG ' ' A' ' 81' ' ' CYS . 50.1 Cg_exo -57.8 114.89 2.16 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.898 1.732 . . . . 72.5 108.18 170.96 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.62 -19.09 29.84 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 113.304 0.853 . . . . 53.24 113.304 -169.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 78.7 -0.1 2.47 Favored 'General case' 0 N--CA 1.506 2.339 0 CA-C-O 123.542 1.639 . . . . 73.42 108.401 -173.149 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.452 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 27.8 ttt -105.75 6.26 31.65 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 113.157 -1.838 . . . . 75.44 108.071 -179.372 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.664 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -66.73 -46.53 75.18 Favored 'General case' 0 C--O 1.199 -1.601 0 CA-C-N 116.128 -0.487 . . . . 64.3 111.884 -178.808 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.456 ' O ' HG22 ' A' ' 95' ' ' VAL . 39.9 mm -59.09 -44.57 98.88 Favored Pre-proline 0 C--O 1.185 -2.332 0 CA-C-O 118.646 -0.693 . . . . 72.2 110.081 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.452 ' HD2' ' C ' ' A' ' 90' ' ' MET . 52.5 Cg_exo -47.63 -42.41 29.64 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 121.994 1.796 . . . . 72.32 112.342 169.539 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.627 HD22 HD12 ' A' ' 18' ' ' LEU . 4.4 mm? -67.01 -39.84 87.15 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.976 0.417 . . . . 72.33 110.616 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.664 HG13 ' O ' ' A' ' 91' ' ' GLU . 2.9 m -68.19 -29.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 122.824 1.297 . . . . 73.43 110.895 -178.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.488 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 24.5 t -82.92 5.13 22.93 Favored 'General case' 0 C--N 1.276 -2.629 0 C-N-CA 127.274 2.23 . . . . 62.3 111.68 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 17.3 tt -50.21 -48.16 24.54 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 113.439 0.903 . . . . 73.15 113.439 -173.207 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 4.1 p90 175.52 173.88 0.28 Allowed 'General case' 0 CA--C 1.499 -0.981 0 C-N-CA 126.339 1.856 . . . . 74.44 107.031 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -130.29 103.62 0.58 Allowed Glycine 0 N--CA 1.418 -2.543 0 C-N-CA 120.029 -1.081 . . . . 61.44 111.991 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.534 ' HD2' ' CG ' ' A' ' 66' ' ' PHE . 26.0 Cg_exo -69.65 50.86 0.82 Allowed 'Trans proline' 0 CA--C 1.554 1.481 0 C-N-CA 123.739 2.959 . . . . 74.44 111.72 174.203 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 . . . . . 0 N--CA 1.412 -2.335 0 N-CA-C 107.583 -1.265 . . . . 71.21 107.583 -179.683 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.647 0 N-CA-C 109.692 -1.363 . . . . 75.04 109.692 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -66.58 129.61 21.62 Favored 'Trans proline' 0 C--O 1.244 0.79 0 C-N-CA 122.118 1.879 . . . . 71.43 109.833 176.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.9 tp -142.0 166.04 25.79 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 108.392 -0.966 . . . . 74.44 108.392 -177.133 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.74 34.77 4.22 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.72 -0.752 . . . . 72.13 111.641 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.5 m -149.82 165.15 33.37 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.335 -0.987 . . . . 55.45 108.335 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -112.32 38.0 2.85 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.493 -0.929 . . . . 72.41 108.493 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.418 ' O ' HD13 ' A' ' 11' ' ' ILE . 3.2 m-20 -105.12 25.71 10.23 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.266 0.839 . . . . 64.33 113.266 -174.572 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.431 ' HB3' ' HB ' ' A' ' 92' ' ' ILE . . . -77.2 -9.18 58.62 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 122.482 1.134 . . . . 51.01 109.778 175.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.482 ' HB3' ' OG ' ' A' ' 96' ' ' SER . 0.0 OUTLIER -69.19 -30.42 68.6 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.005 -1.452 . . . . 73.12 112.267 179.178 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.607 ' HB2' HD12 ' A' ' 11' ' ' ILE . 70.6 m -66.78 -32.45 73.75 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 122.271 1.034 . . . . 63.53 109.443 177.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.607 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.0 OUTLIER -84.38 -51.45 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.364 0 CA-C-N 113.888 -1.506 . . . . 61.15 110.918 -173.538 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -112.72 -6.92 13.84 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 115.003 1.483 . . . . 71.43 115.003 -173.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 53.29 -92.62 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.062 0.945 . . . . 75.44 113.18 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.453 ' OD1' ' HA ' ' A' ' 100' ' ' PRO . 7.8 p30 -170.37 170.55 7.03 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 124.513 1.125 . . . . 64.15 108.053 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.421 ' H ' HD12 ' A' ' 18' ' ' LEU . 46.8 t30 -152.67 152.58 31.91 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.08 -38.79 92.58 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 123.752 0.821 . . . . 75.4 111.076 -177.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -61.3 -29.28 69.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.29 -0.414 . . . . 51.31 111.811 -178.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.539 HD21 ' SD ' ' A' ' 90' ' ' MET . 83.4 mt -65.81 -44.93 84.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.491 -0.559 . . . . 71.44 109.491 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.445 ' HB2' HD11 ' A' ' 97' ' ' ILE . 61.3 t-105 -69.48 -36.88 76.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.48 -0.782 . . . . 74.54 109.842 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.35 -44.09 88.8 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 116.215 -0.448 . . . . 53.53 111.249 178.525 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.545 ' CH2' ' HG ' ' A' ' 25' ' ' LEU . 70.1 t90 -60.76 -48.13 83.18 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.684 -0.858 . . . . 71.13 108.684 176.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.441 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -54.4 -53.22 56.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.93 -1.032 . . . . 70.44 109.294 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.0 t -60.13 -44.66 95.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 112.407 0.521 . . . . 75.44 112.407 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.485 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 42.2 ttm180 -69.95 -45.28 67.78 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 120.596 -0.441 . . . . 75.24 111.029 -176.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.545 ' HG ' ' CH2' ' A' ' 21' ' ' TRP . 2.7 tm? -67.82 -40.32 83.8 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.917 -0.401 . . . . 75.23 109.917 -175.645 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.661 HD13 HD23 ' A' ' 33' ' ' LEU . 6.8 mt -71.0 -25.59 62.75 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 120.957 0.408 . . . . 72.03 111.804 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.0 t -68.93 -17.35 63.94 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.606 -0.887 . . . . 73.23 108.606 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 30.1 mtmt -101.66 -2.63 29.91 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.733 -0.667 . . . . 74.01 110.02 177.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -135.53 57.62 20.66 Favored Pre-proline 0 C--O 1.243 0.756 0 CA-C-N 116.139 -0.482 . . . . 71.43 111.185 -178.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -67.98 -28.47 35.37 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 121.307 1.338 . . . . 74.44 108.774 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.88 -44.27 96.55 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-N 113.16 -1.836 . . . . 75.42 110.624 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.519 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 78.2 t90 -74.85 -45.84 40.4 Favored 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 119.92 -0.712 . . . . 75.02 110.055 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.661 HD23 HD13 ' A' ' 26' ' ' LEU . 2.6 tm? -60.32 -47.14 87.3 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.536 -1.211 . . . . 72.04 111.104 -173.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.608 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 50.1 m -57.43 -48.77 78.24 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 123.191 0.307 . . . . 73.21 111.222 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.02 -39.56 69.24 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.19 0.996 . . . . 71.22 111.854 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.519 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.7 mmmt -73.0 -33.25 65.68 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.784 -0.366 . . . . 70.33 111.091 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.2 mt -62.01 -32.46 72.94 Favored 'General case' 0 C--O 1.183 -2.401 0 N-CA-C 109.986 -0.375 . . . . 74.42 109.986 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 34' ' ' SER . 67.6 mtt180 -63.21 -30.47 71.61 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.13 0.491 . . . . 74.33 111.482 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 t -87.47 -35.72 18.07 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 115.48 -0.782 . . . . 73.55 110.536 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.73 ' CD1' HG23 ' A' ' 72' ' ' THR . 56.9 m-85 -86.64 -49.14 7.73 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 113.009 0.744 . . . . 73.32 113.009 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 8.6 mp -88.99 114.08 58.7 Favored Pre-proline 0 C--N 1.3 -1.561 0 C-N-CA 123.834 0.854 . . . . 62.42 109.228 179.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.97 -32.38 13.66 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.678 1.585 . . . . 74.43 110.333 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.4 m -105.59 29.13 6.81 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 115.22 -0.9 . . . . 63.54 109.472 -177.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.503 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -44.89 101.49 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.965 1.306 . . . . 60.11 114.311 -174.497 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.45 72.8 6.05 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.333 1.063 . . . . 75.12 108.775 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.409 HD22 ' HB3' ' A' ' 34' ' ' SER . 3.4 pp -96.52 -16.12 21.28 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.327 -1.306 . . . . 74.41 112.192 -178.419 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -87.12 -1.88 58.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.797 0.808 . . . . 75.53 111.796 -173.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.02 73.59 1.25 Allowed 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.461 -0.495 . . . . 44.52 110.656 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.1 m -101.32 83.97 2.55 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-O 121.595 0.712 . . . . 55.35 109.666 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -30.41 70.66 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 114.715 -1.129 . . . . 73.04 112.172 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -120.74 169.5 8.7 Favored Pre-proline 1 N--CA 1.377 -4.078 0 N-CA-C 106.337 -1.727 . . . . 62.32 106.337 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -81.12 -151.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.804 1.669 . . . . 71.11 110.869 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.5 m -76.47 38.74 0.19 Allowed 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 124.29 1.036 . . . . 74.55 112.607 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -65.88 151.62 94.76 Favored Pre-proline 0 N--CA 1.447 -0.599 0 C-N-CA 123.472 0.709 . . . . 72.24 112.152 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.9 -42.01 60.19 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 123.866 3.044 . . . . 73.35 114.369 -176.795 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -74.35 -27.9 60.89 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 120.792 0.33 . . . . 74.1 110.9 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 95.0 t -69.84 -47.19 71.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 107.937 -1.134 . . . . 62.45 107.937 177.351 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.447 ' O ' HD23 ' A' ' 62' ' ' LEU . 45.9 mm -58.91 -47.66 88.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.557 -1.202 . . . . 74.1 109.507 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -54.89 -37.54 66.43 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.548 -0.751 . . . . 74.22 111.594 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 22.5 ttt85 -60.61 -48.1 83.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.607 0.718 . . . . 52.11 110.887 177.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -66.21 -45.05 82.09 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.675 -1.148 . . . . 74.34 110.712 -176.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.8 mm? -74.18 -31.17 62.57 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.385 -1.28 . . . . 72.13 111.454 -176.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -60.51 -42.42 96.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.716 0.769 . . . . 70.33 109.693 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -60.03 -31.02 69.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.605 -1.18 . . . . 72.14 112.69 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.23 -44.54 71.8 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 110.011 -0.366 . . . . 73.32 110.011 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.745 -0.661 . . . . 64.42 109.307 176.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.12 -29.73 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.436 -0.802 . . . . 62.11 111.651 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.565 ' HB2' HG21 ' A' ' 72' ' ' THR . 35.2 mm-40 -68.86 -45.71 70.35 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 121.437 0.637 . . . . 62.05 109.366 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -174.42 142.1 6.23 Favored Glycine 0 N--CA 1.408 -3.185 0 CA-C-N 115.051 -0.977 . . . . 73.23 111.643 -175.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.449 ' O ' ' HZ3' ' A' ' 98' ' ' TRP . 0.0 OUTLIER -67.5 -30.18 69.8 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 105.843 -1.91 . . . . 62.34 105.843 170.396 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.93 -35.33 64.59 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.866 -1.515 . . . . 73.34 108.824 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.73 HG23 ' CD1' ' A' ' 40' ' ' PHE . 54.1 m -59.18 -45.52 90.82 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 115.434 -0.803 . . . . 65.41 110.654 175.577 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.56 ' HD1' HG23 ' A' ' 95' ' ' VAL . 66.2 t-105 -66.47 -38.61 87.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 121.095 -0.242 . . . . 73.21 110.457 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.639 ' HA ' HG21 ' A' ' 95' ' ' VAL . 89.1 mttt -56.7 -48.76 76.97 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.264 0.554 . . . . 73.52 110.603 174.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 47.2 m -62.79 -42.27 99.63 Favored 'General case' 0 N--CA 1.4 -2.969 0 CA-C-N 114.771 -1.104 . . . . 74.11 110.455 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.81 -47.98 82.64 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 115.012 -0.994 . . . . 73.23 111.69 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.414 HG22 ' HG3' ' A' ' 91' ' ' GLU . 49.7 mm -65.55 -34.75 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 119.551 -0.86 . . . . 64.23 110.903 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -63.95 -37.7 88.37 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.022 -0.535 . . . . 73.33 110.272 177.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 84.2 m-20 -74.37 -42.62 59.04 Favored 'General case' 0 C--O 1.192 -1.96 0 CA-C-N 116.517 -0.31 . . . . 71.52 110.731 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -50.13 -53.99 23.75 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.518 1.527 . . . . 64.42 109.947 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 45.0 t -66.59 -32.12 73.26 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.693 -0.685 . . . . 43.22 110.958 -179.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -76.19 -55.13 5.86 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.892 -0.595 . . . . 74.15 111.631 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 21.4 mt-10 -75.33 -25.26 57.66 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 113.132 0.79 . . . . 63.42 113.132 -170.078 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.528 HD13 HD12 ' A' ' 25' ' ' LEU . 94.4 mt -88.0 12.14 14.13 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.857 0.688 . . . . 71.13 112.857 -176.721 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.8 t70 72.58 -54.75 0.69 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.675 1.19 . . . . 65.13 113.428 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.62 116.34 39.6 Favored Pre-proline 0 C--N 1.308 -1.197 0 C-N-CA 123.129 0.572 . . . . 63.44 111.302 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -82.96 80.76 2.57 Favored 'Trans proline' 0 N--CA 1.43 -2.242 0 C-N-CA 121.674 1.583 . . . . 74.01 110.786 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.529 ' CD1' ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -67.57 -25.65 65.9 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.653 -0.703 . . . . 63.35 111.864 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.492 ' O ' HD22 ' A' ' 88' ' ' LEU . 9.4 t70 63.06 -164.14 0.26 Allowed 'General case' 0 CA--C 1.551 0.993 0 O-C-N 124.303 1.002 . . . . 74.14 109.13 175.013 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.539 ' SD ' HD21 ' A' ' 18' ' ' LEU . 41.3 ttm 60.4 34.01 20.65 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 123.085 1.422 . . . . 74.1 108.363 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.414 ' HG3' HG22 ' A' ' 77' ' ' ILE . 35.2 tt0 -53.75 -44.99 70.44 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.46 2.304 . . . . 64.41 112.703 -174.409 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.736 ' HA ' HG12 ' A' ' 95' ' ' VAL . 41.5 mm -71.33 -50.33 11.12 Favored Pre-proline 0 C--O 1.197 -1.658 0 CA-C-O 118.701 -0.666 . . . . 71.02 111.774 -177.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.501 ' HB2' ' HG2' ' A' ' 90' ' ' MET . 47.3 Cg_exo -51.8 -34.21 53.8 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 121.524 1.482 . . . . 65.44 112.147 169.267 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.437 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 3.6 mm? -65.14 -42.66 93.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.743 0.306 . . . . 72.51 110.897 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.736 HG12 ' HA ' ' A' ' 92' ' ' ILE . 2.5 p -70.51 -36.5 66.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 122.39 1.09 . . . . 72.44 111.54 176.017 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.482 ' OG ' ' HB3' ' A' ' 9' ' ' GLU . 69.7 m -71.21 5.91 1.94 Allowed 'General case' 0 C--N 1.251 -3.709 0 CA-C-N 114.26 -1.336 . . . . 71.22 113.61 176.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.445 HD11 ' HB2' ' A' ' 19' ' ' TRP . 4.0 tp -67.83 -18.95 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 123.95 0.9 . . . . 74.45 109.288 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.449 ' HZ3' ' O ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -56.35 -18.04 9.67 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.617 1.167 . . . . 70.41 113.833 -176.627 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -136.38 80.36 0.3 Allowed Glycine 0 N--CA 1.427 -1.912 0 N-CA-C 109.782 -1.327 . . . . 61.33 109.782 175.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.453 ' HA ' ' OD1' ' A' ' 14' ' ' ASN . 94.7 Cg_endo -85.47 40.83 0.83 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.225 2.617 . . . . 74.53 110.442 -177.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 . . . . . 0 C--N 1.288 -2.103 0 CA-C-N 114.323 -1.308 . . . . 64.3 108.403 -176.778 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.494 -1.262 0 N-CA-C 110.697 -0.961 . . . . 62.04 110.697 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -68.85 112.1 2.81 Favored 'Trans proline' 0 C--O 1.238 0.498 0 C-N-CA 122.874 2.382 . . . . 63.52 111.74 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -92.22 -26.22 18.28 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 109.547 -0.538 . . . . 71.12 109.547 178.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 120.52 100.91 1.81 Allowed Glycine 0 N--CA 1.431 -1.668 0 N-CA-C 111.077 -0.809 . . . . 71.41 111.077 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.5 m 69.11 178.51 0.25 Allowed 'General case' 0 C--O 1.247 0.942 0 C-N-CA 124.358 1.063 . . . . 65.21 112.344 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 31.5 tpp -84.48 -16.86 40.98 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-O 121.531 0.682 . . . . 60.33 109.26 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -87.84 23.7 1.96 Allowed 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.773 -0.649 . . . . 63.15 111.433 -176.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.4 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -79.24 -21.24 46.46 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 122.066 0.936 . . . . 73.01 109.21 174.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.511 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.8 OUTLIER -60.85 -30.53 70.18 Favored 'General case' 0 C--O 1.202 -1.407 0 CA-C-N 114.232 -1.349 . . . . 74.21 112.955 -179.26 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.617 ' HB2' HD12 ' A' ' 11' ' ' ILE . 65.9 m -58.22 -38.68 77.28 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 122.186 0.993 . . . . 71.51 110.141 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.617 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.2 mp -79.74 -37.21 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.855 0 CA-C-N 113.413 -1.721 . . . . 64.15 109.94 -175.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -89.84 -4.56 57.52 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.979 -0.555 . . . . 55.12 111.201 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.4 mt 65.88 140.41 0.03 OUTLIER 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.532 1.933 . . . . 63.12 115.207 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -83.64 81.76 8.61 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.597 -2.371 . . . . 75.01 104.597 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.443 ' H ' HD23 ' A' ' 18' ' ' LEU . 25.5 t-20 -103.95 154.7 19.35 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-N 115.568 -0.742 . . . . 62.32 111.998 -171.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -52.85 -29.04 25.75 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.917 1.687 . . . . 62.44 111.607 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -57.7 -42.51 83.87 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.738 0.815 . . . . 74.25 110.365 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.623 HD12 HD22 ' A' ' 94' ' ' LEU . 3.0 mm? -67.01 -40.09 87.21 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.882 -0.599 . . . . 64.41 109.835 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -66.86 -47.51 71.67 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.287 -0.87 . . . . 75.3 109.731 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.14 -37.18 86.53 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.25 -0.432 . . . . 75.41 111.543 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -64.1 -50.45 68.24 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 110.27 -0.271 . . . . 74.2 110.27 175.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 40.7 tp -60.31 -53.01 62.7 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.721 -0.672 . . . . 62.41 110.166 -178.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.0 t -58.93 -42.17 85.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 C-N-CA 123.299 0.64 . . . . 54.21 112.592 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 52.5 ttt180 -70.98 -45.36 64.17 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.019 -0.672 . . . . 74.41 110.73 -176.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -66.25 -39.65 89.65 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.181 -0.674 . . . . 71.32 109.181 -177.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.589 HD13 HD23 ' A' ' 33' ' ' LEU . 7.9 mt -72.14 -25.48 61.73 Favored 'General case' 0 C--N 1.307 -1.283 0 N-CA-C 112.817 0.673 . . . . 72.3 112.817 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -68.13 -21.67 64.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.245 -1.02 . . . . 51.54 108.245 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 29.5 mtmt -92.26 -5.72 51.83 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.531 0.681 . . . . 54.42 109.948 178.361 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.434 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.4 m-80 -135.65 53.81 9.14 Favored Pre-proline 0 C--O 1.242 0.693 0 CA-C-N 115.403 -0.817 . . . . 53.02 112.06 -177.202 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.7 Cg_exo -68.96 -22.28 36.05 Favored 'Trans proline' 0 C--N 1.36 1.165 0 N-CA-C 108.881 -1.238 . . . . 64.23 108.881 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -67.55 -44.87 77.23 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 113.717 -1.583 . . . . 72.33 110.006 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.451 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 66.3 t90 -74.9 -44.9 46.24 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 119.708 -0.797 . . . . 71.41 110.062 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.589 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -58.01 -48.02 81.3 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.464 -1.244 . . . . 64.22 111.452 -173.175 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.697 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 19.6 p -54.5 -53.44 54.39 Favored 'General case' 0 C--O 1.21 -1.009 0 O-C-N 123.673 0.608 . . . . 75.24 111.791 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.61 -40.9 63.18 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.528 1.131 . . . . 63.41 112.687 176.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.451 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.3 mmmt -74.07 -30.51 62.41 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 120.288 -0.565 . . . . 75.12 111.543 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 95.4 mt -62.32 -37.95 87.56 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 108.836 -0.801 . . . . 73.3 108.836 172.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.697 ' HG3' ' O ' ' A' ' 34' ' ' SER . 74.7 mtp180 -62.54 -31.34 72.1 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.41 0.624 . . . . 62.24 111.199 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 39.4 m -73.07 -33.92 65.94 Favored 'General case' 0 N--CA 1.401 -2.897 0 C-N-CA 125.014 1.326 . . . . 64.12 111.814 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.618 ' CD1' HG23 ' A' ' 72' ' ' THR . 60.7 m-85 -95.93 -51.38 4.48 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.661 -0.7 . . . . 71.2 112.589 -176.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.549 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -96.71 111.26 56.78 Favored Pre-proline 0 N--CA 1.429 -1.522 0 N-CA-C 108.581 -0.896 . . . . 71.22 108.581 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.61 -11.93 16.9 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.582 2.188 . . . . 72.53 112.615 -177.219 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.5 p -114.34 29.52 7.96 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 123.619 0.768 . . . . 73.14 112.161 -176.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.674 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -47.51 111.51 0.43 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 115.222 1.564 . . . . 74.34 115.222 -175.624 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.48 65.83 0.69 Allowed 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 104.758 -2.312 . . . . 71.43 104.758 170.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.674 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.9 pp -91.96 -17.28 25.38 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.628 -1.624 . . . . 71.12 111.341 -171.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.0 -9.08 54.01 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.352 -0.84 . . . . 71.35 112.112 -174.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.0 m -80.15 89.13 5.42 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 115.484 -0.78 . . . . 62.53 112.17 -177.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -111.82 82.87 1.69 Allowed 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.6 -0.889 . . . . 74.4 108.6 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.86 -46.2 90.45 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 122.449 1.118 . . . . 65.13 111.708 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.493 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 53.9 mm-40 -101.26 168.92 8.43 Favored Pre-proline 0 C--N 1.244 -3.996 0 N-CA-C 105.469 -2.049 . . . . 63.14 105.469 175.135 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 54' ' ' ASN . 23.4 Cg_exo -67.51 -144.33 0.02 OUTLIER 'Trans proline' 0 CA--C 1.551 1.354 0 C-N-CA 122.616 2.211 . . . . 71.54 112.826 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -76.12 36.87 0.15 Allowed 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.079 0.952 . . . . 61.43 111.409 -177.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.482 ' O ' HG12 ' A' ' 58' ' ' ILE . 5.2 m-20 -67.45 149.06 98.56 Favored Pre-proline 0 N--CA 1.432 -1.33 0 C-N-CA 126.162 1.785 . . . . 74.03 112.419 -175.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.538 ' HG2' ' OE2' ' A' ' 56' ' ' GLU . 16.1 Cg_endo -61.99 -28.24 80.43 Favored 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.016 2.477 . . . . 61.11 111.598 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.538 ' OE2' ' HG2' ' A' ' 55' ' ' PRO . 3.4 mp0 -67.53 -37.9 83.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.526 -0.916 . . . . 73.35 108.526 177.05 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.493 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 84.9 t -74.29 -36.64 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 114.4 -1.273 . . . . 74.22 109.574 -178.701 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 54' ' ' ASN . 48.6 mm -64.72 -44.78 96.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.527 -0.76 . . . . 63.02 109.147 174.64 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.453 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 59.8 t-80 -56.79 -40.84 76.64 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 123.254 0.621 . . . . 71.12 110.437 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.474 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 3.2 tpt180 -53.66 -48.19 69.66 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 125.16 1.384 . . . . 72.32 110.954 177.425 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.524 ' HB3' HD11 ' A' ' 37' ' ' LEU . 62.8 mt-30 -70.72 -50.97 30.6 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.869 -1.06 . . . . 65.3 110.756 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.426 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.2 mm? -66.78 -30.42 70.62 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 114.562 -1.199 . . . . 71.11 112.695 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 56.9 t30 -52.95 -40.39 63.62 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 125.132 1.373 . . . . 72.12 110.717 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.549 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 29.3 mmt180 -60.43 -30.76 69.83 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 72.13 112.976 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.03 -38.14 72.58 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.347 . . . . 42.43 110.886 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -71.71 -27.83 63.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.283 -0.636 . . . . 73.34 109.283 177.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.71 -31.94 72.23 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 115.189 -0.914 . . . . 72.34 109.665 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.405 ' CB ' HG21 ' A' ' 72' ' ' THR . 8.7 mm-40 -70.84 -54.44 11.56 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 109.273 -0.64 . . . . 71.21 109.273 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -177.96 146.56 7.6 Favored Glycine 0 N--CA 1.417 -2.614 0 C-N-CA 120.447 -0.882 . . . . 70.24 113.111 -175.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -69.73 -26.76 64.48 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 106.056 -1.831 . . . . 55.0 106.056 169.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.83 -31.61 63.3 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 113.658 -1.61 . . . . 64.43 108.189 175.132 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.618 HG23 ' CD1' ' A' ' 40' ' ' PHE . 51.6 m -71.25 -39.67 71.48 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 115.538 -0.756 . . . . 64.04 111.07 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.494 ' HD1' ' O ' ' A' ' 95' ' ' VAL . 47.3 t-105 -63.9 -35.01 79.24 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 107.696 -1.224 . . . . 72.43 107.696 174.131 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.941 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 78.5 tttt -62.23 -45.85 91.5 Favored 'General case' 1 N--CA 1.366 -4.671 0 N-CA-C 114.832 1.419 . . . . 73.32 114.832 173.292 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.2 m -62.75 -34.95 78.26 Favored 'General case' 0 N--CA 1.41 -2.425 0 CA-C-O 122.081 0.943 . . . . 71.12 109.342 175.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' PHE . . . . . 0.417 ' HB3' ' O ' ' A' ' 73' ' ' TRP . 73.2 t80 -62.26 -52.44 63.72 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 113.835 -1.529 . . . . 60.4 112.623 -178.708 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.709 HG13 ' HA ' ' A' ' 95' ' ' VAL . 50.2 mm -68.04 -29.13 43.65 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 C-N-CA 119.022 -1.071 . . . . 74.21 111.094 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -63.76 -41.22 98.02 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.188 -0.46 . . . . 73.23 110.93 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -76.12 -37.04 58.57 Favored 'General case' 0 C--O 1.21 -1.015 0 C-N-CA 120.412 -0.515 . . . . 73.2 110.307 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.49 -54.21 24.03 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.989 1.315 . . . . 71.04 109.388 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.462 ' SG ' HD13 ' A' ' 88' ' ' LEU . 60.1 m -64.16 -38.36 90.77 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.405 -0.816 . . . . 71.55 111.654 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -75.57 -48.18 23.46 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.067 -0.515 . . . . 75.0 111.404 -175.83 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -76.48 -33.66 58.68 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 114.918 1.451 . . . . 74.2 114.918 -175.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.6 mt -83.14 -21.63 33.54 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.661 -0.815 . . . . 74.03 111.324 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 70.89 -9.06 0.87 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.321 1.048 . . . . 62.31 112.935 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.02 137.56 94.65 Favored Pre-proline 0 N--CA 1.437 -1.11 0 N-CA-C 109.092 -0.707 . . . . 75.13 109.092 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -84.41 102.81 0.9 Allowed 'Trans proline' 0 N--CA 1.436 -1.854 0 C-N-CA 121.755 1.637 . . . . 61.23 112.978 -177.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.462 HD13 ' SG ' ' A' ' 81' ' ' CYS . 4.5 mp -90.96 -41.07 11.33 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 107.936 -1.135 . . . . 61.44 107.936 173.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.9 t70 68.71 -54.33 0.55 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.531 1.532 . . . . 74.43 112.923 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 64.4 mtt -96.94 82.3 3.22 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.593 -0.892 . . . . 53.05 108.593 175.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -71.3 -34.31 70.5 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 125.735 1.614 . . . . 73.14 112.257 -176.093 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.563 ' HB ' ' HD3' ' A' ' 93' ' ' PRO . 50.1 mm -49.66 -52.07 54.04 Favored Pre-proline 0 CA--C 1.572 1.792 0 C-N-CA 125.004 1.322 . . . . 72.52 113.475 -173.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.563 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 13.8 Cg_exo -58.84 -37.94 91.12 Favored 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 121.526 1.484 . . . . 74.31 111.649 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.636 ' O ' HG22 ' A' ' 97' ' ' ILE . 4.2 mm? -64.04 -37.46 87.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.567 0.747 . . . . 42.53 111.286 176.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.941 ' CG2' ' HA ' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -85.69 -27.64 6.32 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.179 0 CA-C-O 121.877 0.846 . . . . 74.5 112.712 -171.234 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . 0.447 ' CB ' ' HG2' ' A' ' 9' ' ' GLU . 9.4 t -101.66 5.3 41.43 Favored 'General case' 0 C--N 1.256 -3.485 0 C-N-CA 119.245 -0.982 . . . . 72.33 111.279 -177.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.636 HG22 ' O ' ' A' ' 94' ' ' LEU . 15.5 tt -77.14 -49.62 22.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 112.643 0.609 . . . . 73.44 112.643 -177.589 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.2 m0 66.19 -31.52 0.16 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 126.23 1.812 . . . . 64.32 113.124 -176.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 97' ' ' ILE . . . 105.3 -174.19 21.06 Favored Glycine 0 N--CA 1.429 -1.78 0 N-CA-C 110.822 -0.911 . . . . 62.24 110.822 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.46 109.66 0.78 Allowed 'Trans proline' 0 C--O 1.25 1.1 0 C-N-CA 122.501 2.134 . . . . 60.01 110.59 176.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 . . . . . 0 N--CA 1.42 -1.94 0 N-CA-C 108.48 -0.933 . . . . 64.2 108.48 -179.768 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.307 0 N-CA-C 110.779 -0.928 . . . . 71.22 110.779 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -64.86 -24.09 61.51 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 122.75 2.3 . . . . 64.14 114.012 -177.538 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.8 mp -108.76 155.23 21.0 Favored 'General case' 0 C--O 1.245 0.867 0 O-C-N 122.254 -0.279 . . . . 75.22 110.382 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.88 -95.11 0.1 OUTLIER Glycine 0 N--CA 1.438 -1.195 0 N-CA-C 110.833 -0.907 . . . . 61.43 110.833 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.433 ' HB2' ' HB2' ' A' ' 8' ' ' ALA . 49.5 m -139.72 120.32 14.19 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.98 -0.748 . . . . 65.51 108.98 179.147 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.543 ' SD ' ' HB3' ' A' ' 74' ' ' LYS . 34.6 tpp -81.03 -12.28 59.38 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-O 121.621 0.724 . . . . 73.24 110.53 -176.982 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -109.03 24.96 12.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.743 -0.662 . . . . 75.32 110.606 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.514 ' HA ' HD13 ' A' ' 11' ' ' ILE . . . -79.46 -7.43 58.41 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.111 0.958 . . . . 72.0 109.721 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.408 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -69.85 -30.05 67.44 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.937 1.295 . . . . 75.3 111.791 -178.987 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.735 ' HB2' HD12 ' A' ' 11' ' ' ILE . 49.6 m -57.39 -29.32 63.99 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 125.418 1.487 . . . . 73.33 110.348 174.236 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.735 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -88.13 -34.28 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.218 0 CA-C-N 114.126 -1.397 . . . . 74.31 111.666 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -75.22 -66.63 0.74 Allowed 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.223 1.564 . . . . 74.34 115.223 -167.02 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 54.9 177.09 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 115.31 1.596 . . . . 70.11 115.31 -178.562 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 38.7 t30 68.92 126.66 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 125.317 1.447 . . . . 64.51 110.472 -176.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.534 ' HB2' HG13 ' A' ' 97' ' ' ILE . 9.1 p30 -150.84 28.21 0.69 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 114.315 1.228 . . . . 74.45 114.315 -173.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.48 -49.97 67.07 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.294 -0.963 . . . . 60.51 113.288 -176.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -75.52 -33.03 60.69 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.246 -1.02 . . . . 73.45 108.246 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.646 HD21 ' HA ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -55.76 -46.61 77.83 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 113.73 -1.577 . . . . 74.05 111.262 178.865 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -59.57 -48.15 82.8 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.431 -0.804 . . . . 74.51 110.986 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.71 65.91 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.2 -0.455 . . . . 73.34 111.362 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.42 ' HE1' HD21 ' A' ' 88' ' ' LEU . 42.1 t-105 -71.1 -51.4 25.33 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 110.269 -0.271 . . . . 70.11 110.269 175.203 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.91 -51.17 67.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.023 -0.535 . . . . 73.32 110.473 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.5 t -60.11 -45.14 96.15 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-N 115.602 -0.727 . . . . 75.3 112.73 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 75.7 ttt180 -71.82 -41.93 67.61 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.483 -0.487 . . . . 74.2 110.864 -177.44 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.498 HD12 HD13 ' A' ' 84' ' ' LEU . 1.9 tm? -65.66 -41.91 91.96 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.255 0.55 . . . . 73.43 109.864 -177.15 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.662 HD13 HD23 ' A' ' 33' ' ' LEU . 4.3 mt -72.17 -24.96 61.52 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.342 0.497 . . . . 73.43 112.342 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.8 t -67.04 -24.65 66.02 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 108.4 -0.963 . . . . 71.14 108.4 177.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 59.5 mttt -87.02 -12.95 45.85 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.612 -0.722 . . . . 44.22 109.66 178.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.416 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.6 m-80 -129.97 54.06 13.43 Favored Pre-proline 0 N--CA 1.444 -0.747 0 CA-C-N 115.353 -0.84 . . . . 64.24 113.208 -173.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.416 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.0 Cg_exo -69.48 -22.2 33.72 Favored 'Trans proline' 0 C--N 1.357 1.003 0 N-CA-C 108.24 -1.485 . . . . 64.45 108.24 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.83 -41.8 91.32 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.593 -1.639 . . . . 74.34 109.893 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.5 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 76.5 t90 -75.3 -43.64 49.9 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.518 -0.873 . . . . 74.45 109.934 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.662 HD23 HD13 ' A' ' 26' ' ' LEU . 1.9 tm? -60.69 -40.16 91.16 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.38 -1.282 . . . . 73.42 111.191 -173.335 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.543 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 51.0 p -53.46 -53.52 50.26 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.196 0.31 . . . . 74.1 111.21 176.915 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.432 ' HA ' ' NE ' ' A' ' 38' ' ' ARG . . . -52.1 -48.62 64.65 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.519 1.528 . . . . 74.43 112.192 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 69.0 mmtt -69.27 -32.03 70.95 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 120.424 -0.51 . . . . 34.31 111.921 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.566 HD12 HD22 ' A' ' 46' ' ' LEU . 37.4 mt -67.15 -31.05 71.22 Favored 'General case' 0 C--O 1.187 -2.212 0 C-N-CA 120.127 -0.629 . . . . 74.43 110.367 173.701 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 34' ' ' SER . 24.6 mtm180 -61.79 -33.61 74.42 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.792 0.806 . . . . 74.22 109.589 177.253 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' SER . . . . . 0.41 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 75.3 m -78.4 -29.66 47.34 Favored 'General case' 0 N--CA 1.398 -3.073 0 C-N-CA 125.126 1.37 . . . . 64.33 113.174 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.571 ' CD1' HG23 ' A' ' 72' ' ' THR . 52.5 m-85 -102.16 -46.63 4.78 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 112.863 0.69 . . . . 74.31 112.863 -178.243 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 8.7 mp -91.29 135.59 28.03 Favored Pre-proline 0 C--N 1.294 -1.84 0 C-N-CA 124.491 1.116 . . . . 52.15 110.701 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -90.86 -14.44 1.89 Allowed 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.343 2.029 . . . . 60.02 110.453 169.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.2 p -114.01 28.2 8.94 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 124.44 1.096 . . . . 71.22 111.531 -175.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.488 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -68.43 113.2 5.78 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.664 -1.153 . . . . 73.54 112.733 -177.295 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -147.14 75.55 1.38 Allowed 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 114.364 -1.289 . . . . 71.15 109.008 173.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.566 HD22 HD12 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -92.81 -12.29 31.55 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.126 -1.397 . . . . 65.44 108.744 -179.268 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.98 -16.66 63.79 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.264 -1.335 . . . . 72.45 111.538 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 51.8 t -79.72 92.95 5.47 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 106.98 -1.489 . . . . 64.43 106.98 173.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.5 m -91.32 86.34 6.09 Favored 'General case' 0 N--CA 1.411 -2.378 0 CA-C-O 121.783 0.802 . . . . 72.02 111.733 -176.094 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -41.57 82.05 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.867 1.318 . . . . 74.12 108.597 173.035 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.586 ' HG3' ' CG2' ' A' ' 57' ' ' VAL . 2.5 pt-20 -137.34 163.37 49.38 Favored Pre-proline 0 C--N 1.258 -3.386 0 CA-C-N 112.216 -2.265 . . . . 63.14 108.097 170.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 51' ' ' GLU . 57.8 Cg_endo -69.42 -156.43 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.814 2.343 . . . . 64.11 113.057 -177.301 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 m -75.59 38.75 0.15 Allowed 'General case' 0 C--O 1.251 1.157 0 C-N-CA 124.616 1.166 . . . . 71.3 112.571 -176.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.462 ' HB2' HG23 ' A' ' 57' ' ' VAL . 95.8 m-20 -58.47 152.06 46.65 Favored Pre-proline 0 N--CA 1.436 -1.17 0 C-N-CA 125.5 1.52 . . . . 72.41 111.025 177.607 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.73 -39.11 90.95 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.514 2.809 . . . . 75.45 112.732 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -72.75 -31.96 65.31 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.683 -0.69 . . . . 72.43 110.05 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.586 ' CG2' ' HG3' ' A' ' 51' ' ' GLU . 67.5 t -69.66 -46.33 75.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.298 -0.864 . . . . 61.34 108.89 178.232 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.444 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.5 mm -59.45 -46.92 92.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.037 -0.983 . . . . 75.54 109.338 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -55.93 -39.68 72.04 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.791 0.436 . . . . 73.35 111.483 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -64.07 -39.82 94.92 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.349 0.595 . . . . 64.04 111.2 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.45 HE21 HG12 ' A' ' 57' ' ' VAL . 78.2 mt-30 -70.81 -45.49 64.51 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.019 -0.992 . . . . 74.13 110.395 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -66.14 -31.08 71.71 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.254 -1.339 . . . . 51.34 111.509 -178.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 50.5 t30 -52.75 -43.06 65.51 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.869 1.268 . . . . 74.13 110.57 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.88 -30.09 63.55 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.305 -1.316 . . . . 73.24 113.076 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.439 HD12 HD13 ' A' ' 62' ' ' LEU . 90.9 mt -72.34 -42.29 65.51 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-O 120.623 0.249 . . . . 62.42 111.431 -177.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -70.55 -28.14 64.68 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.367 -0.975 . . . . 65.34 108.367 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.56 -41.07 96.54 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.079 -0.964 . . . . 44.25 109.841 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.497 ' HB2' HG21 ' A' ' 72' ' ' THR . 43.5 mm-40 -63.96 -47.19 81.4 Favored 'General case' 0 N--CA 1.426 -1.666 0 N-CA-C 109.641 -0.503 . . . . 63.23 109.641 176.201 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -176.92 143.44 6.31 Favored Glycine 0 N--CA 1.407 -3.261 0 C-N-CA 120.356 -0.926 . . . . 73.34 113.841 -176.111 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -69.87 -27.11 64.55 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 106.565 -1.643 . . . . 74.44 106.565 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.05 -37.66 58.03 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.407 -1.269 . . . . 34.33 108.473 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.571 HG23 ' CD1' ' A' ' 40' ' ' PHE . 94.0 m -59.6 -35.66 74.76 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.093 -0.958 . . . . 75.24 110.754 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.559 ' CD1' HG23 ' A' ' 95' ' ' VAL . 58.5 t-105 -63.88 -42.69 97.44 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 109.668 -0.493 . . . . 75.23 109.668 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.782 ' HA ' HG21 ' A' ' 95' ' ' VAL . 50.3 mttt -62.84 -47.09 84.9 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.198 0.599 . . . . 75.55 110.887 177.278 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.7 m -61.32 -40.8 95.55 Favored 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 115.914 -0.584 . . . . 71.12 110.882 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -60.64 -50.65 72.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.363 -0.835 . . . . 64.2 111.016 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.532 HG13 ' HA ' ' A' ' 95' ' ' VAL . 32.4 mm -66.88 -33.38 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 120.482 -0.487 . . . . 63.42 111.528 -175.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -60.63 -43.16 97.85 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.862 -0.422 . . . . 52.12 109.862 176.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.3 m-20 -71.66 -42.11 67.92 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.98 -0.554 . . . . 72.43 111.274 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.45 ' HA ' ' CZ2' ' A' ' 32' ' ' TRP . 2.4 tm? -50.45 -54.62 20.7 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.346 1.458 . . . . 72.35 109.774 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 88' ' ' LEU . 46.9 t -67.55 -32.21 72.83 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.806 -1.088 . . . . 73.1 111.24 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -72.85 -44.58 61.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.448 -0.796 . . . . 74.3 111.65 -176.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 9.8 mt-10 -89.24 -19.67 25.09 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 113.98 1.104 . . . . 63.55 113.98 -171.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.498 HD13 HD12 ' A' ' 25' ' ' LEU 0.255 85.3 mt -82.16 49.13 1.35 Allowed 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 115.658 1.725 . . . . 70.23 115.658 -174.579 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.464 ' OD2' HG23 ' A' ' 86' ' ' VAL . 26.6 t70 71.73 -73.11 0.1 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.684 1.364 . . . . 43.43 114.684 173.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.464 HG23 ' OD2' ' A' ' 85' ' ' ASP . 71.3 t -99.77 124.46 43.94 Favored Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 122.385 -0.197 . . . . 73.44 110.917 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.28 107.06 0.76 Allowed 'Trans proline' 0 C--O 1.252 1.202 0 C-N-CA 122.845 2.363 . . . . 74.12 111.481 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.44 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 4.8 mp -64.45 -38.87 92.55 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.312 -0.858 . . . . 70.4 109.606 179.459 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.9 t70 65.38 9.94 6.13 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-O 122.818 1.294 . . . . 45.31 111.333 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.455 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 25.5 ptm -124.43 39.95 3.85 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 107.657 -1.238 . . . . 74.2 107.657 177.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -40.13 95.05 Favored 'General case' 0 C--O 1.203 -1.386 0 CA-C-N 114.021 -1.445 . . . . 63.04 111.003 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.729 ' HA ' HG12 ' A' ' 95' ' ' VAL . 31.1 mm -64.53 -48.33 74.76 Favored Pre-proline 0 C--N 1.29 -2.003 0 CA-C-O 119.088 -0.482 . . . . 70.41 111.518 179.433 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.455 ' HD2' ' C ' ' A' ' 90' ' ' MET . 84.6 Cg_exo -51.23 -38.44 61.4 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 121.507 1.471 . . . . 75.23 111.01 170.077 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.646 ' HA ' HD21 ' A' ' 18' ' ' LEU . 3.2 mm? -63.48 -46.47 86.0 Favored 'General case' 0 C--O 1.188 -2.178 0 O-C-N 123.371 0.42 . . . . 74.12 112.076 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.782 HG21 ' HA ' ' A' ' 74' ' ' LYS . 5.7 p -68.79 -31.53 51.12 Favored 'Isoleucine or valine' 0 C--O 1.251 1.18 0 CA-C-O 122.377 1.084 . . . . 72.23 112.817 -178.822 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.5 t -62.36 -6.86 3.59 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 113.329 -1.759 . . . . 62.14 111.621 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.534 HG13 ' HB2' ' A' ' 15' ' ' ASN . 15.3 tt -61.21 -28.58 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 124.333 1.053 . . . . 75.35 111.869 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' TRP . . . . . 0.485 ' O ' ' HD3' ' A' ' 100' ' ' PRO . 34.0 t-105 -151.73 -20.44 0.19 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 120.539 -0.465 . . . . 72.13 111.478 -174.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -114.3 88.53 0.48 Allowed Glycine 0 N--CA 1.435 -1.409 0 C-N-CA 119.874 -1.155 . . . . 70.1 111.972 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' PRO . . . . . 0.485 ' HD3' ' O ' ' A' ' 98' ' ' TRP . 19.4 Cg_endo -99.01 105.62 0.06 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.541 0 C-N-CA 123.079 2.519 . . . . 60.21 111.734 175.594 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 . . . . . 0 N--CA 1.428 -1.561 0 C-N-CA 126.932 2.093 . . . . 73.34 112.036 178.386 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.855 0 N-CA-C 109.948 -1.261 . . . . 50.3 109.948 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -71.82 -32.1 11.94 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.638 2.225 . . . . 64.54 112.581 -178.21 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mp -93.49 119.63 32.8 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 120.786 0.326 . . . . 72.32 110.389 -178.357 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.14 112.83 1.93 Allowed Glycine 0 N--CA 1.426 -1.998 0 C-N-CA 120.448 -0.882 . . . . 72.04 111.538 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.4 t 74.61 -64.02 0.4 Allowed 'General case' 0 C--O 1.242 0.667 0 C-N-CA 124.998 1.319 . . . . 64.43 111.393 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.503 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 2.1 mpt? 61.29 19.1 9.84 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 124.404 1.081 . . . . 74.23 111.343 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -81.16 24.58 0.52 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 113.055 0.761 . . . . 74.41 113.055 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.433 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.46 -17.66 56.0 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.425 -0.583 . . . . 74.31 109.425 174.116 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 6' ' ' MET . 0.3 OUTLIER -54.18 -43.63 70.85 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.078 0.951 . . . . 74.45 111.527 178.973 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -55.83 -31.54 62.81 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 124.743 1.217 . . . . 72.42 111.224 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.433 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.2 mp -87.6 -34.84 7.65 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 C-N-CA 124.825 1.25 . . . . 65.34 111.521 -176.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -91.63 -44.27 9.14 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 115.436 1.643 . . . . 75.33 115.436 -171.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 64.44 171.01 0.19 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.778 0.831 . . . . 75.22 112.989 -174.532 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.414 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 4.4 p-10 -108.56 -176.97 3.19 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 112.724 0.638 . . . . 65.31 112.724 -175.138 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.5 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 45.2 t-20 -155.26 142.95 19.78 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.557 -0.905 . . . . 74.34 108.557 -176.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.83 -29.83 67.19 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.779 0.659 . . . . 71.53 112.779 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -68.41 -32.85 73.18 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 122.405 1.098 . . . . 62.03 108.959 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.529 HD21 ' HA ' ' A' ' 94' ' ' LEU . 7.0 tt -69.92 -35.11 74.31 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 113.158 -1.837 . . . . 74.34 109.568 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 59.2 t-105 -63.63 -44.97 92.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.596 -0.52 . . . . 75.43 109.596 175.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.46 -40.99 93.18 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.033 -0.531 . . . . 74.14 110.308 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -57.49 -50.57 72.64 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.643 -0.708 . . . . 65.53 110.704 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.48 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 57.4 tp -59.53 -51.32 70.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.059 -0.519 . . . . 74.23 110.609 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.54 -51.4 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.095 -0.502 . . . . 71.13 111.984 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 31.3 mmt180 -70.27 -38.46 75.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.964 0.357 . . . . 75.33 111.964 -174.304 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -66.47 -41.52 88.89 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.881 -0.785 . . . . 75.3 108.881 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.701 HD13 HD23 ' A' ' 33' ' ' LEU . 5.4 mt -70.71 -24.89 62.73 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.412 0.523 . . . . 71.32 112.412 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.1 m -68.46 -20.91 64.65 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.024 -0.732 . . . . 73.11 109.024 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 34.1 mtmt -92.06 -3.56 55.61 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.799 -0.637 . . . . 63.31 109.31 177.998 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.437 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 54.1 m-80 -137.53 54.08 7.48 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 115.641 -0.709 . . . . 65.42 111.945 -177.163 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 13.4 Cg_exo -70.41 -19.86 32.5 Favored 'Trans proline' 0 C--N 1.358 1.044 0 N-CA-C 108.643 -1.329 . . . . 71.53 108.643 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -69.56 -43.93 71.9 Favored 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.06 -1.427 . . . . 51.55 109.731 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.0 t90 -74.77 -43.05 56.87 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 120.133 -0.627 . . . . 74.33 110.196 177.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.701 HD23 HD13 ' A' ' 26' ' ' LEU . 2.4 tm? -59.77 -45.78 91.2 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.178 -0.919 . . . . 72.33 111.016 -173.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.407 ' HB2' HD22 ' A' ' 46' ' ' LEU . 32.1 p -62.54 -35.37 79.23 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 112.025 0.38 . . . . 25.12 112.025 178.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.53 99.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.469 0.652 . . . . 65.24 110.391 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.9 mmtt -72.48 -31.7 65.61 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 120.234 -0.586 . . . . 73.02 111.714 175.931 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 73.0 mt -58.43 -50.84 72.25 Favored 'General case' 0 C--O 1.201 -1.462 0 CA-C-O 119.864 -0.112 . . . . 72.34 111.229 176.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -60.4 -30.49 69.63 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.232 0.826 . . . . 74.52 113.232 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.4 m -72.38 -50.13 28.83 Favored 'General case' 1 N--CA 1.375 -4.214 0 CA-C-N 114.55 -1.204 . . . . 74.14 112.078 176.61 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.437 ' CD1' HG23 ' A' ' 72' ' ' THR . 55.5 m-85 -80.8 -43.89 19.37 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.507 0.929 . . . . 72.4 113.507 -175.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.6 ' HG ' ' OE1' ' A' ' 68' ' ' GLN . 6.5 mp -79.43 124.78 83.89 Favored Pre-proline 0 C--N 1.287 -2.116 0 C-N-CA 124.125 0.97 . . . . 62.11 111.605 -176.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -82.08 -10.33 11.45 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.875 1.716 . . . . 70.42 107.957 168.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 p -111.48 29.33 7.92 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 127.29 2.236 . . . . 74.31 109.987 -178.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.314 0.0 OUTLIER -54.0 92.41 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 116.502 2.038 . . . . 73.14 116.502 -179.401 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASP . . . . . 0.641 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 8.7 m-20 -118.44 81.65 1.72 Allowed 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.607 -1.627 . . . . 74.4 106.607 174.557 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.407 HD22 ' HB2' ' A' ' 34' ' ' SER . 3.7 pp -95.51 -6.52 40.37 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.161 -1.381 . . . . 62.45 111.52 -176.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.78 4.0 49.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.391 -0.822 . . . . 75.34 110.375 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' CYS . . . . . 0.641 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 64.3 m -88.32 30.46 0.88 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.414 0.626 . . . . 73.4 111.57 -177.173 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -80.2 89.51 5.46 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 109.236 -0.653 . . . . 64.2 109.236 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.37 -25.51 65.11 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.049 -0.978 . . . . 72.52 112.584 178.288 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -132.58 167.75 21.15 Favored Pre-proline 1 N--CA 1.378 -4.039 0 CA-C-N 113.925 -1.489 . . . . 65.44 107.176 178.098 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -63.79 -141.06 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.388 2.725 . . . . 72.03 113.285 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -76.21 37.65 0.16 Allowed 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.773 0.829 . . . . 65.33 111.963 -177.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.465 ' HB2' HG23 ' A' ' 57' ' ' VAL . 6.4 m120 -67.64 145.78 98.3 Favored Pre-proline 0 C--N 1.301 -1.519 0 C-N-CA 124.497 1.119 . . . . 55.51 111.491 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.1 -38.2 92.57 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.413 2.742 . . . . 71.2 113.187 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.08 -28.69 60.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.741 0.305 . . . . 61.42 110.359 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.465 HG23 ' HB2' ' A' ' 54' ' ' ASN . 86.1 t -66.04 -50.9 66.04 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.511 0 N-CA-C 107.835 -1.172 . . . . 74.53 107.835 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.4 mm -59.67 -42.7 89.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.329 -1.305 . . . . 63.13 109.873 177.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -58.44 -36.29 73.42 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.978 -0.556 . . . . 63.12 111.592 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 31.7 ttm-85 -63.16 -41.79 99.3 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.951 0.882 . . . . 71.12 110.731 177.247 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 74.6 mt-30 -67.23 -39.65 86.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.547 -1.206 . . . . 74.4 110.313 -177.056 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.462 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -74.09 -31.05 62.65 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.8 -1.091 . . . . 72.04 110.676 177.138 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.433 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 8.6 t30 -61.87 -35.51 78.51 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 124.247 1.019 . . . . 70.22 109.364 178.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -58.26 -55.84 29.85 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 114.98 -1.009 . . . . 74.4 110.257 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.599 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 79.6 mt -57.27 -33.83 68.02 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.929 0.491 . . . . 74.32 111.327 -177.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -57.15 -45.86 83.21 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.554 -0.748 . . . . 72.13 109.561 176.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.4 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 61.51 110.811 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.6 ' OE1' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -60.25 -47.68 84.98 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 123.842 0.857 . . . . 73.4 111.067 177.046 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 166.47 138.46 2.44 Favored Glycine 0 N--CA 1.411 -3.03 0 C-N-CA 119.867 -1.159 . . . . 55.2 112.695 -178.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.442 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -70.29 -27.07 64.11 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 105.913 -1.884 . . . . 75.41 105.913 170.42 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.4 67.59 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.111 -1.404 . . . . 54.03 108.044 175.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.495 HG21 ' HB3' ' A' ' 68' ' ' GLN . 98.7 m -64.93 -34.43 78.38 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.356 -0.838 . . . . 52.45 110.087 177.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.642 ' HD1' HG23 ' A' ' 95' ' ' VAL . 33.1 t-105 -66.56 -39.52 88.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.503 -0.554 . . . . 73.43 109.503 179.062 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.778 ' HA ' HG21 ' A' ' 95' ' ' VAL . 84.3 mttt -57.17 -52.0 67.06 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 122.874 0.469 . . . . 74.41 111.084 174.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.6 m -58.09 -41.82 84.31 Favored 'General case' 0 N--CA 1.411 -2.383 0 CA-C-O 121.791 0.805 . . . . 62.41 110.13 178.17 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -61.12 -49.96 75.16 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 114.497 -1.229 . . . . 74.12 111.567 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.538 HG21 ' O ' ' A' ' 91' ' ' GLU . 49.1 mm -68.15 -31.38 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 119.676 -0.809 . . . . 65.13 112.01 -175.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -62.04 -37.47 85.04 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.195 0.521 . . . . 73.21 109.745 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.21 -35.92 47.9 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.426 -0.51 . . . . 75.51 111.733 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -53.02 -54.88 28.77 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 124.657 1.183 . . . . 75.1 109.004 178.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 14.8 p -68.34 -36.82 79.82 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.839 -0.618 . . . . 63.2 112.605 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.66 -54.43 7.44 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.932 -0.576 . . . . 54.13 112.029 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -76.31 -21.31 56.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.93 1.085 . . . . 75.13 113.93 -172.593 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.33 19.21 2.83 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 112.21 0.448 . . . . 72.12 112.21 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 72.94 -63.33 0.44 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.478 1.511 . . . . 75.25 112.65 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.5 m -72.63 120.69 82.04 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-O 121.115 0.483 . . . . 74.34 112.087 -176.163 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -72.1 117.38 5.11 Favored 'Trans proline' 0 N--CA 1.44 -1.652 0 C-N-CA 121.813 1.675 . . . . 55.24 109.719 177.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.5 mt -79.97 -28.94 39.5 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 116.231 -0.44 . . . . 75.2 110.231 -178.202 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.9 t70 71.66 -44.47 0.59 Allowed 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 126.116 1.766 . . . . 74.3 111.301 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.489 ' O ' HD23 ' A' ' 94' ' ' LEU . 67.8 mtt -84.22 47.92 1.41 Allowed 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 125.192 1.397 . . . . 72.13 110.273 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.538 ' O ' HG21 ' A' ' 77' ' ' ILE . 10.7 pt-20 -70.68 -35.63 72.91 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.254 0.55 . . . . 74.42 111.147 -178.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.778 ' HA ' HG12 ' A' ' 95' ' ' VAL . 24.4 mm -63.96 -47.8 79.61 Favored Pre-proline 0 C--O 1.184 -2.354 0 CA-C-O 118.292 -0.861 . . . . 60.12 111.028 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.463 ' HD2' ' C ' ' A' ' 90' ' ' MET . 25.4 Cg_exo -48.76 -37.41 35.44 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 122.098 1.865 . . . . 73.13 112.176 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.529 ' HA ' HD21 ' A' ' 18' ' ' LEU . 4.5 mm? -67.51 -36.42 81.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.193 0.597 . . . . 74.35 111.287 175.983 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.778 HG21 ' HA ' ' A' ' 74' ' ' LYS . 7.5 p -84.58 -32.69 7.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-O 122.178 0.99 . . . . 71.24 113.026 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.5 t -63.13 -6.5 4.28 Favored 'General case' 0 C--N 1.271 -2.845 0 CA-C-N 113.935 -1.484 . . . . 73.55 112.427 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.414 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 13.8 tt -71.63 -17.36 19.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-O 121.829 0.823 . . . . 53.32 109.654 177.493 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.43 29.64 5.29 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 104.899 -2.26 . . . . 70.2 104.899 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -104.77 -171.61 24.51 Favored Glycine 0 N--CA 1.424 -2.121 0 CA-C-N 113.575 -1.648 . . . . 71.24 111.348 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -74.85 115.83 4.41 Favored 'Trans proline' 0 N--CA 1.444 -1.431 0 C-N-CA 123.296 2.664 . . . . 65.0 112.427 -174.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 . . . . . 0 C--N 1.295 -1.781 0 CA-C-N 115.43 -0.805 . . . . 75.41 108.878 176.481 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.606 0 N-CA-C 110.701 -0.96 . . . . 71.22 110.701 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -80.56 -178.37 4.4 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.795 2.33 . . . . 73.12 111.172 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.6 mt -61.15 107.18 0.7 Allowed 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.256 0.551 . . . . 75.32 109.587 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.36 -45.21 1.08 Allowed Glycine 0 N--CA 1.428 -1.877 0 N-CA-C 110.475 -1.05 . . . . 52.43 110.475 -175.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.5 m -72.31 127.27 32.05 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.28 -1.008 . . . . 52.04 108.28 176.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.538 ' SD ' HD12 ' A' ' 92' ' ' ILE . 47.8 tpp 72.21 4.24 4.95 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 122.57 1.176 . . . . 74.41 110.005 -176.698 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ASP . . . . . 0.455 ' O ' HD13 ' A' ' 11' ' ' ILE . 52.4 m-20 -118.88 24.76 10.65 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-N 114.157 -1.383 . . . . 75.02 108.524 177.587 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.52 -19.74 52.26 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.935 -0.765 . . . . 45.4 108.935 175.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.476 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -53.66 -45.5 70.28 Favored 'General case' 0 C--O 1.207 -1.148 0 N-CA-C 114.735 1.383 . . . . 75.41 114.735 -177.248 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 10' ' ' SER . . . . . 0.539 ' HB2' HD12 ' A' ' 11' ' ' ILE . 73.0 m -65.24 -35.91 82.51 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-O 121.74 0.781 . . . . 72.44 111.895 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.539 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.4 -41.06 14.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 C-N-CA 124.383 1.073 . . . . 55.55 111.852 -172.202 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmm180 -103.18 7.89 38.59 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.846 0.858 . . . . 72.43 112.008 -172.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -43.78 126.43 4.65 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.571 1.322 . . . . 71.33 114.571 -173.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -152.36 132.07 13.17 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 103.642 -2.725 . . . . 70.35 103.642 174.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -118.84 -61.37 1.66 Allowed 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.667 -0.813 . . . . 63.41 112.841 -174.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -71.11 -48.4 52.43 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.349 0.499 . . . . 62.14 112.349 -171.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 82.5 m-20 -66.1 -35.83 81.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.871 0.844 . . . . 51.22 109.557 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -70.43 -42.32 71.72 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 114.304 -1.316 . . . . 74.12 110.051 -178.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -60.0 -51.37 69.95 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.575 -0.528 . . . . 72.32 109.575 175.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -57.71 -48.54 79.28 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.79 -0.641 . . . . 73.11 111.119 -178.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.693 ' CH2' ' HB2' ' A' ' 25' ' ' LEU . 7.7 t-105 -56.25 -50.91 69.98 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 123.252 0.345 . . . . 72.13 111.276 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.89 -42.73 94.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 110.358 -0.238 . . . . 63.43 110.358 -176.361 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.41 -46.04 97.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.248 -0.433 . . . . 65.34 110.787 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.594 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 67.0 mtt180 -62.85 -48.17 80.18 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 109.786 -0.45 . . . . 73.02 109.786 178.49 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.693 ' HB2' ' CH2' ' A' ' 21' ' ' TRP . 30.1 tp -55.45 -48.56 74.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.693 1.197 . . . . 72.44 111.705 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.582 HD13 HD23 ' A' ' 33' ' ' LEU . 9.8 mt -73.65 -23.98 59.93 Favored 'General case' 0 C--N 1.281 -2.393 0 CA-C-N 115.475 -0.784 . . . . 63.42 112.73 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.6 t -75.22 -16.93 60.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 107.735 -1.209 . . . . 62.2 107.735 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.594 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 39.1 mtmt -90.61 -13.81 33.65 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.361 -0.607 . . . . 64.23 109.361 174.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.482 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.0 m-80 -137.34 49.48 2.84 Favored Pre-proline 0 C--O 1.241 0.657 0 CA-C-N 115.489 -0.778 . . . . 65.01 112.187 -175.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.482 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.1 Cg_exo -71.33 -20.79 27.41 Favored 'Trans proline' 0 C--N 1.362 1.265 0 N-CA-C 108.522 -1.376 . . . . 65.15 108.522 -178.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.14 -39.45 78.83 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 113.851 -1.522 . . . . 74.42 109.839 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.559 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 61.4 t90 -74.08 -40.13 62.97 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 118.872 -1.131 . . . . 74.02 109.136 178.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.582 HD23 HD13 ' A' ' 26' ' ' LEU . 1.4 tm? -62.84 -39.86 95.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 114.674 -1.148 . . . . 75.5 109.783 -175.411 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.502 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 65.9 m -53.28 -49.53 66.75 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 123.468 0.48 . . . . 74.33 111.024 175.31 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.46 -46.09 73.25 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.332 1.053 . . . . 64.52 112.002 177.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.424 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 67.5 mmtt -68.6 -35.33 77.18 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 121.054 -0.258 . . . . 74.41 111.433 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.9 mt -60.24 -34.31 73.51 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 122.333 -0.229 . . . . 61.04 110.523 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ARG . . . . . 0.502 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -61.75 -35.93 79.54 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.635 0.731 . . . . 63.11 110.264 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.1 m -78.69 -28.52 45.23 Favored 'General case' 0 N--CA 1.402 -2.856 0 C-N-CA 125.362 1.465 . . . . 73.41 113.055 -177.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.602 ' CD1' HG23 ' A' ' 72' ' ' THR . 61.4 m-85 -102.44 -45.8 4.97 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.75 1.019 . . . . 54.42 113.75 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.0 125.53 70.28 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 114.359 1.244 . . . . 74.34 114.359 -173.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.64 -0.3 5.83 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 122.555 2.17 . . . . 53.25 108.396 166.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 p -106.89 17.48 23.06 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 126.297 1.839 . . . . 52.35 109.902 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.24 92.07 0.04 OUTLIER 'General case' 0 N--CA 1.41 -2.459 0 CA-C-N 114.168 -1.378 . . . . 73.24 111.269 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -129.47 56.6 1.7 Allowed 'General case' 0 CA--C 1.484 -1.588 0 N-CA-C 102.811 -3.033 . . . . 72.1 102.811 169.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 pp -90.2 -18.4 25.8 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.484 -1.689 . . . . 52.25 110.051 -171.802 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.94 -19.88 64.19 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 114.729 -1.123 . . . . 55.33 109.833 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 49.2 t -100.85 107.78 19.4 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.504 -1.225 . . . . 74.33 107.762 177.55 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.4 m -133.28 117.39 17.31 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.677 0.751 . . . . 73.34 110.799 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.97 -15.04 62.98 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.5 -1.227 . . . . 73.13 114.028 -178.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -137.0 165.86 31.62 Favored Pre-proline 0 N--CA 1.382 -3.848 0 N-CA-C 107.423 -1.325 . . . . 64.42 107.423 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.67 -149.51 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.241 1.961 . . . . 73.43 110.737 175.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.2 m -76.2 37.9 0.17 Allowed 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.019 0.928 . . . . 61.13 112.61 -176.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.41 ' HB2' HG23 ' A' ' 57' ' ' VAL . 80.3 m-20 -63.69 153.01 84.96 Favored Pre-proline 0 N--CA 1.448 -0.562 0 C-N-CA 123.968 0.907 . . . . 74.12 112.196 -177.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.79 -44.56 43.98 Favored 'Trans proline' 0 C--N 1.363 1.301 0 C-N-CA 123.828 3.019 . . . . 65.31 113.341 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -73.92 -23.1 59.49 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 112.301 0.482 . . . . 71.44 112.301 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 91.6 t -75.59 -36.87 35.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.093 -1.077 . . . . 71.4 108.093 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 mm -64.53 -45.59 95.16 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.036 -1.098 . . . . 72.21 108.036 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -54.16 -42.7 69.89 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.011 0.924 . . . . 74.4 110.462 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.639 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 36.2 ttt180 -54.5 -49.11 70.93 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.583 1.553 . . . . 73.34 110.831 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 90.4 mt-30 -64.58 -48.71 73.96 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.298 -0.865 . . . . 74.23 111.173 -177.407 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.514 HD12 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -72.13 -30.55 65.17 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.86 -1.064 . . . . 64.14 111.546 -175.202 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -53.35 -50.5 64.9 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 124.382 1.073 . . . . 71.43 111.01 175.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -54.92 -32.28 61.05 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.007 -1.451 . . . . 62.43 112.831 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.7 mt -72.18 -43.46 64.51 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.559 -0.291 . . . . 52.13 111.019 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' PHE . . . . . 0.52 ' CE1' ' HG2' ' A' ' 70' ' ' MET . 78.1 t80 -68.04 -30.21 69.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.768 -0.827 . . . . 70.04 108.768 177.544 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.56 68.73 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.038 -0.983 . . . . 42.12 110.777 176.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.44 ' HB2' HG21 ' A' ' 72' ' ' THR . 10.3 mm-40 -70.93 -55.43 8.4 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 108.748 -0.834 . . . . 72.34 108.748 174.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.63 145.97 9.13 Favored Glycine 0 CA--C 1.476 -2.364 0 CA-C-N 115.147 -0.933 . . . . 64.25 112.016 -175.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.52 ' HG2' ' CE1' ' A' ' 66' ' ' PHE . 66.3 mtm -70.52 -27.97 64.58 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 105.51 -2.033 . . . . 72.12 105.51 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' ALA . . . . . 0.504 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . . . -74.13 -39.4 63.35 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.342 -1.754 . . . . 72.54 108.719 175.895 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.602 HG23 ' CD1' ' A' ' 40' ' ' PHE . 66.8 m -58.87 -42.05 88.53 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.693 -0.685 . . . . 75.11 109.286 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.532 ' HD1' HG23 ' A' ' 95' ' ' VAL . 70.4 t-105 -65.88 -40.51 91.65 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 116.307 -0.406 . . . . 70.44 111.556 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.713 ' CB ' HG21 ' A' ' 95' ' ' VAL . 14.7 ptpt -67.93 -41.89 81.86 Favored 'General case' 0 CA--C 1.506 -0.72 0 O-C-N 121.518 -0.739 . . . . 71.23 112.22 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.3 m -63.69 -37.15 86.27 Favored 'General case' 0 N--CA 1.406 -2.674 0 CA-C-N 115.332 -0.849 . . . . 73.51 110.171 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.41 -50.72 71.7 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.174 -0.921 . . . . 71.13 111.557 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.511 HG21 ' O ' ' A' ' 91' ' ' GLU . 47.3 mm -62.55 -32.12 54.29 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.407 0.622 . . . . 64.55 111.013 -176.046 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -57.61 -45.75 84.94 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.826 -1.079 . . . . 70.42 110.151 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 10.5 m-20 -78.19 -38.42 43.37 Favored 'General case' 0 C--O 1.21 -0.974 0 CA-C-N 116.407 -0.36 . . . . 72.54 111.408 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.559 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.2 tm? -50.07 -55.01 16.57 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 125.492 1.517 . . . . 74.22 110.552 -178.698 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' CYS . . . . . 0.434 ' SG ' ' HG3' ' A' ' 91' ' ' GLU . 51.3 m -67.83 -32.68 73.39 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.893 -0.594 . . . . 73.44 111.701 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -70.73 -51.51 26.82 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.61 -0.723 . . . . 73.32 111.163 -177.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 13.4 mt-10 -79.23 -17.43 54.8 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 112.98 0.733 . . . . 61.24 112.98 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.4 11.11 22.54 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.168 0.509 . . . . 54.43 111.431 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 69.62 -59.71 0.49 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.142 1.534 . . . . 53.24 115.142 172.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 31.1 m -70.29 132.53 87.87 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 112.343 0.497 . . . . 63.13 112.343 -175.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 86' ' ' VAL . 17.3 Cg_exo -68.11 109.4 1.95 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.468 2.112 . . . . 71.24 109.252 175.218 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.5 mt -79.75 -44.17 21.21 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 116.503 -0.317 . . . . 74.34 111.435 -174.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 26.0 t0 71.18 161.99 0.24 Allowed 'General case' 0 C--O 1.243 0.76 0 C-N-CA 125.259 1.424 . . . . 74.43 109.945 -175.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 65.86 23.22 11.36 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.572 -0.529 . . . . 53.01 109.572 -171.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.629 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 33.4 tt0 -56.28 -37.75 70.25 Favored 'General case' 0 C--O 1.21 -0.992 0 C-N-CA 125.641 1.576 . . . . 71.25 111.359 -177.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.553 ' HA ' HG12 ' A' ' 95' ' ' VAL . 38.5 mm -72.16 -48.78 10.18 Favored Pre-proline 0 C--N 1.274 -2.705 0 O-C-N 120.983 -1.073 . . . . 73.33 109.996 178.653 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.476 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 68.1 Cg_exo -51.35 -29.9 32.19 Favored 'Trans proline' 0 CA--C 1.563 1.928 0 C-N-CA 121.311 1.341 . . . . 73.22 111.844 166.085 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.629 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 9.2 mp -59.63 -36.5 76.47 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.835 -0.432 . . . . 62.25 109.835 171.666 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.713 HG21 ' CB ' ' A' ' 74' ' ' LYS . 3.7 p -85.88 -41.63 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-O 122.375 1.083 . . . . 54.34 113.246 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.2 m -71.4 7.17 1.45 Allowed 'General case' 0 C--N 1.246 -3.904 0 C-N-CA 125.189 1.396 . . . . 65.44 113.845 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 15.1 tt -73.34 -17.9 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 N-CA-C 114.193 1.183 . . . . 75.5 114.193 -172.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -89.28 -78.49 0.35 Allowed 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 114.738 1.385 . . . . 74.4 114.738 -174.13 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -120.52 -108.95 2.18 Favored Glycine 0 N--CA 1.429 -1.783 0 CA-C-N 115.931 -0.577 . . . . 43.31 113.332 -170.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -55.96 116.76 3.4 Favored 'Trans proline' 0 C--O 1.248 1.006 0 C-N-CA 123.406 2.737 . . . . 63.12 113.448 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? . . . . . 0 N--CA 1.436 -1.154 0 N-CA-C 107.977 -1.12 . . . . 72.25 107.977 172.815 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 111.076 -0.81 . . . . 73.44 111.076 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -92.91 30.54 0.29 Allowed 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 123.616 2.877 . . . . 74.2 112.39 -176.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 65.94 95.74 0.06 Allowed 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.166 0.986 . . . . 75.13 111.807 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.39 -50.2 33.85 Favored Glycine 0 CA--C 1.489 -1.551 0 N-CA-C 108.795 -1.722 . . . . 61.34 108.795 176.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.6 m -80.95 99.15 8.24 Favored 'General case' 0 N--CA 1.417 -2.11 0 N-CA-C 107.376 -1.342 . . . . 62.53 107.376 174.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' MET . . . . . 0.403 ' HG3' HD11 ' A' ' 92' ' ' ILE . 22.5 ttt -80.04 -18.37 50.31 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.005 0.907 . . . . 63.21 109.698 -176.389 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -91.29 25.83 2.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.267 -0.879 . . . . 71.43 109.926 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ALA . . . . . 0.423 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -76.7 -10.35 59.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.937 -1.029 . . . . 52.02 108.882 173.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . 0.615 ' OE2' ' HE2' ' A' ' 74' ' ' LYS . 6.1 pt-20 -58.64 -38.68 78.62 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.241 -0.891 . . . . 74.4 109.697 175.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 50.0 m -57.78 -26.73 62.33 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.226 1.41 . . . . 71.44 111.165 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ILE . . . . . 0.423 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -88.04 -27.59 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.471 -1.241 . . . . 74.21 110.66 -176.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -82.55 -66.82 0.84 Allowed 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.793 1.034 . . . . 73.11 113.793 -172.688 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 43.99 -172.19 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.508 1.67 . . . . 71.11 115.508 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.9 t30 40.19 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 126.679 1.992 . . . . 74.4 115.843 171.325 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -179.48 108.24 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.57 0.7 . . . . 75.24 110.356 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -71.98 -28.42 63.4 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 124.636 1.174 . . . . 61.45 112.526 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -58.6 -27.6 64.8 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.782 0.66 . . . . 63.32 112.782 -174.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.48 ' HB2' HD12 ' A' ' 97' ' ' ILE . 3.1 mm? -64.32 -36.3 83.68 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 121.099 -0.24 . . . . 73.44 110.519 176.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TRP . . . . . 0.514 ' HB2' HD11 ' A' ' 97' ' ' ILE . 74.7 t-105 -69.63 -49.58 52.54 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.128 -0.487 . . . . 75.44 110.219 -176.818 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.27 -39.75 91.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.136 -0.484 . . . . 61.12 110.813 179.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TRP . . . . . 0.502 ' HE1' ' HG ' ' A' ' 88' ' ' LEU . 13.6 t-105 -60.85 -50.32 73.89 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.202 -0.454 . . . . 74.25 110.306 176.084 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -57.63 -53.07 62.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 124.073 0.858 . . . . 70.34 109.418 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.1 t -58.41 -47.36 88.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.873 -0.603 . . . . 60.13 112.227 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.489 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 74.7 mtp180 -69.18 -44.42 72.22 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 112.163 0.431 . . . . 63.4 112.163 -176.732 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.476 HD12 HD13 ' A' ' 84' ' ' LEU . 1.8 tm? -67.57 -39.84 84.9 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.199 -0.667 . . . . 75.23 109.199 -176.316 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 4.7 mt -73.9 -25.1 59.83 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.165 -0.471 . . . . 75.41 112.233 177.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -67.02 -20.99 65.95 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.176 -1.046 . . . . 64.42 108.176 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 33.5 mtmt -91.79 -15.21 28.61 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.548 0.69 . . . . 62.34 109.716 177.629 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.447 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -129.84 51.86 8.28 Favored Pre-proline 0 C--O 1.241 0.647 0 CA-C-N 115.375 -0.829 . . . . 61.41 112.683 -175.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.447 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.8 Cg_exo -68.56 -20.66 40.88 Favored 'Trans proline' 0 C--N 1.365 1.416 0 N-CA-C 108.546 -1.367 . . . . 64.32 108.546 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -63.25 -43.21 98.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 113.187 -1.824 . . . . 75.32 109.549 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TRP . . . . . 0.458 ' HE1' ' HG3' ' A' ' 83' ' ' GLU . 67.8 t90 -76.02 -47.7 23.82 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 121.943 0.878 . . . . 65.54 110.419 176.419 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.488 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.3 tm? -58.89 -44.29 91.12 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.181 -1.372 . . . . 62.35 112.221 -172.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.7 p -52.76 -54.15 37.98 Favored 'General case' 0 C--N 1.316 -0.879 0 O-C-N 123.54 0.525 . . . . 64.22 111.67 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.24 -45.49 76.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.108 1.363 . . . . 72.41 111.703 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -64.6 -43.9 92.32 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 112.511 0.56 . . . . 74.52 112.511 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.578 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 77.2 mt -55.54 -39.68 70.87 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 123.382 0.426 . . . . 72.14 111.135 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -62.29 -26.23 68.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.387 0.613 . . . . 73.03 112.224 -178.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.6 t -83.52 -22.26 32.51 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.693 -0.685 . . . . 54.52 110.311 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PHE . . . . . 0.458 ' CD1' HG23 ' A' ' 72' ' ' THR . 48.4 m-85 -98.05 -57.42 2.22 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.281 -0.418 . . . . 64.23 111.784 -178.095 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.561 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.4 mm? -85.34 113.19 49.14 Favored Pre-proline 0 N--CA 1.423 -1.778 0 N-CA-C 109.009 -0.737 . . . . 74.31 109.009 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.17 -33.38 72.56 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.276 2.651 . . . . 72.41 115.532 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.49 28.22 8.9 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 121.912 0.863 . . . . 61.2 112.525 -176.059 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' A' ' 37' ' ' LEU . 23.2 ttm -89.25 106.55 18.51 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 115.275 1.583 . . . . 75.24 115.275 -175.791 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -111.78 79.23 1.19 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.214 -2.143 . . . . 50.14 105.214 169.44 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.19 -2.0 57.96 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.145 -0.934 . . . . 41.44 111.727 -173.153 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -78.39 45.84 0.59 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 122.818 1.294 . . . . 73.0 112.678 -174.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -117.04 97.92 6.19 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 107.118 -1.438 . . . . 63.15 107.118 174.217 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.2 m -81.86 83.72 7.11 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-O 121.86 0.838 . . . . 74.12 112.053 -175.074 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.74 -33.55 58.11 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-O 122.529 1.157 . . . . 65.2 110.837 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -137.48 167.51 20.32 Favored Pre-proline 0 N--CA 1.384 -3.769 0 C-N-CA 126.695 1.998 . . . . 72.14 106.501 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -81.93 -148.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 122.001 1.801 . . . . 72.32 110.664 174.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.4 m -76.26 37.28 0.16 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 124.291 1.036 . . . . 73.22 111.776 -176.589 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASN . . . . . 0.483 ' HB2' HG23 ' A' ' 57' ' ' VAL . 76.5 m-20 -64.18 148.25 95.85 Favored Pre-proline 0 N--CA 1.44 -0.975 0 C-N-CA 123.605 0.762 . . . . 73.31 112.983 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -58.31 -35.12 99.04 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 123.479 2.786 . . . . 65.41 112.68 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -72.6 -31.27 65.05 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.171 0.51 . . . . 71.4 109.96 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.483 HG23 ' HB2' ' A' ' 54' ' ' ASN . 94.6 t -67.8 -52.03 44.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.347 -0.983 . . . . 73.41 108.347 177.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 47.1 mm -55.06 -43.45 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 114.478 -1.237 . . . . 72.31 109.849 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -58.71 -40.53 83.98 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.133 -0.94 . . . . 72.34 111.039 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.416 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 37.0 ttt180 -64.81 -37.55 88.01 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.681 0.753 . . . . 72.52 110.554 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.451 ' O ' ' HB2' ' A' ' 64' ' ' ARG . 94.5 mt-30 -72.66 -48.68 37.29 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 114.492 -1.231 . . . . 72.34 111.525 -176.648 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -67.36 -30.61 70.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 115.269 -0.878 . . . . 62.34 110.885 -178.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.416 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 50.9 t30 -54.06 -46.08 71.86 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.658 1.183 . . . . 74.23 110.222 174.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ARG . . . . . 0.561 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 26.1 mmt180 -56.39 -36.65 69.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 114.626 -1.17 . . . . 62.35 112.594 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LEU . . . . . 0.511 HD12 HD13 ' A' ' 62' ' ' LEU . 97.8 mt -71.04 -31.0 67.34 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.7 0.259 . . . . 62.12 111.7 -177.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -59.32 -35.74 74.37 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.055 -0.72 . . . . 74.2 109.055 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.82 -27.41 60.28 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 115.072 -0.967 . . . . 73.21 112.103 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.419 ' CB ' HG21 ' A' ' 72' ' ' THR . 5.1 mm-40 -70.66 -52.7 19.47 Favored 'General case' 0 N--CA 1.423 -1.778 0 C-N-CA 120.824 -0.35 . . . . 63.11 111.36 -179.131 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.42 143.75 5.32 Favored Glycine 0 CA--C 1.477 -2.319 0 C-N-CA 118.835 -1.65 . . . . 61.44 114.537 -173.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.418 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.2 ptm -67.38 -30.67 70.51 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.887 -1.523 . . . . 71.2 106.887 168.417 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.7 -37.37 59.54 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 114.36 -1.291 . . . . 40.43 108.538 177.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' THR . . . . . 0.458 HG23 ' CD1' ' A' ' 40' ' ' PHE . 86.6 m -62.19 -38.73 90.21 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 114.912 -1.04 . . . . 65.14 111.089 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' TRP . . . . . 0.518 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 39.8 t-105 -68.25 -36.06 78.86 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.491 -0.559 . . . . 71.15 109.491 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . 0.615 ' HE2' ' OE2' ' A' ' 9' ' ' GLU . 85.5 mttt -58.17 -52.27 66.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 120.763 0.316 . . . . 74.4 110.199 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -60.34 -38.48 83.91 Favored 'General case' 0 N--CA 1.405 -2.688 0 CA-C-N 115.433 -0.803 . . . . 72.21 111.136 179.147 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -61.14 -50.58 72.63 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-N 115.112 -0.949 . . . . 74.51 110.798 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ILE . . . . . 0.509 HG21 ' O ' ' A' ' 91' ' ' GLU . 46.5 mm -70.15 -30.89 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.627 -0.829 . . . . 53.03 110.573 -177.469 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.84 -47.47 82.59 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.376 -0.829 . . . . 74.31 109.874 176.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -73.28 -37.25 66.32 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.951 -0.568 . . . . 74.32 111.239 177.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 0.417 HD12 HD21 ' A' ' 88' ' ' LEU . 1.9 tm? -50.45 -54.27 23.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.846 1.259 . . . . 74.31 109.449 178.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.6 m -66.71 -44.4 81.76 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.687 -0.688 . . . . 65.13 111.347 -178.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -61.62 -54.24 45.59 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.291 0.567 . . . . 65.42 111.097 -175.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . 0.458 ' HG3' ' HE1' ' A' ' 32' ' ' TRP . 22.5 mm-40 -70.21 -40.62 74.43 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.173 -0.921 . . . . 74.41 113.485 -175.194 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.476 HD13 HD12 ' A' ' 25' ' ' LEU . 82.6 mt -80.32 -39.8 27.98 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 120.011 -0.676 . . . . 53.35 112.63 -174.638 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -169.2 -96.62 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.03 0.377 . . . . 65.13 110.821 179.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.492 ' HB ' ' HD2' ' A' ' 87' ' ' PRO . 34.8 m -141.04 173.28 5.04 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 104.945 -2.243 . . . . 63.14 104.945 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.492 ' HD2' ' HB ' ' A' ' 86' ' ' VAL . 5.6 Cg_endo -50.89 105.48 0.1 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 121.859 1.706 . . . . 71.21 110.3 171.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LEU . . . . . 0.588 HD22 ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -50.39 -53.3 30.28 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 125.314 1.446 . . . . 74.32 111.227 -172.446 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -154.2 48.81 0.62 Allowed 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 104.344 -2.465 . . . . 50.11 104.344 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' MET . . . . . 0.518 ' O ' HD23 ' A' ' 94' ' ' LEU . 65.7 mtt 74.31 146.14 0.08 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.655 -2.066 . . . . 71.34 109.84 -170.529 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLU . . . . . 0.509 ' O ' HG21 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -71.73 -35.18 70.08 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.273 1.035 . . . . 73.41 110.817 178.107 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.684 ' HA ' HG12 ' A' ' 95' ' ' VAL . 31.3 mm -59.42 -49.8 90.58 Favored Pre-proline 0 C--N 1.279 -2.487 0 CA-C-N 114.353 -1.294 . . . . 74.33 114.043 -172.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' PRO . . . . . 0.407 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 74.8 Cg_exo -54.85 -35.46 88.78 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.211 1.941 . . . . 74.51 111.259 174.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 90' ' ' MET . 4.0 mm? -71.42 -33.6 69.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.845 -1.07 . . . . 63.42 110.916 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' VAL . . . . . 0.684 HG12 ' HA ' ' A' ' 92' ' ' ILE . 4.3 p -83.59 -33.63 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 C-N-CA 119.355 -0.938 . . . . 71.24 112.3 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.3 t -55.71 -26.39 44.98 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 113.768 -1.56 . . . . 54.14 112.068 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.514 HD11 ' HB2' ' A' ' 19' ' ' TRP . 12.0 tt -69.02 -30.38 46.45 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.096 0 CA-C-N 116.505 -0.316 . . . . 45.35 110.59 -177.683 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 16.7 t90 28.49 80.77 0.02 OUTLIER 'General case' 0 C--O 1.244 0.812 0 C-N-CA 127.265 2.226 . . . . 72.42 116.019 -177.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.64 -172.45 23.88 Favored Glycine 0 N--CA 1.418 -2.516 0 CA-C-N 115.042 -0.981 . . . . 62.14 112.243 175.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -91.17 48.96 0.7 Allowed 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 123.866 3.044 . . . . 74.45 111.409 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 . . . . . 0 C--N 1.3 -1.573 0 CA-C-N 115.957 -0.565 . . . . 72.31 110.606 179.97 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.41 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 42.8 tpp . . . . . 0 C--O 1.222 -0.368 0 CA-C-O 122.065 0.936 . . . . 73.2 108.98 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -74.8 24.85 0.09 Allowed 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 114.338 1.236 . . . . 75.41 114.338 -174.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.429 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.2 -15.1 59.63 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 122.411 1.1 . . . . 51.51 109.588 178.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 96' ' ' SER . 1.1 pt-20 -65.35 -41.71 93.57 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 113.808 -1.542 . . . . 71.22 111.52 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.2 m -74.89 -17.23 60.61 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.448 -0.797 . . . . 70.43 109.857 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.429 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.9 mm -87.48 -50.67 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-O 122.138 0.971 . . . . 60.3 108.887 -176.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.3 mmt180 -84.72 6.7 23.2 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.911 -1.495 . . . . 72.13 113.148 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -44.14 122.53 2.96 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 124.902 1.281 . . . . 71.55 112.798 -177.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.407 ' OD1' ' HG ' ' A' ' 18' ' ' LEU . 28.0 t-20 -162.86 150.73 13.73 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 104.559 -2.385 . . . . 71.32 104.559 176.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . 0.28 21.8 p30 -145.72 -44.5 0.21 Allowed 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 115.562 1.69 . . . . 73.24 115.562 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.52 -46.32 90.47 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 119.201 0.91 . . . . 71.32 111.833 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -67.29 -44.23 79.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.985 -0.552 . . . . 74.03 109.832 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.407 ' HG ' ' OD1' ' A' ' 14' ' ' ASN . 89.5 mt -66.07 -39.54 90.16 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.375 -0.829 . . . . 73.32 111.58 -177.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 73.0 t-105 -65.42 -43.84 89.29 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 110.274 -0.269 . . . . 75.35 110.274 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.98 -44.36 96.25 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 120.863 0.363 . . . . 72.34 110.666 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 17.9 t-105 -60.45 -48.59 81.1 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.587 -0.733 . . . . 75.31 110.583 175.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.463 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 33.9 tp -58.4 -53.04 62.81 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.675 -0.693 . . . . 73.4 109.862 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -53.85 -46.09 63.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 123.528 0.731 . . . . 64.13 112.441 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.552 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 3.9 mmp_? -72.4 -43.39 63.97 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 120.18 -0.608 . . . . 72.53 112.396 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.426 HD12 HD13 ' A' ' 84' ' ' LEU . 2.1 tm? -68.21 -42.34 80.0 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.047 0.451 . . . . 62.32 109.81 -176.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 33' ' ' LEU . 1.2 mt -68.56 -25.75 65.06 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 122.854 0.461 . . . . 72.42 110.936 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.4 t -71.56 -18.53 62.24 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 108.99 -0.744 . . . . 75.32 108.99 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.552 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.32 -2.29 52.44 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 121.725 0.774 . . . . 74.44 109.489 178.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.428 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.4 m-80 -137.92 50.21 3.11 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.165 -0.925 . . . . 73.11 111.78 -177.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.428 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.2 Cg_exo -65.62 -23.98 56.13 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 121.604 1.536 . . . . 65.2 109.197 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -66.1 -39.58 90.09 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 112.997 -1.911 . . . . 71.13 111.095 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.803 ' HE3' HD22 ' A' ' 33' ' ' LEU . 84.4 t90 -76.06 -44.73 37.64 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.492 -1.299 . . . . 75.24 107.492 -175.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.803 HD22 ' HE3' ' A' ' 32' ' ' TRP . 3.5 mm? -53.4 -56.96 12.51 Favored 'General case' 0 N--CA 1.407 -2.601 0 CA-C-N 113.015 -1.902 . . . . 64.52 113.61 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.552 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 3.4 p -53.74 -44.64 70.11 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.927 0.767 . . . . 63.31 111.133 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.92 72.23 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.673 1.589 . . . . 41.12 111.22 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.51 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.1 mmmt -69.28 -35.79 76.41 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-N 115.956 -0.565 . . . . 72.51 111.691 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 97.2 mt -60.61 -30.97 70.18 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 123.09 0.244 . . . . 52.34 110.817 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 34' ' ' SER . 10.3 mtp180 -66.85 -26.75 67.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.328 0.585 . . . . 73.55 111.906 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -78.4 -38.01 42.65 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.716 -0.674 . . . . 74.52 109.434 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.493 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 86.5 m-85 -80.31 -59.47 2.69 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.676 -0.693 . . . . 75.0 111.404 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.1 mm? -89.33 110.89 42.04 Favored Pre-proline 0 N--CA 1.432 -1.35 0 N-CA-C 109.269 -0.641 . . . . 63.22 109.269 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -70.85 -19.65 30.64 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.218 1.945 . . . . 73.23 111.851 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 p -114.13 28.58 8.65 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.086 -0.961 . . . . 71.42 109.935 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.844 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -43.33 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.941 1.4 . . . . 64.02 112.351 -175.432 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.09 60.06 4.71 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-O 123.088 1.423 . . . . 71.24 108.368 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.844 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.4 pp -81.03 -9.78 59.79 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.23 -1.805 . . . . 71.44 110.799 -176.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.25 -14.16 60.14 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.743 -1.117 . . . . 64.35 110.218 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.4 t -85.87 103.79 14.94 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 115.348 -0.842 . . . . 51.52 108.861 178.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.1 t -142.13 81.56 1.76 Allowed 'General case' 0 N--CA 1.428 -1.563 0 N-CA-C 107.878 -1.156 . . . . 70.02 107.878 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -39.58 94.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.84 -1.073 . . . . 73.22 111.743 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.25 155.85 53.26 Favored Pre-proline 0 N--CA 1.383 -3.819 0 CA-C-N 113.346 -1.752 . . . . 61.11 106.918 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.16 -145.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.558 1.677 0 C-N-CA 124.013 3.142 . . . . 52.42 112.164 174.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.0 m -74.73 38.37 0.12 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 123.864 0.866 . . . . 62.41 113.28 -175.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 57' ' ' VAL . 4.5 m-20 -62.08 149.52 86.18 Favored Pre-proline 0 N--CA 1.435 -1.196 0 C-N-CA 124.417 1.087 . . . . 72.42 110.544 177.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.45 -46.83 24.85 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 123.613 2.876 . . . . 65.44 113.703 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -74.34 -23.77 59.08 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.866 0.691 . . . . 64.35 112.866 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.46 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 87.0 t -72.7 -39.51 60.39 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 N-CA-C 108.289 -1.004 . . . . 70.35 108.289 177.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.11 -48.01 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 108.136 -1.061 . . . . 72.14 108.136 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 23.5 t-160 -52.03 -43.12 63.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.93 0.892 . . . . 74.33 110.708 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.406 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 65.2 ttt-85 -54.73 -41.37 70.29 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.084 0.953 . . . . 61.44 111.897 178.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.8 mt-30 -73.31 -39.45 65.3 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 115.225 -0.898 . . . . 71.24 110.509 -175.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -75.29 -31.09 60.59 Favored 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 114.603 -1.18 . . . . 73.34 110.883 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 28.6 t-20 -53.89 -47.03 71.52 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.691 1.196 . . . . 73.22 110.602 175.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.5 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 32.2 mmt-85 -53.84 -36.62 62.76 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 113.659 -1.61 . . . . 74.21 111.888 178.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.3 mt -72.05 -36.68 69.67 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.95 0.405 . . . . 63.43 111.051 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.43 -25.21 66.64 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.392 -0.822 . . . . 75.3 109.086 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -31.27 59.91 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.431 -0.804 . . . . 72.15 110.832 176.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.28 -57.17 5.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-O 121.436 0.636 . . . . 70.42 109.869 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -172.55 141.66 6.37 Favored Glycine 0 CA--C 1.466 -2.987 0 CA-C-N 115.122 -0.944 . . . . 21.25 111.387 -174.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.488 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 1.9 mpt? -70.45 -30.67 67.57 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.318 -1.734 . . . . 74.4 106.318 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.93 -29.01 58.19 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 113.437 -1.71 . . . . 74.41 108.11 176.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.3 m -70.47 -34.03 71.94 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.241 -0.89 . . . . 62.34 109.421 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.581 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 69.7 t-105 -63.67 -46.89 83.51 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.198 -0.668 . . . . 63.5 109.198 175.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 70' ' ' MET . 82.8 mttt -58.56 -36.0 73.24 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 115.968 -0.56 . . . . 65.45 111.521 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.43 ' O ' ' HB3' ' A' ' 78' ' ' ASN . 49.0 m -72.7 -47.22 48.97 Favored 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 123.147 0.579 . . . . 65.4 110.953 177.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.493 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 81.4 t80 -55.79 -50.44 70.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 123.328 0.651 . . . . 55.51 111.73 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.637 HG21 ' HB2' ' A' ' 94' ' ' LEU . 41.0 mm -62.87 -30.75 50.26 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.944 -0.571 . . . . 72.15 111.19 -176.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.43 ' HB3' ' O ' ' A' ' 75' ' ' SER . 3.6 t-20 -58.86 -46.51 87.58 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 109.422 -0.584 . . . . 64.1 109.422 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -73.16 -39.65 65.48 Favored 'General case' 0 C--O 1.198 -1.646 0 CA-C-N 115.487 -0.778 . . . . 70.32 110.445 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.428 HD21 HD21 ' A' ' 26' ' ' LEU . 2.3 tm? -50.33 -53.87 25.72 Favored 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 124.776 1.23 . . . . 74.51 109.249 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.98 -36.53 84.69 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.893 -0.594 . . . . 55.31 111.266 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -73.36 -54.2 8.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.98 0.419 . . . . 64.02 111.658 -176.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -74.98 -24.02 58.37 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.641 -0.709 . . . . 73.54 112.298 -172.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.426 HD13 HD12 ' A' ' 25' ' ' LEU . 85.4 mt -91.22 4.51 52.1 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.31 -0.556 . . . . 74.2 112.014 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 72.12 -46.84 0.65 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 114.221 1.193 . . . . 50.05 114.221 174.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.453 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 47.3 t -56.88 126.68 73.04 Favored Pre-proline 0 C--N 1.315 -0.909 0 C-N-CA 124.488 1.115 . . . . 73.12 112.864 -175.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 86' ' ' VAL . 5.3 Cg_endo -86.75 102.09 0.58 Allowed 'Trans proline' 0 N--CA 1.44 -1.64 0 C-N-CA 122.466 2.111 . . . . 60.44 110.426 173.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 mp -69.81 -53.15 19.55 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.211 -0.449 . . . . 54.14 109.84 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.1 t70 173.96 -50.77 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.557 1.143 . . . . 63.4 107.968 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.9 ttt -177.47 153.12 0.88 Allowed 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 104.89 -2.263 . . . . 53.13 104.89 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.547 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.1 pm0 -71.46 -42.37 68.23 Favored 'General case' 0 C--O 1.206 -1.216 0 CA-C-N 118.696 0.68 . . . . 73.32 112.342 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.637 ' O ' HG22 ' A' ' 95' ' ' VAL . 35.1 mm -54.23 -39.39 74.22 Favored Pre-proline 0 CA--C 1.594 2.66 0 C-N-CA 125.486 1.514 . . . . 64.25 114.118 -175.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -52.3 -41.8 64.12 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 122.126 1.884 . . . . 72.14 111.035 170.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.637 ' HB2' HG21 ' A' ' 77' ' ' ILE . 3.7 mm? -76.29 -25.03 54.45 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.756 -1.111 . . . . 75.22 110.128 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.637 HG22 ' O ' ' A' ' 92' ' ' ILE . 4.6 m -74.62 -29.02 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-O 122.43 1.11 . . . . 63.04 110.789 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.478 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 6.0 t -81.76 1.18 35.73 Favored 'General case' 0 C--N 1.275 -2.631 0 CA-C-N 113.846 -1.524 . . . . 64.52 111.476 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 18.2 tt -57.38 -30.84 36.77 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 N-CA-C 112.981 0.734 . . . . 73.43 112.981 -173.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 24.5 p-90 . . . . . 0 C--N 1.318 -0.77 0 N-CA-C 112.362 0.504 . . . . 74.31 112.362 -177.697 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 64.9 mtt . . . . . 0 C--O 1.213 -0.826 0 N-CA-C 112.227 0.455 . . . . 74.34 112.227 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -104.24 23.5 12.99 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 120.919 0.39 . . . . 72.43 110.08 174.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.444 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.95 -17.58 57.04 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.812 1.292 . . . . 73.22 108.857 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.546 ' HB2' ' HB2' ' A' ' 96' ' ' SER . 0.8 OUTLIER -59.17 -45.65 90.44 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 113.178 -1.828 . . . . 74.51 114.088 -177.745 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 65.0 m -76.22 -16.49 59.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.311 0.577 . . . . 73.31 110.663 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.444 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.0 mm -82.47 -44.26 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 121.937 0.875 . . . . 64.31 108.938 -176.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -102.19 7.27 40.92 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.678 -1.146 . . . . 75.54 111.984 -175.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -35.21 122.31 0.58 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 126.279 1.831 . . . . 51.31 115.028 -172.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -145.2 151.6 38.67 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.479 -2.786 . . . . 74.22 103.479 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -128.7 -72.58 0.6 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 118.636 0.653 . . . . 72.43 112.244 -174.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.2 -38.21 90.26 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.32 0.859 . . . . 73.41 113.32 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -66.29 -37.84 86.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-O 121.886 0.85 . . . . 55.52 110.542 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.421 HD13 HD22 ' A' ' 94' ' ' LEU . 86.4 mt -75.32 -40.79 58.09 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.639 -1.164 . . . . 73.51 110.238 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 44.5 t-105 -64.39 -42.07 96.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 75.4 110.49 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.88 93.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.355 -0.384 . . . . 53.31 110.689 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -60.89 -50.55 72.95 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.685 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.82 -53.04 62.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.505 -0.77 . . . . 43.43 109.287 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.32 -42.4 95.29 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 115.583 -0.735 . . . . 72.12 112.774 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 20.4 tpt180 -72.62 -41.68 65.28 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 121.93 -0.482 . . . . 74.21 111.411 -177.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.572 HD12 HD13 ' A' ' 84' ' ' LEU . 2.0 tm? -69.78 -40.89 75.78 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.601 -0.518 . . . . 74.42 109.601 -176.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.491 HD13 HD23 ' A' ' 33' ' ' LEU . 5.9 mt -69.36 -25.13 64.03 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 112.398 0.518 . . . . 54.31 112.398 176.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -67.58 -19.67 65.28 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.677 -0.86 . . . . 52.33 108.677 175.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 35.3 mtmt -99.03 -2.1 38.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.635 -0.712 . . . . 65.24 109.491 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.418 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.2 m-80 -145.49 52.85 1.7 Allowed Pre-proline 0 C--O 1.243 0.74 0 N-CA-C 112.717 0.636 . . . . 73.24 112.717 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 15.8 Cg_exo -68.16 -22.83 40.2 Favored 'Trans proline' 0 C--N 1.356 0.926 0 N-CA-C 108.864 -1.245 . . . . 54.31 108.864 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.64 -43.63 88.85 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 113.477 -1.692 . . . . 63.12 110.583 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.593 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.4 t90 -71.6 -43.18 66.71 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 108.832 -0.803 . . . . 75.44 108.832 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.632 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.6 tm? -58.28 -44.81 88.64 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 114.395 -1.275 . . . . 75.12 109.053 -176.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.514 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.0 m -60.17 -48.54 81.31 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.358 -0.383 . . . . 75.33 111.249 176.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -39.6 70.65 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.742 0.817 . . . . 64.24 111.785 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.0 mmmt -75.57 -35.95 60.51 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 121.048 -0.261 . . . . 62.25 111.217 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 66.3 mt -58.76 -30.34 67.44 Favored 'General case' 0 C--O 1.203 -1.392 0 N-CA-C 110.466 -0.198 . . . . 63.04 110.466 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 34' ' ' SER . 88.5 mtt180 -58.55 -26.56 63.69 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 123.259 0.35 . . . . 60.54 111.624 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.3 t -88.42 -50.15 6.49 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 109.641 -0.503 . . . . 73.21 109.641 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.444 ' CD1' HG23 ' A' ' 72' ' ' THR . 75.5 m-85 -70.05 -46.06 65.77 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.476 0.917 . . . . 73.34 113.476 -175.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.538 HD23 ' H ' ' A' ' 45' ' ' ASP . 9.3 mp -87.7 113.47 54.57 Favored Pre-proline 0 C--N 1.312 -1.062 0 C-N-CA 123.993 0.917 . . . . 73.0 110.056 -178.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 41' ' ' LEU . 30.0 Cg_endo -61.81 -29.9 83.61 Favored 'Trans proline' 0 N--CA 1.482 0.813 0 C-N-CA 123.712 2.941 . . . . 64.33 114.155 -174.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.1 p -112.55 7.04 18.76 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.39 0.614 . . . . 61.22 110.308 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.417 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 26.5 mtt 41.7 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 127.312 2.245 . . . . 63.34 112.188 -172.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.538 ' H ' HD23 ' A' ' 41' ' ' LEU . 35.3 t70 -98.11 59.54 1.39 Allowed 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.406 -1.331 . . . . 73.42 107.406 176.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -96.34 -11.47 25.79 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.657 -1.611 . . . . 72.34 111.78 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -80.45 37.61 0.4 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 124.436 1.094 . . . . 73.1 111.87 -175.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.6 m -91.85 -0.34 57.51 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.804 -0.635 . . . . 72.44 111.495 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 72.7 m -91.44 64.65 5.11 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.454 0.645 . . . . 73.02 112.23 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.413 ' HD1' ' HG3' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -82.41 -32.47 29.08 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 122.67 1.224 . . . . 73.44 109.557 173.5 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 44.6 mt-10 -93.76 172.8 5.4 Favored Pre-proline 0 C--N 1.264 -3.126 0 CA-C-N 112.487 -2.142 . . . . 53.11 106.574 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 39.8 Cg_endo -66.45 -169.87 0.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 121.27 1.314 . . . . 62.24 111.85 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.0 m -78.18 38.55 0.29 Allowed 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 123.488 0.715 . . . . 64.05 112.248 -175.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.615 ' HB2' HG23 ' A' ' 57' ' ' VAL . 96.1 m-20 -57.65 149.72 50.37 Favored Pre-proline 0 N--CA 1.438 -1.067 0 C-N-CA 123.984 0.914 . . . . 73.44 111.931 -177.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -44.79 -51.86 6.85 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 124.144 3.23 . . . . 72.33 113.011 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -73.22 -26.27 61.07 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 113.416 0.895 . . . . 53.22 113.416 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.615 HG23 ' HB2' ' A' ' 54' ' ' ASN . 72.2 t -65.65 -38.64 82.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 108.575 -0.898 . . . . 71.5 108.575 175.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.9 mm -70.53 -50.21 46.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 115.478 -0.783 . . . . 74.5 109.812 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -52.73 -39.99 62.64 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.241 1.017 . . . . 74.35 110.953 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -57.57 -40.62 79.35 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 125.079 1.352 . . . . 63.44 111.856 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 58.9 mt-30 -76.12 -39.46 55.1 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.657 -0.702 . . . . 75.01 110.602 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.46 -30.66 71.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 114.933 -1.031 . . . . 63.41 111.26 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.423 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 47.4 t30 -55.58 -34.37 64.74 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.834 1.254 . . . . 73.31 111.165 177.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -63.32 -30.16 71.34 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.644 -0.707 . . . . 74.34 111.969 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.0 mt -73.09 -31.89 64.64 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.086 0.469 . . . . 73.23 110.212 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.495 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 70.9 t80 -61.92 -29.83 70.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.294 -0.866 . . . . 73.55 109.117 177.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.21 -21.52 36.37 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 114.868 -1.06 . . . . 74.0 111.781 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -82.37 -47.18 12.62 Favored 'General case' 0 N--CA 1.419 -2.021 0 O-C-N 122.148 -0.345 . . . . 72.35 111.389 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.66 142.86 4.2 Favored Glycine 0 CA--C 1.473 -2.586 0 C-N-CA 120.275 -0.964 . . . . 62.45 112.56 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.548 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.64 -31.18 68.03 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 106.95 -1.5 . . . . 70.2 106.95 170.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.5 64.05 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.595 -1.184 . . . . 60.23 108.264 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.444 HG23 ' CD1' ' A' ' 40' ' ' PHE . 96.1 m -58.1 -40.61 81.6 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.084 -0.962 . . . . 54.22 110.217 176.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.446 ' HE1' HG22 ' A' ' 97' ' ' ILE . 65.4 t-105 -61.65 -46.89 87.85 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.97 -0.559 . . . . 73.04 109.906 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 70' ' ' MET . 34.7 mtmt -60.79 -42.79 98.25 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.549 -0.296 . . . . 72.4 111.359 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.4 m -66.06 -42.24 89.74 Favored 'General case' 0 N--CA 1.412 -2.36 0 C-N-CA 123.04 0.536 . . . . 74.24 111.128 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.429 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 79.0 t80 -61.49 -51.25 69.42 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.518 -0.765 . . . . 74.01 111.574 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.553 HG21 ' HB2' ' A' ' 94' ' ' LEU . 41.9 mm -61.7 -33.28 56.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.303 -0.408 . . . . 72.43 111.878 -175.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.57 -45.2 94.0 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.127 -0.694 . . . . 74.02 109.127 176.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.443 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 85.2 m-20 -68.1 -40.15 82.66 Favored 'General case' 0 C--O 1.195 -1.808 0 CA-C-N 115.475 -0.784 . . . . 75.54 110.704 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.497 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 1.5 tm? -50.04 -51.4 42.61 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.039 1.336 . . . . 74.41 108.894 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 72.8 m -67.39 -36.9 82.24 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.95 -1.023 . . . . 53.32 112.187 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -76.59 -40.1 50.54 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 123.398 0.679 . . . . 75.51 112.209 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 38.8 mt-10 -85.75 -29.25 24.01 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.773 1.027 . . . . 71.21 113.773 -172.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.572 HD13 HD12 ' A' ' 25' ' ' LEU . 95.8 mt -90.81 -28.26 18.33 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 113.706 1.002 . . . . 63.43 113.706 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -148.34 -169.58 3.38 Favored 'General case' 0 C--N 1.283 -2.284 0 N-CA-C 104.602 -2.37 . . . . 75.1 104.602 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.0 m -82.17 134.17 49.58 Favored Pre-proline 0 C--N 1.283 -2.284 0 N-CA-C 107.421 -1.326 . . . . 71.3 107.421 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -22.93 100.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 1 C-N-CA 126.096 4.53 . . . . 71.05 114.171 -174.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.8 mt -64.16 -34.26 77.66 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 115.257 -0.883 . . . . 74.33 110.48 -176.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.3 t70 58.19 37.13 26.22 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 123.126 1.441 . . . . 74.25 110.889 173.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -143.46 32.35 1.32 Allowed 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.712 -1.588 . . . . 73.21 106.712 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.584 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -70.69 -39.76 73.3 Favored 'General case' 0 C--O 1.192 -1.938 0 CA-C-N 114.38 -1.282 . . . . 73.44 112.971 -174.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.537 ' O ' HG22 ' A' ' 95' ' ' VAL . 44.5 mm -55.74 -45.73 99.84 Favored Pre-proline 0 CA--C 1.574 1.886 0 C-N-CA 123.783 0.833 . . . . 72.15 112.107 -175.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -50.95 -37.53 56.53 Favored 'Trans proline' 0 CA--C 1.555 1.573 0 C-N-CA 121.921 1.747 . . . . 64.32 111.566 171.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.553 ' HB2' HG21 ' A' ' 77' ' ' ILE . 4.3 mm? -76.68 -31.69 57.43 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.838 -0.619 . . . . 73.41 110.911 176.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.584 HG13 ' O ' ' A' ' 91' ' ' GLU . 6.5 m -66.54 -29.47 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.301 0 CA-C-O 122.566 1.174 . . . . 73.1 110.815 -177.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.546 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 31.3 t -75.47 -16.23 60.34 Favored 'General case' 0 C--N 1.27 -2.88 0 CA-C-N 113.379 -1.737 . . . . 72.32 113.077 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.459 HG22 ' O ' ' A' ' 94' ' ' LEU . 10.7 tt -72.38 -5.28 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 CA-C-O 121.362 0.601 . . . . 72.02 111.617 -172.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.495 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 47.2 t90 . . . . . 0 C--N 1.319 -0.759 0 C-N-CA 125.166 1.386 . . . . 71.03 110.4 -179.006 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.1 ttt . . . . . 0 CA--C 1.505 -0.783 0 CA-C-O 123.511 1.624 . . . . 73.11 111.067 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.521 ' O ' HD13 ' A' ' 11' ' ' ILE . 10.2 m-20 -141.82 24.25 2.04 Favored 'General case' 0 C--N 1.273 -2.75 0 CA-C-N 111.596 -2.547 . . . . 62.44 106.099 173.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HG2' ' A' ' 12' ' ' ARG . . . -74.41 -34.75 63.34 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-N 113.852 -1.522 . . . . 74.1 107.641 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.558 ' HB3' HG23 ' A' ' 92' ' ' ILE . 1.7 pm0 -51.47 -45.35 62.72 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 113.68 -1.6 . . . . 74.14 112.093 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.4 m -56.62 -40.6 75.66 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.362 1.065 . . . . 71.34 111.051 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.521 HD13 ' O ' ' A' ' 7' ' ' ASP . 1.2 mp -83.92 -43.21 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.024 0 CA-C-N 113.958 -1.474 . . . . 73.22 111.022 -175.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.472 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 35.9 mmt180 -69.1 -65.52 0.7 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 116.032 1.864 . . . . 74.3 116.032 -170.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.549 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 2.5 tm? -176.45 141.1 0.39 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.114 0.87 . . . . 61.54 110.991 -172.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.46 ' N ' HD13 ' A' ' 13' ' ' LEU . 6.7 p30 -153.65 138.0 16.67 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 106.593 -1.632 . . . . 54.3 106.593 168.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -152.63 153.13 32.72 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.379 -0.528 . . . . 70.22 110.581 -175.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.4 -30.56 71.29 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.112 0.965 . . . . 72.32 112.073 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -65.7 -26.03 67.58 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.142 0.496 . . . . 74.14 111.692 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.81 -35.61 64.9 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.782 -0.821 . . . . 71.54 108.782 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.473 ' HB2' ' CD1' ' A' ' 97' ' ' ILE . 77.0 t-105 -65.38 -45.38 84.28 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.423 -0.808 . . . . 73.24 109.086 177.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.68 87.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 72.22 110.992 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -59.93 -50.83 72.22 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.848 0.717 . . . . 73.01 110.715 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.14 -51.43 70.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.514 -0.767 . . . . 72.15 110.075 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.2 t -60.14 -42.8 91.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.514 -0.767 . . . . 71.25 112.018 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.513 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -69.45 -45.89 67.99 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.322 -0.622 . . . . 72.44 109.322 -176.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.413 ' CD1' HD13 ' A' ' 84' ' ' LEU . 2.2 tm? -65.93 -42.32 90.24 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.534 -0.543 . . . . 55.43 109.534 -177.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.644 HD13 HD23 ' A' ' 33' ' ' LEU . 7.6 mt -72.5 -25.49 61.42 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 112.942 0.719 . . . . 62.35 112.942 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 42.6 t -68.03 -20.14 64.96 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.336 -0.987 . . . . 65.22 108.336 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.2 mtmt -92.78 -7.22 47.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.666 -0.697 . . . . 75.31 109.955 177.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.425 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 43.7 m-80 -136.74 54.13 8.43 Favored Pre-proline 0 C--O 1.243 0.724 0 CA-C-N 115.986 -0.552 . . . . 55.53 112.162 -174.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.425 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.4 Cg_exo -68.84 -23.71 34.95 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.309 1.339 . . . . 63.21 109.081 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.7 -44.61 95.78 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 113.93 -1.486 . . . . 75.23 109.637 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.612 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.4 t90 -74.57 -45.13 47.38 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 121.453 0.644 . . . . 74.35 109.967 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.644 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -60.21 -45.31 93.61 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.738 -1.119 . . . . 63.42 110.687 -174.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.485 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.7 m -57.39 -46.53 83.34 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 123.236 0.335 . . . . 51.22 111.19 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.94 -40.54 80.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.287 1.035 . . . . 62.12 111.573 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.612 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.6 mmmt -73.94 -29.96 62.3 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 120.822 -0.351 . . . . 74.31 111.876 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.2 mt -62.66 -30.27 71.25 Favored 'General case' 0 C--O 1.2 -1.552 0 N-CA-C 109.71 -0.478 . . . . 74.33 109.71 173.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 34' ' ' SER . 70.8 mtt180 -62.87 -31.13 72.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.947 0.403 . . . . 74.14 111.395 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 t -85.28 -39.04 18.17 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.34 0.591 . . . . 75.22 110.826 -179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.6 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.0 m-85 -84.65 -46.45 11.49 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.175 0.806 . . . . 74.41 113.175 -176.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 mp -89.74 119.43 69.46 Favored Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 123.328 0.651 . . . . 65.12 110.489 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.51 -41.49 19.81 Favored 'Trans proline' 0 C--N 1.324 -0.714 0 C-N-CA 122.218 1.945 . . . . 72.33 110.872 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.0 t -86.5 -8.92 57.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.494 -0.775 . . . . 60.54 112.594 -176.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.445 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 12.4 mtt 28.75 91.5 0.01 OUTLIER 'General case' 0 C--O 1.236 0.395 0 C-N-CA 126.632 1.973 . . . . 65.22 112.89 -173.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -99.65 61.62 1.16 Allowed 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 123.263 1.506 . . . . 51.13 110.309 177.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 pp -89.19 -19.64 25.19 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 113.157 -1.838 . . . . 72.45 110.494 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.55 5.39 50.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.305 1.05 . . . . 74.32 108.809 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 41.9 t -85.7 21.8 1.77 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.965 -1.016 . . . . 60.23 109.354 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.6 m -73.14 94.04 1.89 Allowed 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 122.03 0.919 . . . . 73.23 108.899 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -20.45 62.2 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.405 -1.271 . . . . 72.34 113.149 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.534 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 37.9 mt-10 -137.04 170.39 10.89 Favored Pre-proline 0 N--CA 1.38 -3.942 0 N-CA-C 107.307 -1.368 . . . . 75.31 107.307 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.04 -151.43 0.01 OUTLIER 'Trans proline' 0 CA--C 1.562 1.894 0 C-N-CA 123.605 2.87 . . . . 54.33 112.962 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.6 p -75.33 37.18 0.13 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.004 0.922 . . . . 65.22 112.663 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.414 ' O ' HG12 ' A' ' 58' ' ' ILE . 78.5 m-20 -71.65 148.69 92.9 Favored Pre-proline 0 N--CA 1.431 -1.399 0 C-N-CA 123.987 0.915 . . . . 74.23 112.591 -176.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -59.88 -34.26 95.53 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.296 2.664 . . . . 73.34 113.132 -177.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -75.19 -23.82 57.73 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.35 0.595 . . . . 73.13 110.996 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.534 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 95.7 t -74.01 -45.26 49.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 108.047 -1.094 . . . . 54.23 108.047 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 54' ' ' ASN . 47.5 mm -58.67 -37.64 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 114.227 -1.351 . . . . 74.1 109.787 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -54.38 -43.74 71.66 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.712 -0.676 . . . . 73.35 111.6 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.52 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 2.0 tpp180 -54.9 -54.46 42.28 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.968 0.907 . . . . 74.41 110.791 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -59.46 -42.59 92.35 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.296 -1.32 . . . . 72.53 111.79 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.452 HD12 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -79.64 -30.85 41.45 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.418 -0.81 . . . . 71.43 111.535 -177.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.52 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 22.7 t-20 -53.42 -48.25 68.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 124.896 1.278 . . . . 71.12 110.177 174.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -55.07 -30.91 60.63 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 113.549 -1.66 . . . . 73.35 112.978 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.1 mt -72.16 -42.47 65.89 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 120.526 0.203 . . . . 71.44 111.283 -178.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.582 ' CD1' ' HB3' ' A' ' 98' ' ' TRP . 55.5 t80 -71.32 -24.95 62.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.638 0.732 . . . . 73.32 109.028 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -28.38 64.58 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.159 -0.928 . . . . 71.14 109.875 175.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.557 ' HB2' HG21 ' A' ' 72' ' ' THR . 37.3 mm-40 -74.79 -56.77 4.43 Favored 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 108.217 -1.031 . . . . 71.34 108.217 173.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -168.97 145.84 9.79 Favored Glycine 0 CA--C 1.479 -2.187 0 CA-C-N 115.495 -0.775 . . . . 53.23 112.147 -175.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.513 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 56.7 ttp -68.8 -32.27 71.88 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 105.606 -1.998 . . . . 74.23 105.606 170.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.7 68.32 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.623 -1.626 . . . . 72.22 108.3 176.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.6 HG23 ' CD1' ' A' ' 40' ' ' PHE . 96.8 m -57.36 -40.76 78.78 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.577 -0.738 . . . . 61.23 110.167 175.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.476 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.5 t-105 -61.51 -50.62 71.97 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 110.35 -0.241 . . . . 72.31 110.35 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 70' ' ' MET . 80.6 mttt -55.38 -45.14 76.58 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.111 0.482 . . . . 74.13 111.151 178.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.2 m -66.97 -40.58 87.51 Favored 'General case' 0 N--CA 1.406 -2.658 0 C-N-CA 123.845 0.858 . . . . 73.12 111.495 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.444 ' HZ ' ' CD2' ' A' ' 33' ' ' LEU . 81.9 t80 -61.26 -47.77 84.51 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.876 -0.602 . . . . 75.44 110.903 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 73' ' ' TRP . 49.6 mm -62.7 -33.47 60.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 CA-C-O 121.311 0.577 . . . . 62.33 110.055 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.41 -39.27 94.06 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.376 -0.829 . . . . 63.33 109.184 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -75.33 -42.97 53.14 Favored 'General case' 0 C--O 1.194 -1.817 0 N-CA-C 110.252 -0.277 . . . . 74.34 110.252 178.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.404 HD21 HD21 ' A' ' 26' ' ' LEU . 1.5 tm? -49.86 -53.97 22.39 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 125.495 1.518 . . . . 72.33 109.212 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.466 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 52.7 t -63.31 -35.7 81.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.456 -0.793 . . . . 75.44 111.321 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -76.2 -54.6 6.56 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.183 0.516 . . . . 73.34 111.335 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -71.05 -39.31 72.33 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.539 -0.755 . . . . 64.43 112.627 -172.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.413 HD13 ' CD1' ' A' ' 25' ' ' LEU . 96.4 mt -82.58 -8.4 59.61 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.397 -0.521 . . . . 64.32 109.912 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 t70 49.86 68.66 0.71 Allowed 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 125.503 1.521 . . . . 60.23 112.86 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.31 116.86 10.32 Favored Pre-proline 0 C--N 1.296 -1.754 0 N-CA-C 105.967 -1.864 . . . . 65.04 105.967 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -69.49 103.74 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 121.768 1.645 . . . . 75.31 109.638 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.466 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 44.1 mt -81.18 -46.98 14.05 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 120.715 -0.394 . . . . 74.22 110.815 -175.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t70 70.13 -45.14 0.58 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 124.756 1.223 . . . . 74.41 110.961 -173.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 25.7 mmt -87.95 40.38 0.94 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 124.453 1.101 . . . . 64.1 110.096 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.641 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -69.19 -46.32 67.74 Favored 'General case' 0 C--O 1.191 -2.006 0 C-N-CA 120.437 -0.505 . . . . 75.12 111.356 -177.144 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.558 HG23 ' HB3' ' A' ' 9' ' ' GLU . 33.2 mm -64.49 -43.37 71.2 Favored Pre-proline 0 CA--C 1.567 1.6 0 C-N-CA 124.202 1.001 . . . . 73.11 109.632 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.549 ' HA ' ' O ' ' A' ' 13' ' ' LEU . 65.0 Cg_exo -50.22 -37.16 48.66 Favored 'Trans proline' 0 CA--C 1.565 2.03 0 C-N-CA 121.346 1.364 . . . . 62.54 112.167 167.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.448 ' O ' HG22 ' A' ' 97' ' ' ILE . 3.8 mm? -70.82 -40.46 72.46 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.589 -0.278 . . . . 70.23 110.479 173.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.641 HG13 ' O ' ' A' ' 91' ' ' GLU . 4.4 m -65.1 -33.93 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 CA-C-O 122.629 1.204 . . . . 75.04 110.562 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.463 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 23.0 t -64.27 -19.8 65.64 Favored 'General case' 0 C--N 1.28 -2.417 0 CA-C-N 113.467 -1.697 . . . . 44.22 112.701 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.473 ' CD1' ' HB2' ' A' ' 19' ' ' TRP . 13.5 tt -68.24 -26.78 34.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 C-N-CA 120.169 -0.612 . . . . 52.2 111.043 -174.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.582 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . 57.5 m95 . . . . . 0 N--CA 1.42 -1.936 0 CA-C-O 121.796 0.808 . . . . 73.41 110.854 175.41 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.8 tpp . . . . . 0 C--O 1.242 0.66 0 CA-C-O 122.021 0.915 . . . . 73.43 110.326 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -110.99 24.81 12.47 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.034 -0.985 . . . . 73.41 110.203 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.498 ' HA ' HD13 ' A' ' 11' ' ' ILE . . . -75.79 -12.7 60.23 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.772 1.272 . . . . 72.33 109.128 175.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.35 71.42 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 113.191 -1.822 . . . . 72.42 112.347 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 60.0 m -59.29 -47.46 85.3 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 122.464 1.126 . . . . 63.44 110.184 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.546 ' H ' HD12 ' A' ' 11' ' ' ILE . 4.2 mp -72.84 -42.08 61.02 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.237 0 CA-C-N 114.177 -1.374 . . . . 64.33 112.426 -175.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -76.69 -34.07 58.21 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.123 0.416 . . . . 73.43 112.123 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.2 mt 67.05 171.72 0.26 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.975 1.31 . . . . 72.5 113.595 -175.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -89.23 170.19 10.81 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.568 -0.742 . . . . 73.11 110.079 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.401 ' OD1' ' HB2' ' A' ' 17' ' ' ASN . 22.0 t-20 -159.26 133.59 7.75 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.082 -0.34 . . . . 74.52 110.082 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.49 -32.68 71.71 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.028 0.751 . . . . 74.11 113.028 -176.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . 0.401 ' HB2' ' OD1' ' A' ' 15' ' ' ASN . 16.2 m120 -64.05 -35.45 80.77 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.499 -0.556 . . . . 75.23 109.499 177.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.71 -36.12 81.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 41.24 110.226 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -65.45 -45.51 83.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 71.55 110.089 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.66 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 74.4 110.329 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.407 ' CZ2' HD23 ' A' ' 88' ' ' LEU . 2.6 t-105 -56.96 -50.18 73.42 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.674 -0.694 . . . . 72.5 110.2 174.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -53.15 61.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 124.191 0.932 . . . . 73.13 109.307 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.4 t -55.57 -51.61 56.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 111.922 0.341 . . . . 64.21 111.922 -178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -71.97 -34.18 68.74 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 112.483 0.549 . . . . 74.45 112.483 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.431 HD22 ' HE2' ' A' ' 28' ' ' LYS . 1.9 tm? -73.79 -46.47 45.27 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.048 -1.093 . . . . 54.1 108.048 -176.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.466 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -65.95 -25.18 67.0 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 123.905 0.882 . . . . 72.33 110.439 -179.207 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.1 m -64.2 -17.61 63.71 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.224 0.535 . . . . 72.24 110.246 174.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.452 ' C ' ' HD3' ' A' ' 30' ' ' PRO . 30.1 mtmt -100.78 0.97 39.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.227 -0.657 . . . . 74.32 109.227 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.466 ' OD1' ' HA ' ' A' ' 26' ' ' LEU . 5.2 m120 -125.19 45.75 1.47 Allowed Pre-proline 0 CA--C 1.547 0.855 0 CA-C-N 115.629 -0.714 . . . . 70.32 110.315 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.452 ' HD3' ' C ' ' A' ' 28' ' ' LYS . 2.8 Cg_endo -71.3 -20.61 27.71 Favored 'Trans proline' 0 C--N 1.355 0.89 0 CA-C-N 121.321 1.508 . . . . 55.43 110.484 -173.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -75.83 -42.53 49.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.264 -1.335 . . . . 74.52 109.247 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.6 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.8 t90 -75.96 -47.75 23.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.735 -0.666 . . . . 65.34 111.1 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.505 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -56.71 -49.23 75.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.81 -1.087 . . . . 74.51 111.064 -173.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.634 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.5 p -54.44 -49.11 70.79 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 123.56 0.537 . . . . 75.22 111.522 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.47 -45.88 66.3 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.837 1.255 . . . . 71.25 112.501 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.6 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.8 mmmt -71.1 -30.25 66.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.567 0.222 . . . . 60.5 110.595 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.511 HD11 ' HB3' ' A' ' 61' ' ' GLN . 87.4 mt -66.91 -35.62 80.41 Favored 'General case' 0 C--O 1.202 -1.437 0 N-CA-C 109.776 -0.453 . . . . 61.01 109.776 174.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.634 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -60.45 -33.77 73.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.977 0.894 . . . . 64.14 109.825 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.437 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 59.6 m -74.32 -50.69 17.77 Favored 'General case' 0 N--CA 1.394 -3.267 0 C-N-CA 125.222 1.409 . . . . 51.33 112.626 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.564 ' CD1' HG23 ' A' ' 72' ' ' THR . 51.9 m-85 -78.43 -44.78 23.87 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.604 0.964 . . . . 71.42 113.604 -177.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 44' ' ' MET . 7.9 mp -85.69 129.03 56.34 Favored Pre-proline 0 C--N 1.301 -1.518 0 C-N-CA 123.578 0.751 . . . . 74.14 112.157 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 41' ' ' LEU . 10.0 Cg_endo -93.18 -16.15 0.83 Allowed 'Trans proline' 0 CA--C 1.556 1.606 0 C-N-CA 122.372 2.048 . . . . 60.21 110.874 169.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.8 p -114.4 28.61 8.62 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 124.307 1.043 . . . . 64.41 111.535 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.474 ' HA ' HD23 ' A' ' 41' ' ' LEU . 1.4 mpp? -37.66 110.0 0.11 Allowed 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 126.238 1.815 . . . . 65.34 114.181 -173.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -113.31 56.56 0.69 Allowed 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.791 -1.559 . . . . 75.45 106.791 170.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 pp -95.07 -15.96 23.03 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.576 -1.647 . . . . 50.15 110.846 -174.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -85.91 -2.22 58.05 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 122.003 0.906 . . . . 73.11 109.795 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.7 m -81.51 39.25 0.53 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 115.2 -0.909 . . . . 62.31 111.481 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.1 t -87.69 76.81 8.78 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-O 121.901 0.858 . . . . 62.22 108.822 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 122.732 1.253 . . . . 60.05 110.933 176.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -113.53 160.62 30.97 Favored Pre-proline 1 N--CA 1.379 -4.019 0 N-CA-C 105.478 -2.045 . . . . 64.22 105.478 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -69.22 -141.48 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 122.803 2.335 . . . . 44.01 112.353 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -75.78 38.36 0.16 Allowed 'General case' 0 C--N 1.296 -1.721 0 C-N-CA 123.999 0.92 . . . . 73.31 112.88 -175.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.49 ' HB2' HG23 ' A' ' 57' ' ' VAL . 6.3 m-20 -60.03 143.52 87.98 Favored Pre-proline 0 N--CA 1.427 -1.594 0 C-N-CA 123.997 0.919 . . . . 74.13 109.52 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.08 -40.92 79.57 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.339 2.693 . . . . 64.23 113.704 -175.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.86 -30.28 61.3 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.32 -0.237 . . . . 74.24 110.948 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.49 HG23 ' HB2' ' A' ' 54' ' ' ASN . 84.0 t -66.46 -44.86 90.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 N-CA-C 108.249 -1.019 . . . . 72.44 108.249 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.45 -49.09 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 114.564 -1.198 . . . . 72.23 109.385 176.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.0 t-160 -56.24 -35.4 67.34 Favored 'General case' 0 C--O 1.206 -1.214 0 CA-C-N 116.281 -0.418 . . . . 75.53 111.123 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.496 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.5 ttt180 -58.93 -44.33 91.31 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.557 0.694 . . . . 72.05 111.206 176.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.511 ' HB3' HD11 ' A' ' 37' ' ' LEU . 59.0 mt-30 -72.21 -38.42 69.0 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.211 -0.904 . . . . 74.42 110.142 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -72.05 -30.18 64.9 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.891 -1.049 . . . . 72.54 110.439 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.552 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 9.2 t30 -61.64 -32.58 72.74 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 124.648 1.179 . . . . 71.35 109.398 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -67.52 -33.36 74.92 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 115.154 -0.93 . . . . 70.12 111.899 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -72.29 -37.93 68.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 109.11 -0.7 . . . . 64.33 109.11 176.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.552 ' HB3' ' O ' ' A' ' 63' ' ' ASN . 34.9 t80 -52.88 -43.92 66.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.483 -1.235 . . . . 72.51 108.415 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.81 -16.7 60.69 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.975 -1.012 . . . . 73.23 113.345 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.459 ' HB2' HG21 ' A' ' 72' ' ' THR . 39.0 mm-40 -82.98 -44.3 15.42 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 118.671 0.668 . . . . 64.03 110.571 177.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 173.03 143.13 4.08 Favored Glycine 0 CA--C 1.475 -2.433 0 C-N-CA 120.019 -1.086 . . . . 53.12 112.678 -175.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.566 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.4 ptt? -70.47 -27.27 64.1 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 106.684 -1.599 . . . . 74.41 106.684 170.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.85 -34.36 57.85 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.391 -1.277 . . . . 75.5 108.16 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.564 HG23 ' CD1' ' A' ' 40' ' ' PHE . 93.3 m -63.6 -36.12 82.76 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.387 -0.824 . . . . 52.13 109.41 174.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -63.12 -50.88 68.72 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.636 -0.505 . . . . 72.14 109.636 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.566 ' HG3' ' O ' ' A' ' 70' ' ' MET . 84.3 mttt -54.75 -42.23 71.4 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.839 -0.619 . . . . 72.34 111.294 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -65.31 -47.68 75.73 Favored 'General case' 0 N--CA 1.411 -2.398 0 C-N-CA 123.256 0.622 . . . . 74.22 111.142 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -59.34 -51.08 71.46 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.332 -0.849 . . . . 75.0 111.104 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.2 mm -64.79 -36.91 78.81 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 O-C-N 123.411 0.444 . . . . 73.3 110.842 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -58.55 -46.31 87.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.05 -0.523 . . . . 74.03 110.083 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.502 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 72.1 m-20 -72.14 -39.33 68.86 Favored 'General case' 0 C--O 1.185 -2.306 0 C-N-CA 120.795 -0.362 . . . . 70.42 110.94 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.421 HD23 ' CH2' ' A' ' 32' ' ' TRP . 2.5 tm? -49.79 -54.2 20.64 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.963 1.305 . . . . 73.23 110.535 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.44 ' SG ' HD11 ' A' ' 88' ' ' LEU . 59.1 m -63.18 -32.26 73.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.073 -0.967 . . . . 42.24 111.246 -179.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -76.2 -52.86 9.18 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.631 -0.713 . . . . 74.44 111.14 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 28.9 mt-10 -66.76 -44.68 80.77 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.846 0.858 . . . . 43.24 112.582 -173.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 79.8 mt -80.28 -10.81 59.76 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 120.164 -0.614 . . . . 74.32 109.456 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.5 t70 55.74 71.15 0.57 Allowed 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.079 -1.418 . . . . 75.2 111.612 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.7 t -124.86 104.95 29.84 Favored Pre-proline 0 C--N 1.303 -1.419 0 CA-C-N 114.701 -1.136 . . . . 72.11 108.52 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -75.98 73.04 5.02 Favored 'Trans proline' 0 N--CA 1.449 -1.101 0 C-N-CA 122.011 1.807 . . . . 63.25 111.092 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.44 HD11 ' SG ' ' A' ' 81' ' ' CYS . 0.3 OUTLIER -95.87 -24.35 16.48 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.024 1.12 . . . . 64.13 114.024 -178.4 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 62.41 17.83 9.8 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 121.977 0.894 . . . . 71.22 111.247 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.521 ' O ' HD23 ' A' ' 94' ' ' LEU . 63.8 mtt -113.12 17.52 18.67 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.794 -1.093 . . . . 72.22 109.969 -177.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.637 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -60.9 -56.07 25.49 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.218 -0.446 . . . . 71.11 111.165 -175.7 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.535 ' O ' HG22 ' A' ' 95' ' ' VAL . 35.2 mm -66.64 -42.84 48.1 Favored Pre-proline 0 CA--C 1.571 1.764 0 C-N-CA 123.181 0.592 . . . . 72.12 110.728 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -48.05 -41.85 32.99 Favored 'Trans proline' 0 CA--C 1.557 1.638 0 C-N-CA 121.759 1.64 . . . . 62.3 111.943 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.698 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 4.3 mm? -69.45 -36.2 76.38 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 122.795 0.438 . . . . 72.0 110.804 173.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.637 HG13 ' O ' ' A' ' 91' ' ' GLU . 5.8 m -68.21 -35.02 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-O 121.986 0.898 . . . . 72.42 110.156 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.8 t -59.53 -26.42 65.32 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 125.501 1.52 . . . . 71.2 110.99 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.698 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 2.7 mt -50.09 -47.46 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 C-N-CA 123.883 0.873 . . . . 72.34 110.949 176.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.487 ' CD1' ' HA ' ' A' ' 66' ' ' PHE . 7.8 t-105 . . . . . 0 N--CA 1.409 -2.491 0 CA-C-O 122.813 1.292 . . . . 71.41 110.044 178.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.4 ' SD ' HD11 ' A' ' 92' ' ' ILE . 6.4 tpt . . . . . 0 N--CA 1.447 -0.601 0 N-CA-C 107.518 -1.289 . . . . 71.4 107.518 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.59 25.22 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.089 1.514 . . . . 61.5 115.089 -173.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.422 ' HB3' HG21 ' A' ' 92' ' ' ILE . . . -78.26 -17.44 56.67 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.857 1.313 . . . . 74.41 109.129 177.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.502 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -64.82 -31.49 72.75 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 113.408 -1.724 . . . . 75.15 112.925 179.047 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.534 ' HB2' HD12 ' A' ' 11' ' ' ILE . 51.7 m -61.86 -27.84 69.08 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.672 0.748 . . . . 72.34 110.483 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.534 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.62 -29.74 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.427 -1.26 . . . . 71.35 111.76 -173.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.431 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 37.2 mmt180 -85.91 -38.13 18.35 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.9 1.074 . . . . 75.11 113.9 -172.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.15 -51.85 0.27 Allowed 'General case' 0 CA--C 1.552 1.027 0 N-CA-C 117.407 2.373 . . . . 73.41 117.407 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 42.3 m-80 -126.42 -80.59 0.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.588 1.329 . . . . 52.12 114.588 -173.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 67.99 84.67 0.15 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.187 0.995 . . . . 74.31 110.92 -175.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.68 -47.17 55.96 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.379 -0.828 . . . . 72.31 113.086 -177.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -61.23 -33.1 72.95 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.126 0.417 . . . . 71.54 112.126 -176.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.441 HD13 HD22 ' A' ' 94' ' ' LEU . 94.3 mt -64.87 -33.95 77.21 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.056 -0.52 . . . . 74.01 111.595 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.504 ' CA ' HD11 ' A' ' 97' ' ' ILE . 65.9 t-105 -63.9 -39.96 95.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.32 -0.4 . . . . 74.31 110.289 177.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.48 -38.95 91.26 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.593 -0.276 . . . . 73.23 110.435 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 76.7 t90 -58.76 -50.38 74.15 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.861 -0.792 . . . . 75.52 108.861 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.16 -52.89 62.94 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 114.893 -1.049 . . . . 74.14 110.773 -176.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 67.2 t -53.16 -51.76 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.124 0.57 . . . . 65.45 112.117 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.43 -0.35 . . . . 62.32 111.533 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -74.44 -47.12 35.59 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 107.695 -1.224 . . . . 63.41 107.695 -176.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.677 ' HA ' ' ND2' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -68.11 -24.74 65.06 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 124.237 1.015 . . . . 73.43 111.211 -178.67 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.421 ' HA ' ' HB2' ' A' ' 53' ' ' SER . 48.0 t -63.53 -15.11 57.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.079 -0.711 . . . . 64.13 109.079 174.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -100.39 -4.53 28.84 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-O 121.064 0.459 . . . . 72.24 110.084 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.677 ' ND2' ' HA ' ' A' ' 26' ' ' LEU . 8.4 p30 -133.93 48.36 3.17 Favored Pre-proline 0 N--CA 1.472 0.658 0 N-CA-C 113.362 0.875 . . . . 52.21 113.362 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.4 Cg_exo -72.36 -22.95 21.11 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.612 1.541 . . . . 52.14 111.154 -175.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -75.6 -51.32 13.13 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.857 -0.794 . . . . 60.52 108.857 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.548 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 60.9 t90 -60.72 -44.14 96.97 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.06 -0.973 . . . . 74.24 109.668 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.546 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -58.08 -43.4 86.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.627 -0.715 . . . . 75.1 109.641 -178.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 50.7 m -61.99 -49.44 76.06 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 116.26 -0.427 . . . . 52.33 110.964 177.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.14 -39.85 63.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.727 0.811 . . . . 64.32 111.612 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.548 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.2 mmmt -74.21 -33.48 63.4 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.979 -0.289 . . . . 73.52 111.306 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.9 mt -59.1 -34.1 71.62 Favored 'General case' 0 C--O 1.19 -2.05 0 N-CA-C 110.342 -0.244 . . . . 73.21 110.342 174.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.489 ' HG2' ' SD ' ' A' ' 44' ' ' MET . 90.5 mtt180 -59.33 -39.12 82.14 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.287 0.565 . . . . 61.55 110.51 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -72.26 -38.91 68.76 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 114.907 -1.042 . . . . 44.34 110.396 -176.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.544 ' CD1' HG23 ' A' ' 72' ' ' THR . 69.7 m-85 -89.29 -50.19 6.28 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 113.559 0.948 . . . . 73.02 113.559 -176.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.436 ' HB3' ' H ' ' A' ' 44' ' ' MET . 8.3 mp -79.65 128.38 74.89 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 123.591 0.756 . . . . 71.13 110.498 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -72.85 -22.12 20.48 Favored 'Trans proline' 0 C--N 1.321 -0.914 0 C-N-CA 122.23 1.953 . . . . 74.44 111.761 177.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.5 p -108.62 -30.59 8.14 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 113.871 1.063 . . . . 73.14 113.871 -176.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.489 ' SD ' ' HG2' ' A' ' 38' ' ' ARG 0.29 1.1 ptm 41.32 92.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 116.205 1.928 . . . . 52.33 116.205 -175.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -99.12 56.8 1.05 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 123.171 1.463 . . . . 72.42 108.244 177.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.406 HD22 ' HB3' ' A' ' 34' ' ' SER . 3.5 pp -92.18 -17.33 25.03 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.577 -1.647 . . . . 64.04 112.634 -173.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -88.74 0.21 56.7 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.025 0.917 . . . . 74.23 110.744 -176.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.3 m -81.78 69.46 8.46 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.615 -0.721 . . . . 65.22 109.697 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.3 m -93.15 82.89 4.58 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-O 121.896 0.855 . . . . 73.12 109.582 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.66 -28.28 30.76 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 122.698 1.237 . . . . 52.55 110.333 176.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -134.11 167.53 22.42 Favored Pre-proline 1 N--CA 1.376 -4.158 0 N-CA-C 104.948 -2.241 . . . . 62.0 104.948 176.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -76.83 -149.45 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 121.691 1.594 . . . . 75.44 110.648 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.421 ' HB2' ' HA ' ' A' ' 27' ' ' SER . 29.3 p -76.0 38.65 0.17 Allowed 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 123.666 0.786 . . . . 74.1 112.788 -177.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.94 150.98 46.86 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 125.156 1.382 . . . . 72.44 111.591 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -52.87 -43.85 53.1 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 123.529 2.819 . . . . 72.44 113.956 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.4 -28.92 61.3 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 120.977 -0.289 . . . . 73.43 111.37 -178.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 99.8 t -65.87 -52.54 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.362 -1.347 . . . . 62.41 107.362 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.0 mm -55.48 -47.41 78.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.641 -1.163 . . . . 75.43 110.148 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -54.16 -40.93 67.94 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.337 0.655 . . . . 75.21 111.462 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.0 ttm180 -68.17 -41.44 81.52 Favored 'General case' 0 C--N 1.297 -1.705 0 C-N-CA 123.412 0.685 . . . . 74.55 111.093 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.563 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 46.0 mt-30 -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.349 -0.841 . . . . 71.12 111.175 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.427 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -77.9 -30.58 50.73 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.452 -0.795 . . . . 65.32 110.678 -178.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.457 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 24.0 t-20 -54.59 -46.01 73.71 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.244 1.017 . . . . 64.24 110.622 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -54.03 -33.83 58.34 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.114 -1.403 . . . . 71.3 112.075 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.9 mt -72.45 -42.92 64.47 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.734 0.302 . . . . 62.45 111.026 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -64.83 -32.51 74.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.815 -0.63 . . . . 74.25 109.581 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.9 -24.8 63.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.287 -0.87 . . . . 72.13 111.624 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.563 ' HB2' HG21 ' A' ' 72' ' ' THR . 32.2 mm-40 -74.29 -37.37 63.69 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 108.615 -0.883 . . . . 73.42 108.615 175.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.489 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . 170.81 138.78 2.59 Favored Glycine 0 N--CA 1.415 -2.737 0 CA-C-N 114.678 -1.146 . . . . 64.23 110.909 -176.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.534 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.48 -26.55 63.67 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 106.864 -1.532 . . . . 72.22 106.864 171.385 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.44 -37.54 65.81 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 113.986 -1.461 . . . . 72.31 108.374 174.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.563 HG21 ' HB2' ' A' ' 68' ' ' GLN . 53.1 m -58.99 -42.47 90.12 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.488 -0.778 . . . . 74.15 109.707 173.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.477 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -61.27 -46.0 92.15 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.03 -0.532 . . . . 72.33 110.639 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 70' ' ' MET . 95.2 mttt -53.76 -46.39 70.91 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 122.581 0.352 . . . . 71.45 110.852 175.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.7 m -65.63 -42.28 91.67 Favored 'General case' 0 N--CA 1.407 -2.593 0 C-N-CA 123.033 0.533 . . . . 62.2 111.756 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 94.5 t80 -58.37 -49.22 78.01 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.042 -0.527 . . . . 73.33 111.584 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.485 HG22 ' HG3' ' A' ' 91' ' ' GLU . 49.3 mm -61.13 -33.92 58.16 Favored 'Isoleucine or valine' 0 C--O 1.244 0.792 0 O-C-N 123.336 0.397 . . . . 70.31 111.177 -177.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.444 ' HA ' ' OE1' ' A' ' 91' ' ' GLU . 5.7 t30 -57.96 -49.02 78.21 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.857 -0.611 . . . . 65.5 110.156 175.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.6 m-20 -72.85 -40.12 65.97 Favored 'General case' 0 C--O 1.194 -1.846 0 CA-C-N 114.928 -1.033 . . . . 72.22 110.666 -178.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.509 HD21 HD21 ' A' ' 26' ' ' LEU . 2.5 tm? -50.95 -54.47 24.02 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 125.229 1.412 . . . . 72.2 109.732 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.7 m -65.95 -40.67 91.55 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.151 -0.477 . . . . 62.52 110.281 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -65.38 -49.02 70.89 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 73.15 111.986 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 33.9 mt-10 -81.11 -17.71 49.01 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 112.942 0.719 . . . . 72.4 112.942 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -103.17 -39.39 6.88 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 112.501 0.556 . . . . 75.44 112.501 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -138.3 -151.64 0.39 Allowed 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.871 -1.159 . . . . 71.45 107.871 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.2 m -105.04 166.45 11.43 Favored Pre-proline 0 C--N 1.295 -1.771 0 N-CA-C 107.35 -1.352 . . . . 70.02 107.35 175.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.9 86.69 0.73 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.501 1.467 . . . . 71.44 111.577 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.612 HD13 ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -77.48 -13.43 59.92 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-N 115.905 -0.589 . . . . 61.23 112.003 178.058 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.6 t70 53.48 83.63 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 116.1 1.889 . . . . 71.33 116.1 174.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.498 ' HG2' ' CD2' ' A' ' 88' ' ' LEU . 26.2 ptm -156.12 32.25 0.34 Allowed 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.04 -2.578 . . . . 75.03 104.04 168.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.606 ' O ' HG13 ' A' ' 95' ' ' VAL . 35.2 tt0 -60.4 -50.84 72.0 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 111.547 -2.569 . . . . 71.43 111.759 -172.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.547 ' O ' HG22 ' A' ' 95' ' ' VAL . 42.4 mm -60.56 -45.4 97.2 Favored Pre-proline 0 CA--C 1.559 1.29 0 C-N-CA 123.011 0.525 . . . . 72.21 111.536 -177.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -47.89 -37.25 28.67 Favored 'Trans proline' 0 CA--C 1.553 1.454 0 C-N-CA 121.911 1.741 . . . . 74.45 111.812 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.441 HD22 HD13 ' A' ' 18' ' ' LEU . 4.4 mm? -76.26 -34.98 59.14 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 122.797 0.439 . . . . 72.35 110.972 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.606 HG13 ' O ' ' A' ' 91' ' ' GLU . 5.2 m -68.53 -30.59 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-O 122.799 1.285 . . . . 75.31 110.748 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.431 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 30.0 t -83.5 2.86 34.81 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 113.635 -1.62 . . . . 61.15 112.39 -178.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.566 ' HA ' ' O ' ' A' ' 14' ' ' ASN . 9.7 tt -62.67 -25.86 39.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 114.143 1.164 . . . . 73.31 114.143 -170.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 94.2 m95 . . . . . 0 C--N 1.322 -0.619 0 O-C-N 121.777 -0.577 . . . . 71.22 111.533 -179.821 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.435 -1.186 0 CA-C-O 122.048 0.928 . . . . 65.42 111.165 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -106.34 25.68 10.78 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 114.903 -1.044 . . . . 71.22 110.897 177.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.02 -17.25 57.3 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-O 121.396 0.617 . . . . 64.04 109.355 174.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.24 -40.4 64.52 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 126.049 1.74 . . . . 74.21 115.222 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 33.5 t -58.35 -41.52 84.88 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 124.457 1.103 . . . . 63.52 110.261 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.545 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.5 mp -87.2 -36.69 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.147 0 CA-C-N 114.711 -1.131 . . . . 71.44 111.648 -176.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -72.66 -49.48 31.41 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 114.405 1.261 . . . . 72.51 114.405 -176.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 63.1 -168.91 0.19 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.862 0.726 . . . . 61.32 110.054 -171.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -138.85 178.59 7.05 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 121.631 -0.668 . . . . 73.24 111.279 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -114.2 145.02 42.25 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.9 -1.148 . . . . 75.21 107.9 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -64.17 -29.38 70.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.096 0.558 . . . . 72.5 110.516 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -39.01 86.03 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 109.082 -0.71 . . . . 72.43 109.082 176.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.436 HD21 HD13 ' A' ' 94' ' ' LEU . 6.7 tt -72.31 -38.4 68.72 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.152 -1.386 . . . . 72.55 109.182 -177.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.431 ' HA ' HD11 ' A' ' 97' ' ' ILE . 66.8 t-105 -60.77 -51.14 70.6 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.312 -0.404 . . . . 73.32 109.968 175.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.49 -38.23 86.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 115.689 -0.687 . . . . 70.4 110.558 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.7 t-105 -61.48 -50.89 70.94 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.302 0.376 . . . . 75.01 111.074 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.85 -50.15 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.529 -0.545 . . . . 53.42 109.529 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -61.16 -46.32 96.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.947 -0.569 . . . . 55.12 111.811 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.472 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 78.3 ttt180 -69.12 -42.48 75.99 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.7 -0.227 . . . . 73.42 111.606 -176.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.424 HD22 ' HE3' ' A' ' 28' ' ' LYS . 2.4 tm? -67.31 -43.73 80.96 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.446 -0.576 . . . . 62.43 109.446 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.442 HD13 HD13 ' A' ' 33' ' ' LEU . 1.5 mt -70.02 -25.18 63.46 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 122.444 0.298 . . . . 71.21 111.673 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -70.2 -12.91 61.92 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.794 -0.817 . . . . 73.12 108.794 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 7.0 mtmp? -101.17 -5.15 26.0 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.512 -0.551 . . . . 65.33 109.512 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.473 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 92.3 m-20 -136.72 52.06 5.52 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.411 -0.813 . . . . 74.32 111.172 -175.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.473 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 6.1 Cg_exo -71.97 -21.78 23.89 Favored 'Trans proline' 0 C--N 1.358 1.04 0 N-CA-C 108.687 -1.313 . . . . 64.43 108.687 -177.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.49 -36.93 68.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.49 -1.686 . . . . 73.54 109.914 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.592 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 69.2 t90 -75.11 -45.16 42.96 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.571 -0.852 . . . . 75.12 109.098 173.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.475 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 60.3 tp -56.46 -48.82 76.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.367 -1.288 . . . . 62.23 112.346 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.7 m -55.99 -36.74 68.24 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 123.575 0.547 . . . . 72.21 111.641 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.81 -38.84 87.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.382 0.611 . . . . 53.42 110.184 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.592 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.8 mmmt -76.53 -37.25 56.98 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.685 -0.406 . . . . 71.31 111.392 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 88.0 mt -54.37 -49.71 69.19 Favored 'General case' 0 C--O 1.186 -2.251 0 O-C-N 123.574 0.546 . . . . 75.11 110.264 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.498 ' HA ' ' HB3' ' A' ' 44' ' ' MET . 28.4 ptt180 -65.22 -30.49 71.39 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 113.463 0.912 . . . . 74.24 113.463 -178.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 72.1 m -69.93 -23.47 63.22 Favored 'General case' 0 N--CA 1.385 -3.709 0 CA-C-N 115.314 -0.857 . . . . 53.54 111.793 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.43 ' CD1' HG23 ' A' ' 72' ' ' THR . 57.7 m-85 -100.66 -44.11 5.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 123.825 0.85 . . . . 62.03 112.639 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.461 HD21 ' HG2' ' A' ' 64' ' ' ARG . 9.5 mp -76.59 120.48 81.85 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 124.438 1.095 . . . . 72.43 110.67 178.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -62.98 -34.5 70.64 Favored 'Trans proline' 0 CA--C 1.535 0.575 0 C-N-CA 122.953 2.436 . . . . 74.14 113.533 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.6 p -114.34 -5.37 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.18 0.514 . . . . 74.51 112.062 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.498 ' HB3' ' HA ' ' A' ' 38' ' ' ARG 0.286 6.4 ptt? 41.96 92.12 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 115.532 1.679 . . . . 71.43 115.532 -174.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -100.92 58.22 0.9 Allowed 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 107.908 -1.145 . . . . 62.42 107.908 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 pp -96.17 -5.18 41.17 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.743 -1.117 . . . . 74.21 112.915 -175.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -80.7 -13.34 59.09 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.767 0.794 . . . . 75.42 111.326 -176.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -75.53 91.09 2.78 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.195 -0.911 . . . . 75.4 110.153 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.1 t -141.74 76.53 1.55 Allowed 'General case' 0 N--CA 1.419 -1.975 0 N-CA-C 108.352 -0.981 . . . . 65.5 108.352 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.31 -28.56 69.29 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-N 113.83 -1.532 . . . . 74.03 112.475 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HB2' HG21 ' A' ' 57' ' ' VAL . 50.0 mt-10 -122.73 169.44 9.8 Favored Pre-proline 0 C--N 1.247 -3.864 0 N-CA-C 106.187 -1.783 . . . . 63.54 106.187 178.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -68.04 -156.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.558 1.685 0 C-N-CA 121.321 1.347 . . . . 71.33 111.517 173.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.0 m -75.72 39.12 0.16 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 124.154 0.982 . . . . 75.04 113.197 -174.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -57.08 149.6 44.83 Favored Pre-proline 0 N--CA 1.432 -1.354 0 C-N-CA 126.186 1.794 . . . . 63.32 111.295 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -46.65 -45.89 18.96 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.35 3.367 . . . . 70.15 114.243 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -74.6 -25.98 59.61 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.178 0.513 . . . . 74.13 110.966 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' A' ' 51' ' ' GLU . 95.5 t -73.97 -47.73 41.43 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.572 -0.899 . . . . 52.25 108.572 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.4 mm -59.02 -41.81 84.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.962 -1.017 . . . . 72.4 109.861 176.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -55.62 -46.58 77.36 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 115.643 -0.708 . . . . 62.4 110.025 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -58.89 -43.34 90.95 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.365 0.603 . . . . 74.15 111.209 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.33 -46.45 76.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.012 -0.995 . . . . 74.53 111.603 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.401 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -74.44 -30.59 61.96 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.465 -0.788 . . . . 75.42 111.918 -177.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -63.13 -38.45 91.23 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 123.706 0.802 . . . . 63.22 109.854 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.461 ' HG2' HD21 ' A' ' 41' ' ' LEU . 9.5 tpp85 -59.5 -29.46 67.88 Favored 'General case' 1 N--CA 1.375 -4.181 0 C-N-CA 124.924 1.29 . . . . 73.42 111.877 178.582 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -71.09 -38.07 72.42 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.795 -0.446 . . . . 73.4 109.795 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -69.08 -31.23 69.83 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.899 -0.778 . . . . 71.54 108.899 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.88 -26.72 66.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.436 -0.802 . . . . 55.1 110.944 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.525 ' HB2' HG21 ' A' ' 72' ' ' THR . 35.8 mm-40 -70.83 -48.56 53.42 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 107.782 -1.192 . . . . 75.24 107.782 174.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.407 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -174.92 139.69 4.95 Favored Glycine 0 CA--C 1.474 -2.499 0 CA-C-N 114.635 -1.166 . . . . 55.14 110.739 -176.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.619 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -66.08 -29.73 70.12 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 106.211 -1.774 . . . . 75.55 106.211 171.666 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.22 -35.54 59.0 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.789 -1.55 . . . . 63.5 108.718 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.525 HG21 ' HB2' ' A' ' 68' ' ' GLN . 91.1 m -58.75 -41.16 85.87 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.742 -0.663 . . . . 74.11 110.03 175.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.575 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -63.33 -49.37 74.2 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.441 -0.345 . . . . 65.04 110.424 176.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 70' ' ' MET . 86.7 mttt -54.7 -35.39 63.57 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.325 0.65 . . . . 74.33 111.545 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.1 m -72.17 -49.94 31.73 Favored 'General case' 0 N--CA 1.409 -2.507 0 N-CA-C 109.69 -0.485 . . . . 72.52 109.69 176.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -50.51 -48.51 56.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 124.125 0.97 . . . . 75.55 112.189 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.41 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 41.1 mm -57.4 -37.07 55.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 N-CA-C 112.644 0.609 . . . . 75.3 112.644 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -65.92 -34.06 77.26 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.288 0.566 . . . . 74.33 110.169 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.404 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 1.2 m-20 -78.21 -42.77 30.35 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.712 -0.676 . . . . 73.53 110.174 175.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.412 HD21 HD21 ' A' ' 26' ' ' LEU . 2.4 tm? -50.19 -54.52 20.29 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.869 1.668 . . . . 74.42 110.542 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 13.2 p -64.48 -33.36 75.71 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.379 -0.828 . . . . 71.42 111.643 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -75.93 -54.64 6.58 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.063 -0.971 . . . . 72.53 111.778 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 40.5 mt-10 -70.93 -31.35 67.93 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.504 0.927 . . . . 72.54 113.504 -170.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.5 -49.34 19.05 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 119.993 -0.683 . . . . 71.33 111.857 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -161.69 -97.3 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.13 0.269 . . . . 74.21 110.514 -176.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -140.64 165.02 32.72 Favored Pre-proline 0 C--N 1.3 -1.573 0 N-CA-C 105.445 -2.057 . . . . 74.32 105.445 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -43.5 107.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 122.967 2.444 . . . . 64.34 112.101 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -8.86 59.61 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.835 -1.075 . . . . 62.35 112.823 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -175.12 -161.64 0.1 Allowed 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 103.179 -2.897 . . . . 73.42 103.179 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.506 ' O ' HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -86.59 141.62 28.88 Favored 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 106.926 -1.509 . . . . 71.15 106.926 178.448 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.566 ' O ' HG13 ' A' ' 95' ' ' VAL . 36.2 tt0 -52.78 -52.25 57.44 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 124.977 1.311 . . . . 65.43 112.94 -175.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 95' ' ' VAL . 39.3 mm -64.44 -45.6 77.46 Favored Pre-proline 0 C--O 1.169 -3.154 0 CA-C-O 117.534 -1.222 . . . . 70.21 113.136 -172.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -49.38 -35.13 34.71 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 CA-C-N 122.837 2.049 . . . . 72.51 112.097 172.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.506 HD23 ' O ' ' A' ' 90' ' ' MET . 3.4 mm? -72.2 -36.59 69.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.691 -0.686 . . . . 71.54 109.385 175.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.575 ' HA ' ' CD1' ' A' ' 73' ' ' TRP . 2.9 m -69.87 -36.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-O 122.385 1.088 . . . . 74.31 109.993 177.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.6 m -70.42 5.24 1.86 Allowed 'General case' 0 C--N 1.293 -1.858 0 C-N-CA 127.694 2.398 . . . . 72.22 113.007 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.431 HD11 ' HA ' ' A' ' 19' ' ' TRP . 10.3 tp -66.61 -28.56 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.088 0.47 . . . . 55.34 111.163 -175.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 . . . . . 0 N--CA 1.421 -1.887 0 N-CA-C 108.126 -1.064 . . . . 72.31 108.126 -179.796 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 tpt . . . . . 0 N--CA 1.45 -0.469 0 CA-C-O 121.201 0.524 . . . . 72.43 110.162 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -78.32 25.09 0.24 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.933 0.893 . . . . 70.34 112.205 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.56 -13.27 60.09 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.22 -1.03 . . . . 64.3 108.22 174.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.432 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -60.88 -38.24 84.96 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.376 -1.284 . . . . 63.44 112.142 178.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.602 ' HB2' HD12 ' A' ' 11' ' ' ILE . 68.0 m -54.92 -32.17 60.89 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 124.679 1.192 . . . . 74.33 111.727 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.602 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -83.88 -25.91 7.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 C-N-CA 124.91 1.284 . . . . 74.31 110.322 -173.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -110.16 7.4 23.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.646 -0.707 . . . . 62.24 111.964 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.4 tt -51.35 121.43 6.27 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.576 1.151 . . . . 74.41 112.586 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.405 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 26.4 t-20 -152.42 149.43 28.58 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 105.093 -2.188 . . . . 71.01 105.093 177.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -122.17 -73.77 0.64 Allowed 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 118.815 -1.154 . . . . 65.42 113.122 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.97 -34.34 75.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.958 1.466 . . . . 72.12 114.958 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -70.26 -40.21 74.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 120.259 -0.576 . . . . 73.13 110.966 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.8 mt -74.44 -34.86 63.3 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.242 -0.436 . . . . 71.21 110.241 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.438 ' HB2' HD11 ' A' ' 97' ' ' ILE . 49.0 t-105 -61.15 -50.12 74.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.278 -0.419 . . . . 65.42 110.769 178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.11 85.73 Favored 'General case' 0 C--O 1.243 0.74 0 O-C-N 123.225 0.328 . . . . 43.55 110.902 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.439 ' HE1' HD22 ' A' ' 88' ' ' LEU . 22.2 t-105 -63.88 -51.03 66.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.739 -0.664 . . . . 73.32 110.948 176.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.8 tp -60.08 -49.2 78.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.998 -0.546 . . . . 62.03 110.076 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.406 ' HA ' HG21 ' A' ' 58' ' ' ILE . 42.3 t -57.42 -46.38 85.64 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 CA-C-N 115.681 -0.69 . . . . 73.35 111.446 179.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.521 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 19.7 tpt180 -68.52 -44.26 75.02 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 116.644 -0.253 . . . . 55.22 110.728 -176.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.415 HD12 HD13 ' A' ' 84' ' ' LEU . 1.9 tm? -67.93 -42.96 80.22 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 109.674 -0.491 . . . . 73.5 109.674 -176.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.409 HD21 HD21 ' A' ' 80' ' ' LEU . 2.3 mt -71.61 -24.53 61.9 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 112.008 0.373 . . . . 74.14 112.008 177.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.6 t -67.09 -23.28 65.83 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 107.723 -1.214 . . . . 71.24 107.723 175.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 31.1 mtmt -90.94 -10.2 43.32 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.66 -0.7 . . . . 70.44 110.084 178.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -135.4 52.3 6.86 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 122.883 0.473 . . . . 74.2 111.33 -177.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.01 -17.88 24.6 Favored 'Trans proline' 0 C--N 1.368 1.556 0 N-CA-C 108.759 -1.285 . . . . 72.22 108.759 -178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -71.55 -38.58 71.0 Favored 'General case' 0 N--CA 1.417 -2.099 0 CA-C-N 113.386 -1.734 . . . . 73.03 109.455 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.444 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.1 t90 -74.67 -47.98 28.75 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.657 -0.817 . . . . 71.35 109.554 176.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.55 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 52.8 tp -54.05 -51.48 63.92 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.009 -1.45 . . . . 70.31 112.418 -175.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.531 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.9 p -50.34 -51.79 42.63 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 123.878 0.736 . . . . 75.01 112.127 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.73 -43.48 76.63 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 125.083 1.353 . . . . 74.33 112.081 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.444 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.0 mmmt -74.05 -30.03 62.19 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.325 -0.235 . . . . 73.33 110.436 178.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 98.0 mt -63.77 -35.88 82.03 Favored 'General case' 0 C--O 1.187 -2.205 0 N-CA-C 109.256 -0.646 . . . . 73.21 109.256 173.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -61.51 -33.56 74.02 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.269 0.557 . . . . 73.35 110.562 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.3 m -74.56 -41.59 60.28 Favored 'General case' 0 N--CA 1.402 -2.855 0 C-N-CA 124.981 1.312 . . . . 72.03 112.324 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.57 ' CD1' HG23 ' A' ' 72' ' ' THR . 67.1 m-85 -88.99 -48.31 7.52 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 113.091 0.775 . . . . 74.45 113.091 -177.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 8.4 mp -89.85 139.0 27.57 Favored Pre-proline 0 C--N 1.295 -1.777 0 C-N-CA 124.425 1.09 . . . . 50.04 112.139 -177.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 41' ' ' LEU . 3.7 Cg_endo -91.04 -13.0 2.14 Favored 'Trans proline' 0 CA--C 1.551 1.326 0 C-N-CA 122.241 1.96 . . . . 73.43 109.284 166.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.9 p -114.37 26.59 10.13 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 125.668 1.587 . . . . 60.35 111.567 -172.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.454 ' HB3' ' HB2' ' A' ' 41' ' ' LEU 0.257 0.0 OUTLIER -59.11 96.08 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 115.946 1.832 . . . . 75.21 115.946 -173.943 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.413 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 16.4 m-20 -83.72 74.06 10.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.004 -1.48 . . . . 74.41 107.004 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 34' ' ' SER . 4.6 pp -95.81 -27.35 15.26 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-N 115.24 -0.891 . . . . 74.1 111.456 -178.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -103.66 6.13 36.85 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 122.265 1.031 . . . . 73.1 109.668 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 63.6 m -81.72 74.33 8.72 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 122.407 1.099 . . . . 41.32 109.464 177.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.4 t -90.52 83.33 5.84 Favored 'General case' 0 N--CA 1.403 -2.793 0 CA-C-N 114.36 -1.291 . . . . 64.11 110.142 -176.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.411 ' CE1' HG22 ' A' ' 57' ' ' VAL . 0.6 OUTLIER -79.76 -28.79 40.36 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 123.166 1.46 . . . . 75.31 108.696 170.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -135.0 161.87 61.11 Favored Pre-proline 1 N--CA 1.373 -4.313 0 CA-C-N 112.03 -2.35 . . . . 63.03 105.191 177.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.2 Cg_exo -67.81 -143.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.846 2.364 . . . . 73.52 111.917 175.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.9 m -76.91 37.64 0.19 Allowed 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 124.1 0.96 . . . . 71.4 110.489 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 52' ' ' PRO . 7.2 m-20 -65.32 152.23 92.39 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 126.795 2.038 . . . . 74.34 113.258 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -54.32 -41.67 74.36 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 123.954 3.103 . . . . 64.2 114.272 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.47 -29.69 61.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.225 0.536 . . . . 73.35 110.478 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 86.8 t -66.38 -51.65 55.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.207 -1.034 . . . . 71.4 108.207 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.406 HG21 ' HA ' ' A' ' 23' ' ' VAL . 46.9 mm -59.65 -41.56 85.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.561 -1.199 . . . . 71.43 109.709 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -56.42 -42.15 77.55 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.838 0.455 . . . . 74.22 111.251 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.529 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 21.2 ttt180 -61.21 -42.0 97.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.599 0.714 . . . . 75.41 110.953 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 84.6 mt-30 -71.39 -42.24 68.63 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.942 -1.026 . . . . 51.11 111.764 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.406 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -75.51 -31.11 60.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 115.347 -0.842 . . . . 72.34 110.547 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.529 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 23.7 t-20 -53.33 -49.77 66.4 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.957 1.303 . . . . 52.35 110.23 173.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.431 ' CB ' HD21 ' A' ' 41' ' ' LEU . 30.0 mmt180 -54.69 -33.6 61.14 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.553 -1.658 . . . . 54.11 113.071 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -67.02 -40.66 87.29 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.641 0.258 . . . . 71.25 110.575 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -67.17 -32.95 74.39 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.812 -0.81 . . . . 74.42 108.812 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.09 -18.96 63.27 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.321 -0.854 . . . . 64.25 111.281 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -79.52 -55.85 4.74 Favored 'General case' 0 N--CA 1.413 -2.277 0 N-CA-C 107.137 -1.431 . . . . 64.14 107.137 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -166.51 140.29 6.25 Favored Glycine 0 N--CA 1.42 -2.372 0 CA-C-N 114.132 -1.395 . . . . 73.1 111.036 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.445 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 45.8 ttm -65.13 -30.88 71.85 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 106.137 -1.801 . . . . 62.4 106.137 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.15 -35.52 59.16 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.641 -1.618 . . . . 61.52 109.123 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.57 HG23 ' CD1' ' A' ' 40' ' ' PHE . 54.9 m -59.96 -36.95 78.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.813 -0.631 . . . . 72.34 110.007 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.506 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 75.1 t-105 -61.94 -53.0 61.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.678 -0.49 . . . . 72.43 109.678 176.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.507 ' HA ' HG12 ' A' ' 95' ' ' VAL . 92.4 mttt -51.28 -46.58 62.5 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.89 0.876 . . . . 74.52 111.727 177.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.66 -44.11 74.79 Favored 'General case' 0 N--CA 1.41 -2.444 0 C-N-CA 123.035 0.534 . . . . 43.13 112.168 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -57.06 -46.02 82.79 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 122.816 0.446 . . . . 74.11 110.382 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.646 HG21 ' HB2' ' A' ' 94' ' ' LEU . 45.4 mm -63.71 -31.35 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.019 0 CA-C-N 115.751 -0.659 . . . . 74.12 111.565 -177.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.22 -40.77 94.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.5 -0.556 . . . . 73.42 109.5 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 82.7 m-20 -68.44 -42.28 79.06 Favored 'General case' 0 C--O 1.187 -2.221 0 CA-C-N 116.017 -0.538 . . . . 72.23 109.756 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.468 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -50.52 -53.91 26.49 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.085 1.354 . . . . 75.22 109.767 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.4 m -64.24 -35.14 79.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 45.34 111.403 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -76.33 -54.29 6.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.206 0.526 . . . . 73.3 112.105 -178.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 31.0 mt-10 -74.78 -22.57 58.68 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.734 1.013 . . . . 73.04 113.734 -169.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.415 HD13 HD12 ' A' ' 25' ' ' LEU . 94.6 mt -79.71 -42.13 25.29 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 119.046 -1.061 . . . . 62.01 111.823 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . 0.25 4.3 p30 -171.19 -90.48 0.01 OUTLIER 'General case' 0 C--O 1.241 0.641 0 N-CA-C 112.677 0.621 . . . . 74.34 112.677 174.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 69.4 t -130.51 148.04 68.37 Favored Pre-proline 0 C--N 1.301 -1.507 0 N-CA-C 106.297 -1.742 . . . . 74.32 106.297 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -39.22 109.0 0.08 OUTLIER 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 123.393 2.729 . . . . 74.45 112.207 173.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.439 HD22 ' HE1' ' A' ' 21' ' ' TRP . 0.7 OUTLIER -74.29 -15.58 60.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.026 -0.988 . . . . 71.2 112.91 -178.297 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.86 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 105.207 -2.146 . . . . 74.13 105.207 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.1 mmt -168.5 163.66 12.51 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 102.886 -3.005 . . . . 54.34 102.886 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.585 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.9 OUTLIER -72.01 -43.66 64.68 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 118.489 0.586 . . . . 75.14 111.105 -179.548 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.521 ' O ' HG22 ' A' ' 95' ' ' VAL . 29.5 mm -50.47 -44.14 81.95 Favored Pre-proline 0 CA--C 1.572 1.796 0 C-N-CA 125.7 1.6 . . . . 70.42 114.132 -171.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.03 -43.38 58.75 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.494 1.463 . . . . 65.41 110.793 174.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.646 ' HB2' HG21 ' A' ' 77' ' ' ILE . 2.8 mm? -75.15 -31.88 61.17 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.586 -1.188 . . . . 74.03 109.78 -179.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.585 HG13 ' O ' ' A' ' 91' ' ' GLU . 4.1 m -67.74 -31.36 52.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-O 122.176 0.989 . . . . 72.31 110.49 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.4 t -80.79 5.8 14.84 Favored 'General case' 0 C--N 1.281 -2.386 0 CA-C-N 113.708 -1.587 . . . . 33.03 112.408 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.438 HD11 ' HB2' ' A' ' 19' ' ' TRP . 15.4 tt -60.46 -27.81 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 CA-C-O 121.478 0.656 . . . . 64.52 110.448 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.428 -1.533 0 N-CA-C 106.913 -1.514 . . . . 64.01 106.913 173.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.8 tmm? . . . . . 0 CA--C 1.487 -1.479 0 N-CA-C 108.369 -0.974 . . . . 74.35 108.369 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -168.19 23.46 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 114.352 -1.294 . . . . 73.4 109.495 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.455 ' HB3' ' HB ' ' A' ' 92' ' ' ILE . . . -77.63 -12.03 59.93 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.765 1.269 . . . . 52.24 108.788 178.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.413 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -66.65 -30.57 70.86 Favored 'General case' 0 N--CA 1.415 -2.224 0 CA-C-N 112.917 -1.947 . . . . 71.35 111.892 178.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.4 m -67.38 -37.79 83.7 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.638 0.732 . . . . 63.42 111.699 177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.1 mp -84.63 -49.26 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.285 0 CA-C-N 115.168 -0.924 . . . . 73.31 112.015 -176.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -77.91 -36.16 49.84 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.977 -0.689 . . . . 74.14 112.302 -176.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt 60.09 106.91 0.02 OUTLIER 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.39 1.076 . . . . 72.33 113.856 -177.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -69.12 155.57 40.15 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.762 -0.653 . . . . 65.31 110.872 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -157.22 179.88 8.85 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.855 -0.612 . . . . 60.31 109.829 -174.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 mp0 -61.91 -34.68 76.5 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.441 0.697 . . . . 75.32 112.794 -175.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -59.7 -46.92 87.63 Favored 'General case' 0 CA--C 1.474 -1.978 0 CA-C-O 123.0 1.381 . . . . 75.34 109.513 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.448 HD21 HD12 ' A' ' 94' ' ' LEU . 3.2 tm? -65.84 -39.51 90.88 Favored 'General case' 0 N--CA 1.407 -2.625 0 CA-C-N 111.667 -2.515 . . . . 63.53 110.361 -174.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.475 ' CE3' HG12 ' A' ' 97' ' ' ILE . 61.3 t-105 -68.72 -45.75 70.74 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.824 0.345 . . . . 72.43 110.366 174.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.39 85.41 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.634 -0.712 . . . . 64.43 111.309 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.59 -47.34 70.22 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.019 0.528 . . . . 64.32 111.406 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -60.9 -49.99 75.24 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.005 -0.543 . . . . 71.52 110.076 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.797 -0.638 . . . . 64.14 111.443 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.551 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 40.1 mmt180 -72.01 -42.92 65.83 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 112.213 0.449 . . . . 74.35 112.213 -175.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.485 HD12 HD13 ' A' ' 84' ' ' LEU . 2.6 tm? -67.99 -38.23 82.44 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.407 -0.59 . . . . 72.25 109.407 -177.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.503 HD13 HD13 ' A' ' 33' ' ' LEU . 3.3 mt -71.98 -25.45 61.86 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 112.248 0.462 . . . . 61.41 112.248 176.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 t -69.38 -20.98 63.82 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.054 -1.091 . . . . 72.14 108.054 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.551 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.44 -2.56 51.65 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.584 -0.735 . . . . 64.34 109.956 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.437 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -138.32 52.39 4.69 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 115.686 -0.688 . . . . 73.25 111.682 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.1 Cg_exo -68.6 -22.36 38.2 Favored 'Trans proline' 0 C--N 1.364 1.346 0 N-CA-C 108.342 -1.446 . . . . 73.32 108.342 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -67.2 -44.62 79.14 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.01 -1.45 . . . . 72.25 110.375 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.419 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 64.3 t90 -74.31 -44.22 53.46 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 119.387 -0.925 . . . . 71.31 109.251 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.597 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.8 tp -57.74 -52.45 65.4 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.082 -1.417 . . . . 64.01 111.799 -175.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.479 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 15.0 p -51.52 -48.02 63.11 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 124.014 0.821 . . . . 72.52 111.807 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.36 85.01 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.878 0.871 . . . . 72.02 111.691 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 36' ' ' LYS . 24.7 mmmt -68.9 -38.47 79.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.71 -0.396 . . . . 71.24 111.638 177.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.631 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 99.0 mt -58.61 -30.95 67.64 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 123.335 0.654 . . . . 74.51 111.118 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 34' ' ' SER . 51.5 mtm180 -61.87 -30.97 71.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.743 0.417 . . . . 73.12 111.841 -178.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.7 t -84.08 -27.07 28.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.645 0.736 . . . . 62.5 110.185 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.459 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.6 m-85 -89.75 -54.74 3.93 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.631 -0.713 . . . . 75.13 112.518 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.565 HD22 ' SD ' ' A' ' 44' ' ' MET . 9.9 mp -87.49 121.22 71.23 Favored Pre-proline 0 C--N 1.311 -1.088 0 N-CA-C 112.627 0.603 . . . . 71.24 112.627 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -84.14 -15.9 6.43 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 C-N-CA 122.105 1.87 . . . . 74.23 110.49 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 t -115.15 27.83 9.12 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.292 -0.867 . . . . 64.11 110.004 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.637 ' HG2' HD23 ' A' ' 46' ' ' LEU . 5.3 tpt -58.2 111.4 1.19 Allowed 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 113.828 1.047 . . . . 73.21 113.828 -174.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -99.6 68.63 1.58 Allowed 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 107.663 -1.236 . . . . 70.33 107.663 174.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.637 HD23 ' HG2' ' A' ' 44' ' ' MET . 3.0 pp -95.1 -20.64 19.12 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 114.888 -1.051 . . . . 75.41 111.068 -174.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.51 -17.9 50.16 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.124 -0.944 . . . . 74.52 110.696 -174.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.9 m -93.32 74.87 4.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.771 -1.104 . . . . 54.44 112.06 -175.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 p -89.91 84.73 6.23 Favored 'General case' 0 N--CA 1.412 -2.369 0 CA-C-O 121.944 0.878 . . . . 74.23 110.009 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -28.64 68.72 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 114.713 -1.13 . . . . 72.33 111.563 177.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -123.53 164.34 29.03 Favored Pre-proline 1 N--CA 1.369 -4.481 0 N-CA-C 105.215 -2.142 . . . . 74.12 105.215 177.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.492 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 29.0 Cg_endo -65.68 -155.19 0.03 OUTLIER 'Trans proline' 0 CA--C 1.551 1.345 0 C-N-CA 122.562 2.175 . . . . 72.33 112.592 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.7 m -75.52 37.45 0.14 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.453 0.701 . . . . 72.24 110.739 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.492 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 5.0 m-20 -60.59 147.54 83.31 Favored Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 124.822 1.249 . . . . 74.42 113.227 -176.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -43.52 -50.52 6.82 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 124.411 3.407 . . . . 74.54 113.688 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -74.89 -18.96 60.34 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 113.407 0.892 . . . . 71.42 113.407 -178.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.473 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 90.5 t -75.43 -42.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 N-CA-C 107.611 -1.255 . . . . 71.22 107.611 175.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.4 mm -66.2 -42.03 90.35 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-N 115.09 -0.959 . . . . 72.43 108.854 175.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -54.52 -45.74 73.42 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 124.878 1.271 . . . . 73.41 112.854 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 57' ' ' VAL . 6.7 ptm180 -64.59 -31.55 72.82 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-N 118.549 0.613 . . . . 65.32 111.792 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.0 mt-30 -72.52 -44.01 62.79 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.574 0.702 . . . . 73.34 109.435 -177.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.11 -33.09 65.37 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.859 -1.064 . . . . 72.02 110.429 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.414 ' HA ' ' CD2' ' A' ' 66' ' ' PHE . 26.1 t-20 -56.83 -52.4 65.25 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 124.095 0.958 . . . . 74.14 109.854 175.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.517 ' CB ' HD21 ' A' ' 41' ' ' LEU . 21.8 mmt180 -56.71 -29.55 62.55 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.36 -1.291 . . . . 74.54 113.474 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.419 HD21 HD23 ' A' ' 37' ' ' LEU . 56.2 mt -68.79 -45.07 72.27 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 121.125 -0.23 . . . . 73.42 110.863 176.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.414 ' CD2' ' HA ' ' A' ' 63' ' ' ASN . 0.5 OUTLIER -70.3 -25.21 63.22 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 119.807 -0.757 . . . . 71.12 109.62 -179.54 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.19 -30.38 67.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.437 -0.801 . . . . 51.41 110.719 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.48 ' HB2' HG21 ' A' ' 72' ' ' THR . 42.1 mm-40 -66.35 -38.72 88.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 109.003 -0.74 . . . . 44.25 109.003 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -179.59 139.56 3.91 Favored Glycine 0 N--CA 1.404 -3.449 0 CA-C-N 114.575 -1.193 . . . . 53.5 111.29 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.579 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -66.01 -31.47 72.39 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.022 -1.844 . . . . 74.43 106.022 171.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.64 -41.84 44.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.059 -1.428 . . . . 63.51 108.975 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.48 HG21 ' HB2' ' A' ' 68' ' ' GLN . 89.6 m -53.35 -41.27 65.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.845 0.458 . . . . 65.15 110.276 175.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.9 t-105 -62.63 -50.98 69.1 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.693 -0.685 . . . . 73.42 110.358 177.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.579 ' HG3' ' O ' ' A' ' 70' ' ' MET . 87.5 mttt -55.42 -42.76 74.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.616 0.366 . . . . 65.33 111.374 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.9 m -66.12 -46.99 75.6 Favored 'General case' 0 N--CA 1.409 -2.5 0 C-N-CA 123.355 0.662 . . . . 75.5 110.674 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -57.14 -50.83 71.59 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.746 -0.661 . . . . 74.31 110.624 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.445 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 32.1 mm -59.76 -32.77 50.31 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.439 -0.8 . . . . 74.44 111.607 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -64.71 -43.53 93.16 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.568 -0.53 . . . . 74.33 109.568 177.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -72.24 -37.9 69.02 Favored 'General case' 0 C--O 1.189 -2.096 0 CA-C-N 116.403 -0.362 . . . . 73.04 110.385 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.0 tm? -49.53 -54.59 17.16 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 125.402 1.481 . . . . 75.12 110.135 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.8 m -67.82 -35.21 78.21 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 115.942 -0.572 . . . . 44.24 111.09 -178.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -75.81 -48.77 20.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.838 -0.619 . . . . 71.23 111.393 -176.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -71.33 -27.06 63.11 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 122.906 0.482 . . . . 75.32 111.755 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.485 HD13 HD12 ' A' ' 25' ' ' LEU . 85.8 mt -92.26 -3.54 55.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 116.192 -0.458 . . . . 63.25 109.955 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 t70 59.24 38.72 23.29 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.021 1.328 . . . . 61.31 111.551 174.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 m -120.0 105.44 42.64 Favored Pre-proline 0 C--N 1.304 -1.375 0 CA-C-N 115.245 -0.889 . . . . 71.4 111.241 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.75 102.64 1.34 Allowed 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 121.963 1.776 . . . . 64.42 108.959 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.2 mt -96.79 -14.94 21.6 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.437 0.532 . . . . 73.12 112.437 -173.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.7 t70 70.69 -64.84 0.36 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 124.709 1.204 . . . . 62.41 110.572 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.425 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . 23.9 ptp -77.31 35.11 0.17 Allowed 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.68 1.592 . . . . 63.02 112.411 -175.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.7 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 17.8 tt0 -58.9 -36.12 74.17 Favored 'General case' 0 C--O 1.186 -2.246 0 C-N-CA 125.831 1.652 . . . . 74.4 110.039 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.522 ' O ' HG22 ' A' ' 95' ' ' VAL . 47.1 mm -70.88 -45.29 15.72 Favored Pre-proline 0 C--O 1.176 -2.791 0 O-C-N 121.268 -0.895 . . . . 70.52 109.484 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.425 ' HG2' ' HB2' ' A' ' 90' ' ' MET . 21.4 Cg_exo -47.62 -38.21 28.31 Favored 'Trans proline' 0 CA--C 1.554 1.498 0 CA-C-N 121.2 1.464 . . . . 71.14 111.855 164.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 8.9 mp -59.6 -47.74 84.39 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 108.688 -0.856 . . . . 73.2 108.688 171.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 91' ' ' GLU . 3.7 m -64.91 -35.63 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 CA-C-O 122.267 1.032 . . . . 72.21 111.381 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.0 t -83.94 6.05 23.23 Favored 'General case' 0 C--N 1.276 -2.62 0 C-N-CA 125.715 1.606 . . . . 63.03 111.87 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.475 HG12 ' CE3' ' A' ' 19' ' ' TRP . 3.0 tp -65.47 -18.56 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 108.336 -0.987 . . . . 74.13 108.336 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 75.3 t90 . . . . . 0 N--CA 1.42 -1.96 0 C-N-CA 125.541 1.536 . . . . 70.22 108.194 176.51 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.9 ttm . . . . . 0 C--O 1.238 0.474 0 CA-C-O 123.305 1.526 . . . . 64.3 107.466 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -157.41 26.08 0.29 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.335 -2.211 . . . . 61.34 108.312 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.666 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -61.81 -13.34 23.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.286 -0.87 . . . . 70.34 112.955 -178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.63 -37.62 84.63 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.652 0.781 . . . . 75.22 109.745 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.1 m -75.78 -17.66 59.79 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-N 114.051 -1.432 . . . . 70.22 110.541 -174.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.666 HG12 ' HA ' ' A' ' 8' ' ' ALA . 6.6 mm -87.6 -44.31 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 CA-C-N 115.412 -0.813 . . . . 71.24 110.247 -174.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -104.13 -45.33 4.75 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 114.431 1.271 . . . . 74.45 114.431 -174.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 54.91 83.64 0.08 Allowed 'General case' 0 C--N 1.344 0.368 0 N-CA-C 108.896 -0.779 . . . . 73.33 108.896 -166.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.474 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 5.5 t-20 -120.31 -168.51 1.64 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.122 -0.49 . . . . 72.34 110.109 -170.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.628 ' O ' HD12 ' A' ' 18' ' ' LEU . 5.6 t-20 -148.98 -173.05 4.26 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 109.19 -0.671 . . . . 74.35 109.19 -176.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -48.14 -27.48 2.39 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 128.192 2.597 . . . . 72.15 114.099 -171.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -57.98 -28.97 64.86 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 123.09 0.556 . . . . 73.41 110.975 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.643 ' HB2' ' SD ' ' A' ' 90' ' ' MET . 0.0 OUTLIER -62.17 -33.33 74.32 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.533 -0.758 . . . . 71.32 110.653 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.492 ' N ' HD13 ' A' ' 18' ' ' LEU . 75.9 t-105 -68.43 -32.43 72.46 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-N 115.672 -0.695 . . . . 72.31 110.117 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.95 -31.18 70.73 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.093 0.473 . . . . 45.34 109.971 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.581 ' CZ2' ' HG ' ' A' ' 25' ' ' LEU . 73.4 t90 -63.09 -50.07 71.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.635 -0.876 . . . . 73.51 108.635 173.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.06 -53.23 58.52 Favored 'General case' 0 CA--C 1.516 -0.361 0 O-C-N 124.509 1.13 . . . . 73.43 110.415 -176.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.8 t -53.82 -53.64 25.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 O-C-N 123.8 0.688 . . . . 72.25 112.052 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.503 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 26.6 mmt180 -74.57 -32.01 62.25 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 113.233 0.827 . . . . 64.1 113.233 -176.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.581 ' HG ' ' CZ2' ' A' ' 21' ' ' TRP . 1.8 tm? -70.59 -42.64 70.75 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.699 -0.852 . . . . 63.13 108.699 -178.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.513 HD13 HD23 ' A' ' 33' ' ' LEU . 1.2 mt -70.76 -24.63 62.64 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.924 -0.58 . . . . 22.13 111.185 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 p -69.71 -11.95 61.25 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.907 0.86 . . . . 64.24 108.854 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.9 mtmt -99.56 -9.87 22.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.307 -0.627 . . . . 62.41 109.307 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.441 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.3 m-80 -133.62 53.39 10.2 Favored Pre-proline 0 C--O 1.24 0.578 0 CA-C-N 115.664 -0.698 . . . . 72.53 111.934 -175.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -70.07 -22.19 31.01 Favored 'Trans proline' 0 C--N 1.363 1.335 0 N-CA-C 108.472 -1.395 . . . . 72.22 108.472 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.11 -41.86 85.49 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 113.325 -1.762 . . . . 72.25 109.929 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.493 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 73.5 t90 -73.83 -43.04 59.95 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 119.646 -0.822 . . . . 73.44 109.47 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.513 HD23 HD13 ' A' ' 26' ' ' LEU . 2.0 tm? -60.36 -43.26 96.71 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.105 -0.952 . . . . 74.1 110.344 -174.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 m -63.98 -35.16 79.77 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 120.799 0.333 . . . . 71.21 111.625 178.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.26 80.49 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 121.261 0.553 . . . . 32.24 110.172 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.5 mmtt -76.74 -40.61 47.95 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.117 -0.633 . . . . 74.53 112.609 173.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 78.0 mt -51.56 -41.7 61.32 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.189 0.596 . . . . 51.43 111.938 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.475 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 0.1 OUTLIER -59.54 -28.06 66.76 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.383 1.253 . . . . 74.43 114.383 -177.673 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.4 t -77.06 -40.45 46.22 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 115.745 -0.661 . . . . 64.41 110.133 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -81.84 -47.25 13.04 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 123.655 0.782 . . . . 74.54 112.637 -176.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 mp -80.9 124.89 81.17 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 123.379 0.672 . . . . 73.35 109.867 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -72.01 -36.47 5.88 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.045 2.497 . . . . 75.31 114.014 -177.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.5 p -106.12 -5.59 19.26 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.775 0.798 . . . . 71.23 110.316 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.475 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 2.0 mpp? 40.68 92.18 0.01 OUTLIER 'General case' 0 N--CA 1.408 -2.572 0 C-N-CA 127.69 2.396 . . . . 64.34 115.735 -175.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -101.62 70.03 1.25 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 122.733 1.254 . . . . 63.54 108.459 168.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -95.79 -5.13 42.59 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 113.146 -1.843 . . . . 63.21 110.607 -176.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -75.84 47.35 0.42 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.388 1.475 . . . . 71.24 110.436 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.4 m -86.08 -3.47 58.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.629 -0.714 . . . . 74.35 112.715 -176.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 50.7 m -82.95 65.39 8.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.769 0.795 . . . . 63.31 112.733 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.41 -28.22 37.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-O 122.921 1.343 . . . . 75.42 109.931 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.447 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 54.1 mt-10 -116.22 173.39 3.06 Favored Pre-proline 1 N--CA 1.375 -4.185 0 N-CA-C 104.919 -2.252 . . . . 73.44 104.919 175.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 50.8 Cg_endo -66.85 -156.52 0.03 OUTLIER 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 121.296 1.331 . . . . 64.14 112.074 175.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.6 m -76.1 38.4 0.17 Allowed 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.194 0.998 . . . . 62.11 112.417 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 57' ' ' VAL . 86.2 m-20 -60.08 148.39 77.96 Favored Pre-proline 0 N--CA 1.438 -1.054 0 C-N-CA 125.156 1.382 . . . . 74.52 112.308 -179.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.61 -32.93 97.74 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 123.129 2.553 . . . . 65.11 112.781 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.2 mp0 -68.95 -40.39 78.96 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.591 -0.892 . . . . 61.03 108.591 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.412 HG23 ' HB2' ' A' ' 54' ' ' ASN . 78.1 t -63.59 -48.57 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 CA-C-N 114.191 -1.368 . . . . 54.51 109.234 178.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.535 ' HA ' HE21 ' A' ' 61' ' ' GLN . 46.4 mm -59.81 -46.58 93.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.223 -0.899 . . . . 61.51 110.443 177.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -57.15 -38.8 74.08 Favored 'General case' 0 C--O 1.202 -1.406 0 CA-C-O 119.404 -0.331 . . . . 60.13 111.59 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 46.5 ttt180 -61.39 -40.56 94.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.851 0.834 . . . . 74.34 111.281 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.535 HE21 ' HA ' ' A' ' 58' ' ' ILE . 50.1 mt-30 -67.23 -47.15 71.67 Favored 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.434 -1.257 . . . . 74.31 110.317 -177.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.94 -31.04 67.52 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.553 -1.203 . . . . 73.44 111.151 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 2.8 t-20 -54.78 -51.13 66.72 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 124.616 1.166 . . . . 71.42 110.015 176.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -55.14 -31.33 61.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.66 -1.154 . . . . 70.35 113.077 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.8 mt -72.64 -43.73 62.84 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 112.273 0.472 . . . . 64.14 112.273 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -69.96 -25.61 63.72 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.717 -0.846 . . . . 74.1 108.717 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.02 -31.27 68.83 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.338 -0.846 . . . . 73.04 110.832 174.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.44 ' HB2' HG21 ' A' ' 72' ' ' THR . 48.5 mm-40 -68.21 -41.6 81.08 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 109.049 -0.723 . . . . 72.42 109.049 176.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.79 142.34 4.79 Favored Glycine 0 N--CA 1.421 -2.328 0 CA-C-N 114.986 -1.006 . . . . 64.24 112.365 -177.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.2 ptm -69.17 -26.57 64.92 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 106.498 -1.667 . . . . 64.12 106.498 170.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.415 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . . . -75.67 -46.9 28.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 113.684 -1.598 . . . . 74.34 108.004 175.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.44 HG21 ' HB2' ' A' ' 68' ' ' GLN . 84.9 m -53.55 -41.72 66.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.836 0.71 . . . . 75.31 110.339 177.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.574 ' O ' HG12 ' A' ' 77' ' ' ILE . 75.9 t-105 -60.17 -49.43 77.67 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.424 -0.807 . . . . 74.23 111.466 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.415 ' HE3' ' HA ' ' A' ' 71' ' ' ALA . 9.4 ptpt -69.59 -35.02 74.94 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 121.134 0.492 . . . . 53.2 111.479 -174.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.0 m -67.58 -42.45 82.49 Favored 'General case' 0 N--CA 1.405 -2.712 0 CA-C-N 115.632 -0.713 . . . . 35.11 110.361 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.4 -49.62 75.62 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.601 0.761 . . . . 73.14 111.522 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.599 HG21 ' HB2' ' A' ' 94' ' ' LEU . 47.2 mm -59.0 -33.87 51.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.466 -0.788 . . . . 74.25 111.852 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.1 -39.02 93.15 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.965 0.412 . . . . 70.23 110.266 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.447 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 2.4 m-20 -74.51 -36.01 63.2 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.942 0.401 . . . . 65.43 110.474 176.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.496 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.0 tm? -54.4 -54.54 39.2 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.715 1.206 . . . . 71.54 110.225 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 29.9 p -66.9 -32.67 74.07 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.81 -0.632 . . . . 74.23 111.394 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -71.27 -54.75 9.79 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.04 -0.982 . . . . 74.12 111.926 -176.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 19.8 mt-10 -73.31 -22.28 60.37 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 112.52 0.563 . . . . 71.41 112.52 -171.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.9 mt -86.97 -2.26 58.48 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.492 -0.483 . . . . 63.24 111.548 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 t70 72.9 -32.02 0.24 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 114.546 1.313 . . . . 70.52 114.546 174.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.46 ' O ' HD23 ' A' ' 88' ' ' LEU . 61.4 t -48.68 124.43 12.24 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 124.367 1.067 . . . . 65.4 111.891 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -80.27 44.01 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.462 2.774 . . . . 75.4 111.696 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.539 ' H ' HD23 ' A' ' 88' ' ' LEU . 2.0 pt? -62.88 -48.47 78.83 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.506 -0.315 . . . . 54.13 111.326 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.471 ' O ' ' HB1' ' A' ' 8' ' ' ALA . 48.2 m-20 56.3 31.27 18.25 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.139 0.971 . . . . 65.32 111.856 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.643 ' SD ' ' HB2' ' A' ' 18' ' ' LEU . 50.4 mtt -99.76 13.99 31.78 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.116 -1.068 . . . . 64.13 108.116 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.669 ' O ' HG13 ' A' ' 95' ' ' VAL . 3.3 tt0 -47.14 -60.92 2.15 Favored 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 125.184 1.394 . . . . 51.5 113.35 -174.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -64.14 -44.03 75.9 Favored Pre-proline 0 C--O 1.201 -1.48 0 CA-C-N 119.111 0.869 . . . . 61.11 111.717 -178.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -48.37 -35.49 27.98 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 121.476 1.451 . . . . 70.55 111.763 170.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.599 ' HB2' HG21 ' A' ' 77' ' ' ILE . 3.3 mm? -67.98 -51.97 41.23 Favored 'General case' 0 C--O 1.202 -1.406 0 N-CA-C 109.078 -0.712 . . . . 71.54 109.078 169.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.669 HG13 ' O ' ' A' ' 91' ' ' GLU . 2.7 m -60.44 -37.57 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-O 122.062 0.934 . . . . 73.12 113.204 -171.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.1 t -93.52 6.17 49.11 Favored 'General case' 0 C--N 1.26 -3.312 0 CA-C-N 114.146 -1.388 . . . . 71.43 111.774 -174.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.433 HG22 ' O ' ' A' ' 94' ' ' LEU . 8.3 tt -55.24 -39.73 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 112.833 0.679 . . . . 64.24 112.833 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 43.7 m95 . . . . . 0 N--CA 1.411 -2.377 0 N-CA-C 107.608 -1.256 . . . . 73.51 107.608 179.559 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.521 ' O ' ' HG3' ' A' ' 9' ' ' GLU . 2.2 mpt? . . . . . 0 C--O 1.206 -1.223 0 N-CA-C 111.961 0.356 . . . . 65.01 111.961 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.33 25.33 1.21 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 113.328 0.862 . . . . 71.43 113.328 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.505 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.21 -15.7 58.56 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-O 121.821 0.82 . . . . 60.24 108.987 172.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.541 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -56.68 -41.36 77.16 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.643 1.177 . . . . 74.21 114.001 -179.251 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.572 ' HB2' HD12 ' A' ' 11' ' ' ILE . 74.7 m -55.06 -36.64 65.81 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 125.058 1.343 . . . . 64.15 110.36 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.572 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -81.73 -29.71 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.969 0 C-N-CA 125.164 1.386 . . . . 64.45 109.672 -175.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -76.6 -64.88 1.02 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.87 -0.604 . . . . 73.53 112.486 -177.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -175.42 -75.98 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 110.048 -0.353 . . . . 73.33 110.048 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.6 t30 65.31 109.12 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.377 1.071 . . . . 73.11 111.644 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.471 ' H ' HD23 ' A' ' 18' ' ' LEU . 28.0 t-20 -172.78 163.4 5.07 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 122.358 -0.214 . . . . 74.23 110.463 -176.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.04 -27.88 35.03 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.519 1.528 . . . . 73.02 111.472 177.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.2 -28.13 62.59 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 112.599 0.592 . . . . 61.12 112.599 177.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.632 HD12 HD22 ' A' ' 94' ' ' LEU . 3.6 mm? -71.1 -34.59 71.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.219 0.533 . . . . 71.02 109.741 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.454 ' HB2' HD11 ' A' ' 97' ' ' ILE . 74.2 t-105 -65.98 -42.34 89.98 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.401 -0.818 . . . . 75.13 110.236 -178.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.72 -42.65 97.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.061 -0.518 . . . . 72.43 110.35 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -59.41 -50.44 73.93 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.103 -0.499 . . . . 74.21 110.531 176.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.446 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -57.3 -53.31 59.61 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.94 0.775 . . . . 75.43 109.551 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.36 -46.96 94.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 112.849 0.685 . . . . 62.2 112.849 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -72.3 -36.79 69.03 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 112.301 0.482 . . . . 72.1 112.301 -174.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.67 -40.8 63.41 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.943 -0.762 . . . . 62.13 108.943 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.569 HD13 HD23 ' A' ' 33' ' ' LEU . 3.6 mt -71.36 -24.14 62.04 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 112.656 0.613 . . . . 73.2 112.656 178.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.0 t -62.81 -20.96 65.54 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.275 -1.009 . . . . 61.21 108.275 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -97.46 -0.05 46.8 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.061 0.458 . . . . 62.11 110.218 177.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.415 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.2 m-80 -139.36 54.66 6.22 Favored Pre-proline 0 C--O 1.245 0.825 0 C-N-CA 122.886 0.474 . . . . 73.51 111.352 -177.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.415 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -71.22 -21.66 26.67 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.247 1.298 . . . . 74.3 108.808 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -71.71 -36.61 70.59 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 113.625 -1.625 . . . . 72.21 110.437 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.468 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 82.0 t90 -75.0 -48.09 25.85 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 119.518 -0.873 . . . . 72.32 110.016 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.569 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -56.76 -45.65 81.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.822 -1.081 . . . . 70.54 111.172 -172.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.516 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 10.6 p -57.81 -44.93 86.71 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.126 -0.488 . . . . 74.11 112.21 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.87 -44.35 78.03 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 124.106 0.963 . . . . 51.42 111.598 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 70.7 mmtt -71.38 -29.67 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.933 -0.307 . . . . 74.23 111.548 176.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.6 mt -62.7 -36.07 81.74 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 110.263 -0.273 . . . . 73.43 110.263 174.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -63.39 -35.22 79.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.63 0.729 . . . . 51.05 109.769 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.8 m -71.91 -47.47 52.33 Favored 'General case' 0 N--CA 1.392 -3.374 0 C-N-CA 124.883 1.273 . . . . 71.13 111.902 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.529 ' CD1' HG23 ' A' ' 72' ' ' THR . 52.8 m-85 -84.61 -46.48 11.48 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 114.059 1.133 . . . . 73.14 114.059 -174.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 1.9 mm? -95.85 112.83 60.61 Favored Pre-proline 0 N--CA 1.424 -1.739 0 C-N-CA 122.317 0.247 . . . . 74.51 110.423 -175.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.83 -37.9 18.97 Favored 'Trans proline' 0 C--O 1.217 -0.542 0 C-N-CA 122.303 2.002 . . . . 72.44 111.193 178.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.8 t -103.95 30.15 5.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.613 -0.722 . . . . 73.3 110.787 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.555 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -43.61 131.78 5.06 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 115.294 1.59 . . . . 71.25 115.294 178.343 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -124.81 59.77 1.2 Allowed 'General case' 0 C--N 1.276 -2.598 0 CA-C-N 114.499 -1.228 . . . . 73.22 109.198 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.2 pp -84.55 -16.53 41.93 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.336 -1.302 . . . . 65.14 110.079 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.35 -18.14 62.39 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 114.927 -1.033 . . . . 73.22 110.124 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.9 m -80.69 84.4 6.25 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 114.511 -1.222 . . . . 52.21 108.87 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 m -117.19 78.41 1.22 Allowed 'General case' 0 N--CA 1.424 -1.769 0 CA-C-O 121.915 0.864 . . . . 74.04 109.792 -177.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -63.89 1.14 Allowed 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 113.543 -1.662 . . . . 62.4 111.334 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.41 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 10.4 mm-40 -99.78 162.02 22.49 Favored Pre-proline 1 C--N 1.237 -4.313 0 CA-C-N 113.823 -1.535 . . . . 74.52 109.372 -179.492 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 17.8 Cg_endo -62.66 -150.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.561 1.84 0 C-N-CA 124.085 3.19 . . . . 73.34 113.154 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 m -75.34 37.79 0.13 Allowed 'General case' 0 CA--C 1.572 1.795 0 C-N-CA 123.655 0.782 . . . . 64.21 112.365 -175.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.493 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 6.0 m-20 -65.54 150.25 96.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 C-N-CA 125.926 1.69 . . . . 73.45 112.687 -178.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.3 -47.48 27.19 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.717 2.944 . . . . 71.1 113.382 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.428 ' HA ' ' HB3' ' A' ' 59' ' ' HIS . 70.8 mm-40 -71.76 -25.73 62.15 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 112.971 0.73 . . . . 72.44 112.971 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.528 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 95.7 t -66.21 -42.97 92.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.196 0 N-CA-C 108.485 -0.932 . . . . 53.34 108.485 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.411 ' O ' HD23 ' A' ' 62' ' ' LEU . 49.4 mm -67.14 -46.01 85.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.051 -0.977 . . . . 64.0 109.215 175.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 56' ' ' GLU . 20.2 t-160 -54.22 -40.1 67.34 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.114 0.966 . . . . 72.44 110.981 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -54.98 -55.69 27.99 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.768 0.794 . . . . 73.13 110.712 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 60.4 mt-30 -62.26 -34.69 77.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.256 -1.338 . . . . 74.45 110.932 -176.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.508 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -77.04 -35.6 56.76 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-N 114.903 -1.044 . . . . 73.15 111.926 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.431 HD22 ' C ' ' A' ' 63' ' ' ASN . 0.2 OUTLIER -57.46 -35.88 70.72 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.227 1.011 . . . . 50.2 108.695 177.321 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.55 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 12.5 mmt180 -55.37 -42.72 74.33 Favored 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.486 -1.233 . . . . 70.35 111.534 175.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.508 HD12 HD13 ' A' ' 62' ' ' LEU . 78.6 mt -72.22 -33.7 67.77 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.026 0.441 . . . . 72.23 110.085 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.543 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 90.5 t80 -58.34 -31.17 67.33 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.839 -1.073 . . . . 71.41 109.482 174.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.59 -34.19 53.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.445 -0.798 . . . . 40.25 111.54 177.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -67.39 -56.7 8.63 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.116 0.413 . . . . 74.12 112.116 -178.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.67 143.46 5.26 Favored Glycine 0 CA--C 1.474 -2.519 0 C-N-CA 120.005 -1.093 . . . . 44.52 113.299 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.53 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.6 ptt? -70.61 -28.48 64.88 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 107.106 -1.442 . . . . 72.01 107.106 169.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.73 -35.78 65.1 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 114.41 -1.268 . . . . 74.23 107.949 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.529 HG23 ' CD1' ' A' ' 40' ' ' PHE . 98.9 m -65.8 -38.9 90.21 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.616 -1.175 . . . . 75.32 109.747 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.624 ' HD1' HG23 ' A' ' 95' ' ' VAL . 36.9 t-105 -64.37 -42.11 96.36 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 108.921 -0.77 . . . . 75.41 108.921 177.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.835 ' HA ' HG21 ' A' ' 95' ' ' VAL . 93.5 mttt -55.76 -51.78 66.21 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.583 0.353 . . . . 65.52 110.87 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.4 m -61.89 -39.75 93.06 Favored 'General case' 0 N--CA 1.408 -2.539 0 C-N-CA 123.761 0.824 . . . . 51.22 110.719 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -62.8 -52.96 61.15 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.826 -1.079 . . . . 74.24 111.618 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 73' ' ' TRP . 27.0 mm -69.13 -32.07 52.59 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 119.843 -0.743 . . . . 63.41 110.352 -175.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -57.04 -52.15 66.4 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.893 -1.049 . . . . 72.32 108.807 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 4.7 m-20 -67.42 -38.44 84.6 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 115.312 -0.858 . . . . 70.12 111.648 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.469 HD21 HD21 ' A' ' 26' ' ' LEU . 2.6 tm? -51.16 -55.62 16.94 Favored 'General case' 0 C--N 1.311 -1.096 0 C-N-CA 124.711 1.204 . . . . 75.45 110.502 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.565 ' SG ' ' HB3' ' A' ' 91' ' ' GLU . 56.1 m -68.54 -32.93 73.21 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.872 -0.603 . . . . 64.41 111.204 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -70.98 -46.27 62.61 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.557 -0.747 . . . . 75.22 112.048 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 15.1 mt-10 -83.8 -19.62 34.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 113.175 0.806 . . . . 74.43 113.175 -173.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 72.7 mt -79.93 33.32 0.27 Allowed 'General case' 0 C--O 1.243 0.728 0 N-CA-C 113.145 0.794 . . . . 75.22 113.145 -177.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 76.32 -27.12 0.18 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.906 1.682 . . . . 51.32 114.27 171.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.8 p -136.93 105.8 8.85 Favored Pre-proline 0 C--N 1.296 -1.75 0 CA-C-O 120.953 0.406 . . . . 72.52 111.503 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.8 83.7 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.014 1.809 . . . . 70.32 109.675 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.17 -6.96 54.93 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.627 1.343 . . . . 45.21 114.627 -175.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.9 t70 54.46 81.19 0.11 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.983 1.475 . . . . 74.14 114.983 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.457 ' O ' HD23 ' A' ' 94' ' ' LEU . 24.1 ptm -153.11 22.37 0.56 Allowed 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 105.546 -2.02 . . . . 62.23 105.546 172.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.565 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 9.2 pt-20 -70.54 -36.32 73.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 112.77 -2.014 . . . . 55.53 111.512 -173.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.77 ' HA ' HG12 ' A' ' 95' ' ' VAL . 47.2 mm -69.39 -49.13 23.98 Favored Pre-proline 0 C--N 1.277 -2.567 0 CA-C-N 115.977 -0.556 . . . . 73.04 110.793 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -50.72 -44.47 40.61 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.091 1.861 . . . . 65.41 111.54 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.632 HD22 HD12 ' A' ' 18' ' ' LEU . 4.2 mm? -62.76 -39.19 93.4 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.642 0.608 . . . . 55.01 112.642 175.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.835 HG21 ' HA ' ' A' ' 74' ' ' LYS . 5.7 p -75.5 -32.64 25.52 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.122 0 CA-C-O 122.131 0.967 . . . . 45.21 113.105 -177.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.535 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . 21.9 t -58.67 -20.21 46.19 Favored 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 114.075 -1.42 . . . . 63.44 111.521 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 19' ' ' TRP . 3.6 tt -67.58 -16.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 116.183 -0.462 . . . . 62.54 111.664 -175.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.543 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 61.4 t90 . . . . . 0 N--CA 1.445 -0.697 0 N-CA-C 109.311 -0.626 . . . . 73.51 109.311 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.6 ptp . . . . . 0 CA--C 1.507 -0.687 0 CA-C-O 121.638 0.732 . . . . 55.41 109.135 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.65 71.99 1.43 Allowed 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 126.208 1.803 . . . . 73.12 112.749 -171.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.24 -34.41 49.18 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 114.422 -1.263 . . . . 65.35 110.188 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.517 ' CD ' ' HB3' ' A' ' 96' ' ' SER . 0.0 OUTLIER -57.53 -31.46 66.1 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 124.079 0.951 . . . . 74.4 111.288 -178.036 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.6 m -60.29 -30.14 69.29 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 125.043 1.337 . . . . 73.35 111.089 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.1 mp -87.36 -20.43 7.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 114.512 -1.222 . . . . 72.3 109.824 -176.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.582 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.6 mmm180 -107.38 -66.69 1.01 Allowed 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 112.706 0.632 . . . . 74.52 112.706 -177.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 12' ' ' ARG . 11.4 mt 170.63 173.84 0.07 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.089 1.756 . . . . 63.41 110.562 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.7 p30 -160.19 170.29 21.47 Favored 'General case' 0 C--O 1.252 1.231 0 N-CA-C 107.208 -1.404 . . . . 75.02 107.208 172.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.465 ' H ' HD23 ' A' ' 18' ' ' LEU . 28.3 t-20 -160.45 167.86 26.37 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 118.096 0.407 . . . . 73.42 110.839 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.59 -28.07 12.99 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 126.073 1.749 . . . . 72.45 112.717 178.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -57.03 -29.33 63.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.192 -0.458 . . . . 73.04 111.588 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.465 HD23 ' H ' ' A' ' 15' ' ' ASN . 4.0 mm? -65.33 -43.15 91.87 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.185 0.517 . . . . 62.23 110.362 177.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -69.22 -46.44 67.38 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.305 -0.861 . . . . 75.2 110.706 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.79 97.97 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 44.12 111.443 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 -56.48 -49.31 75.03 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.025 -0.534 . . . . 71.43 110.537 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.4 tm? -60.8 -53.29 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 123.834 0.709 . . . . 62.4 110.211 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.14 -50.3 78.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 112.612 0.597 . . . . 75.44 112.612 -176.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.522 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 5.1 tpm_? -72.65 -33.73 66.8 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.973 -0.291 . . . . 73.14 110.54 -175.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.443 HD22 ' HE2' ' A' ' 28' ' ' LYS . 1.9 tm? -69.81 -44.88 69.12 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.548 -0.908 . . . . 64.33 108.548 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.673 HD13 HD23 ' A' ' 33' ' ' LEU . 3.6 mt -71.44 -24.48 62.03 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.604 -0.725 . . . . 55.55 112.118 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 p -67.81 -15.67 63.74 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 108.766 -0.827 . . . . 75.35 108.766 177.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 34.6 mtmt -97.39 -4.1 39.02 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 121.729 0.776 . . . . 74.24 109.39 179.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.442 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.1 m-80 -138.78 54.92 7.12 Favored Pre-proline 0 C--O 1.243 0.73 0 CA-C-N 115.128 -0.942 . . . . 65.23 110.638 -176.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 9.2 Cg_exo -72.29 -21.22 23.49 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 121.437 1.425 . . . . 54.41 108.698 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -71.68 -39.76 70.04 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 114.224 -1.353 . . . . 52.53 109.944 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.61 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 72.2 t90 -74.2 -42.7 59.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.242 -0.983 . . . . 74.01 109.823 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.673 HD23 HD13 ' A' ' 26' ' ' LEU . 2.2 tm? -62.93 -44.57 95.7 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.074 -0.966 . . . . 75.01 110.654 -174.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.57 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 15.8 p -57.89 -47.68 82.07 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.652 0.263 . . . . 73.3 111.524 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.63 67.98 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 124.315 1.046 . . . . 64.52 111.468 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.61 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 32.8 mmmt -72.09 -32.82 67.37 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 120.642 -0.423 . . . . 73.12 111.058 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.3 mt -61.88 -32.9 73.3 Favored 'General case' 0 C--O 1.191 -1.976 0 N-CA-C 109.894 -0.41 . . . . 64.32 109.894 174.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.57 ' HG3' ' O ' ' A' ' 34' ' ' SER . 39.8 mtt180 -64.67 -28.64 69.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.08 0.467 . . . . 74.33 110.885 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.6 t -84.72 -41.38 16.28 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.463 -0.79 . . . . 71.3 110.563 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.526 ' CD1' HG23 ' A' ' 72' ' ' THR . 66.7 m-85 -82.22 -46.24 13.99 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.781 0.66 . . . . 75.04 112.781 -177.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 7.0 mp -88.6 120.49 70.26 Favored Pre-proline 0 C--N 1.305 -1.345 0 C-N-CA 124.02 0.928 . . . . 75.14 110.107 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.14 -24.39 12.64 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 121.914 1.743 . . . . 64.35 111.113 177.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.4 p -114.97 28.51 8.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 123.809 0.844 . . . . 71.42 110.945 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.523 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.4 98.81 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.693 1.368 . . . . 63.33 114.693 -174.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -103.33 72.87 1.18 Allowed 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.899 1.333 . . . . 65.03 107.44 176.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.408 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 4.1 pp -96.14 -12.5 24.64 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 113.375 -1.738 . . . . 62.05 113.538 -173.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -83.4 -11.15 57.91 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.468 0.651 . . . . 74.24 111.131 -174.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.6 t -72.78 106.75 4.87 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 115.023 -0.989 . . . . 71.24 109.216 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.8 p -139.23 87.13 2.17 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.913 0.863 . . . . 70.3 112.001 -177.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.32 -25.85 60.81 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.645 -1.161 . . . . 70.22 112.116 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -129.63 161.86 56.64 Favored Pre-proline 0 N--CA 1.381 -3.889 0 CA-C-N 113.629 -1.623 . . . . 61.52 107.446 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.44 ' HB2' ' H ' ' A' ' 53' ' ' SER . 36.3 Cg_endo -68.37 -148.85 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.928 2.419 . . . . 70.23 111.617 173.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.44 ' H ' ' HB2' ' A' ' 52' ' ' PRO . 6.1 m -75.27 37.86 0.13 Allowed 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 124.419 1.088 . . . . 60.21 112.705 -175.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.555 ' HB2' HG23 ' A' ' 57' ' ' VAL . 7.3 m-20 -58.05 147.04 66.72 Favored Pre-proline 0 N--CA 1.436 -1.166 0 C-N-CA 125.025 1.33 . . . . 73.02 111.27 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -53.35 -34.9 72.82 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 123.892 3.062 . . . . 52.33 112.377 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -73.23 -39.95 65.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.79 -0.641 . . . . 75.32 109.341 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.555 HG23 ' HB2' ' A' ' 54' ' ' ASN . 96.3 t -67.46 -44.69 86.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.618 -1.174 . . . . 75.11 109.248 -178.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.412 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.3 mm -63.44 -43.45 98.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.457 -0.792 . . . . 70.22 109.669 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 12.8 t-160 -58.13 -37.28 74.32 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 116.229 -0.442 . . . . 75.31 111.128 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.94 -44.84 96.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.315 0.578 . . . . 74.33 111.109 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.423 HE21 HG12 ' A' ' 57' ' ' VAL . 70.3 mt-30 -64.52 -47.08 80.2 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.144 -0.935 . . . . 52.45 110.115 -178.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 58' ' ' ILE . 4.3 mm? -68.83 -30.77 69.39 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.326 -1.306 . . . . 54.11 111.656 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 4.7 t30 -61.26 -37.39 82.96 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 123.853 0.861 . . . . 74.21 109.62 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -59.37 -31.36 69.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.868 -1.06 . . . . 44.22 112.041 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.18 -43.73 64.11 Favored 'General case' 0 CA--C 1.501 -0.916 0 N-CA-C 109.635 -0.506 . . . . 63.22 109.635 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -61.04 -39.54 90.2 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.409 -0.96 . . . . 62.41 108.409 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.42 66.12 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.918 -1.037 . . . . 74.42 111.957 177.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.478 ' HB2' HG21 ' A' ' 72' ' ' THR . 9.1 mm-40 -81.45 -50.24 9.67 Favored 'General case' 0 N--CA 1.415 -2.175 0 N-CA-C 108.605 -0.887 . . . . 70.12 108.605 173.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.421 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -179.02 143.23 5.69 Favored Glycine 0 CA--C 1.477 -2.29 0 CA-C-N 115.508 -0.769 . . . . 72.33 112.563 -175.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -26.77 64.01 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 106.772 -1.566 . . . . 74.41 106.772 170.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.39 -36.96 68.8 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.121 -1.4 . . . . 72.34 108.201 174.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.526 HG23 ' CD1' ' A' ' 40' ' ' PHE . 53.0 m -62.39 -33.94 75.74 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.916 -1.038 . . . . 60.33 110.733 177.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -66.48 -38.58 87.62 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.323 -0.621 . . . . 74.4 109.323 178.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.967 ' HA ' HG21 ' A' ' 95' ' ' VAL . 8.8 mtmt -68.31 -32.23 72.21 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 113.205 0.817 . . . . 65.34 113.205 176.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.3 m -68.33 -38.15 81.26 Favored 'General case' 0 N--CA 1.402 -2.837 0 CA-C-O 121.953 0.882 . . . . 74.21 109.063 171.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -65.52 -53.84 36.66 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 114.365 -1.289 . . . . 53.24 112.966 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -64.04 -32.14 56.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.993 0 CA-C-N 118.611 0.642 . . . . 74.23 111.245 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.15 -42.39 99.21 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.4 -0.818 . . . . 70.25 109.331 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.478 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 83.1 m-20 -74.94 -41.19 60.12 Favored 'General case' 0 C--O 1.193 -1.878 0 CA-C-N 115.959 -0.564 . . . . 72.41 111.175 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.448 HD21 HD21 ' A' ' 26' ' ' LEU . 2.4 tm? -50.12 -53.98 23.71 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 125.454 1.502 . . . . 64.14 110.505 -179.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.407 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 50.8 t -66.76 -34.43 77.82 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.207 -0.906 . . . . 52.22 110.702 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -75.75 -50.19 15.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.333 -0.849 . . . . 74.03 112.381 -175.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 36.1 mt-10 -75.32 -28.36 59.62 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 112.196 0.443 . . . . 71.01 112.196 -173.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.8 mt -85.16 -13.64 49.48 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.261 -0.644 . . . . 70.23 109.261 176.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.7 t70 54.01 57.84 5.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.261 1.424 . . . . 74.11 110.743 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 6.0 m -134.52 108.09 11.05 Favored Pre-proline 0 C--N 1.301 -1.529 0 CA-C-N 114.012 -1.449 . . . . 61.43 109.392 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -63.43 111.0 1.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.279 1.986 . . . . 70.21 109.66 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.407 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 41.2 mt -82.91 -39.8 21.02 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.852 -0.739 . . . . 74.14 109.272 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 62.19 12.25 4.98 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.228 1.011 . . . . 63.21 110.688 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.41 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 18.8 ttt -157.25 34.26 0.28 Allowed 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 106.949 -1.5 . . . . 74.34 106.949 -176.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.97 -34.5 71.48 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-N 114.458 -1.246 . . . . 74.01 109.632 -179.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.54 ' HA ' HG12 ' A' ' 95' ' ' VAL . 49.0 mm -63.35 -50.5 73.93 Favored Pre-proline 0 C--N 1.288 -2.074 0 CA-C-N 115.319 -0.855 . . . . 54.14 111.989 -177.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.501 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 50.4 Cg_exo -58.7 -24.38 70.7 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 121.782 1.654 . . . . 65.34 111.756 172.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.401 ' O ' HG22 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -74.4 -31.95 62.52 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.898 -1.149 . . . . 71.11 107.898 177.409 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.967 HG21 ' HA ' ' A' ' 74' ' ' LYS . 9.0 p -88.2 -46.72 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.949 0 N-CA-C 113.949 1.092 . . . . 62.04 113.949 -178.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.517 ' HB3' ' CD ' ' A' ' 9' ' ' GLU . 4.0 t -78.73 3.44 16.56 Favored 'General case' 0 C--N 1.27 -2.871 0 CA-C-N 115.627 -0.715 . . . . 65.42 110.846 -175.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.434 HG23 ' CD1' ' A' ' 98' ' ' TRP . 17.2 tt -56.81 -40.01 68.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.347 0.659 . . . . 70.54 109.952 176.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.434 ' CD1' HG23 ' A' ' 97' ' ' ILE . 46.6 m95 . . . . . 0 N--CA 1.448 -0.553 0 N-CA-C 108.924 -0.769 . . . . 75.32 108.924 178.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 53.1 tpp . . . . . 0 N--CA 1.446 -0.642 0 CA-C-O 121.785 0.803 . . . . 75.13 110.639 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.08 24.99 12.34 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.729 -0.669 . . . . 62.11 109.674 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.522 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.64 -9.54 59.42 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 114.966 -1.015 . . . . 44.04 109.768 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.469 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -60.22 -44.34 95.25 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.4 1.08 . . . . 72.31 112.173 -179.512 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.468 ' HB2' HD12 ' A' ' 11' ' ' ILE . 75.2 m -54.48 -31.73 56.4 Favored 'General case' 0 C--N 1.288 -2.108 0 C-N-CA 125.354 1.462 . . . . 71.13 111.302 174.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.522 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -85.13 -38.2 12.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 C-N-CA 125.026 1.331 . . . . 75.04 110.367 -174.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.74 -38.41 28.76 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.996 0.739 . . . . 73.22 112.996 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.5 mt 61.51 -175.27 0.13 Allowed 'General case' 0 C--O 1.242 0.679 0 C-N-CA 124.38 1.072 . . . . 64.04 113.221 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.507 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 9.7 p30 -125.02 -177.79 3.97 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.84 -0.537 . . . . 55.53 111.562 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.531 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.7 t30 -154.39 153.11 31.05 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.382 -0.97 . . . . 74.14 108.382 -174.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -69.79 -34.53 73.87 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.146 0.43 . . . . 72.21 112.002 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -62.05 -35.95 80.14 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 122.122 0.963 . . . . 75.43 109.041 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 7.3 tt -65.84 -39.06 90.45 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.34 -1.755 . . . . 74.43 110.062 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.44 ' HB2' HD11 ' A' ' 97' ' ' ILE . 20.8 t-105 -71.42 -46.71 59.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.78 0.324 . . . . 63.53 110.245 174.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.01 -40.86 74.03 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-N 115.857 -0.611 . . . . 73.22 110.884 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -53.04 -50.44 64.3 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 124.134 0.896 . . . . 73.05 110.847 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mt -66.49 -45.15 80.61 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 112.741 0.645 . . . . 63.42 112.741 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -51.71 -53.73 15.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 123.738 0.649 . . . . 63.34 111.467 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.452 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 98.2 mtt180 -73.13 -33.7 65.67 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 112.13 0.418 . . . . 62.02 112.13 -176.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.408 HD12 HD13 ' A' ' 84' ' ' LEU . 0.9 OUTLIER -73.67 -46.5 46.13 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 73.32 109.598 -177.229 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.557 HD13 HD23 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -66.24 -25.36 66.86 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 123.679 0.792 . . . . 70.1 110.553 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' ' 53' ' ' SER . 57.7 m -72.58 -10.17 59.47 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.256 0.55 . . . . 52.33 110.838 176.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 70.9 mttt -98.44 -11.43 22.36 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 108.31 -0.996 . . . . 73.25 108.31 177.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.46 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 47.5 m-80 -132.44 51.35 7.03 Favored Pre-proline 0 N--CA 1.436 -1.169 0 CA-C-N 114.499 -1.228 . . . . 52.4 110.822 -175.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.46 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 2.8 Cg_exo -72.75 -19.37 24.09 Favored 'Trans proline' 0 C--N 1.361 1.191 0 N-CA-C 108.65 -1.327 . . . . 52.02 108.65 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -74.89 -37.23 62.18 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 114.189 -1.369 . . . . 72.11 109.641 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -73.21 -42.97 62.03 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.467 -0.893 . . . . 73.2 109.002 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.661 HD13 HD13 ' A' ' 37' ' ' LEU . 2.6 tm? -59.32 -47.16 86.45 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.616 -1.175 . . . . 74.24 110.226 -176.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.1 p -62.27 -38.44 89.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.686 0.279 . . . . 61.42 111.478 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.49 96.75 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.045 0.538 . . . . 72.44 111.272 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HE3' ' HB3' ' A' ' 79' ' ' ASP . 42.9 mmtt -74.52 -52.41 11.99 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 112.6 0.592 . . . . 73.32 112.6 177.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.661 HD13 HD13 ' A' ' 33' ' ' LEU . 10.7 mp -53.41 -31.22 44.1 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 113.999 1.111 . . . . 73.11 113.999 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.645 ' HB2' ' SD ' ' A' ' 44' ' ' MET . 31.5 ptt180 -66.69 -30.84 71.18 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.394 0.887 . . . . 74.05 113.394 179.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 t -72.88 -31.99 65.07 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.495 0.664 . . . . 70.41 109.704 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.524 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.2 m-85 -83.11 -58.61 2.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.706 -0.679 . . . . 73.22 111.497 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mp -72.52 121.69 85.52 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 123.977 0.911 . . . . 75.32 110.439 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.56 -33.73 21.57 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 122.562 2.174 . . . . 75.42 112.617 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 p -94.07 -5.48 47.29 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.206 -0.452 . . . . 65.25 110.609 -178.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.645 ' SD ' ' HB2' ' A' ' 38' ' ' ARG . 8.9 mtt 36.48 91.51 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 127.643 2.377 . . . . 75.42 112.309 -175.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -101.92 72.87 1.37 Allowed 'General case' 0 C--N 1.287 -2.116 0 CA-C-O 122.485 1.136 . . . . 74.31 108.852 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.501 HD11 ' HB3' ' A' ' 38' ' ' ARG . 10.7 mt -92.55 -40.32 10.86 Favored 'General case' 0 CA--C 1.487 -1.464 0 CA-C-N 112.945 -1.934 . . . . 73.42 107.633 -175.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.14 3.35 10.77 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 112.948 -1.933 . . . . 75.1 110.994 -176.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.04 -15.29 63.63 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 125.039 1.336 . . . . 64.33 111.429 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.8 m -75.85 69.28 2.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.657 0.741 . . . . 52.34 111.895 -179.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.47 -9.05 57.03 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.128 0.965 . . . . 73.51 111.609 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.655 ' OE2' HG22 ' A' ' 57' ' ' VAL . 2.6 pt-20 -111.09 160.23 29.76 Favored Pre-proline 0 C--N 1.28 -2.42 0 CA-C-N 114.323 -1.308 . . . . 72.42 109.075 175.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -62.37 -170.74 0.09 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.874 2.382 . . . . 74.31 113.696 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.439 ' HB3' ' OG ' ' A' ' 27' ' ' SER . 13.2 m -76.46 36.91 0.16 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 115.169 -0.923 . . . . 74.23 112.005 -175.06 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.544 ' HB2' HG23 ' A' ' 57' ' ' VAL . 5.1 m-20 -68.39 147.55 98.18 Favored Pre-proline 0 N--CA 1.434 -1.275 0 O-C-N 122.253 -0.28 . . . . 75.54 110.955 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -56.51 -40.1 86.84 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.206 2.604 . . . . 64.01 113.275 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -74.92 -24.08 58.45 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.114 0.483 . . . . 65.55 110.731 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.655 HG22 ' OE2' ' A' ' 51' ' ' GLU . 89.8 t -69.96 -47.68 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 107.871 -1.159 . . . . 63.41 107.871 175.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -61.03 -45.36 98.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 114.23 -1.35 . . . . 71.13 109.725 177.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -55.2 -39.73 69.95 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.823 0.849 . . . . 72.22 111.633 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.35 -41.52 97.19 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.728 0.811 . . . . 64.14 111.365 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.417 HE21 HG12 ' A' ' 57' ' ' VAL . 63.4 mt-30 -71.81 -43.87 64.89 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.145 -0.934 . . . . 63.51 110.374 -176.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.421 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -72.41 -29.91 64.15 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.827 -1.079 . . . . 72.0 111.47 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -53.27 -42.17 66.26 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 75.45 110.335 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.2 mmt85 -55.04 -32.87 62.21 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.653 -1.158 . . . . 75.4 112.707 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.3 mt -72.35 -39.24 68.24 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 120.604 0.24 . . . . 65.2 110.81 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -64.38 -37.67 88.34 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.636 -0.876 . . . . 73.42 108.636 174.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.01 -28.25 69.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.668 -1.151 . . . . 65.14 111.439 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.402 ' HB2' HG21 ' A' ' 72' ' ' THR . 9.7 mm-40 -74.56 -57.49 3.9 Favored 'General case' 0 N--CA 1.409 -2.491 0 N-CA-C 107.772 -1.196 . . . . 72.32 107.772 174.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . 0.437 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -170.5 142.42 7.14 Favored Glycine 0 CA--C 1.466 -3.005 0 CA-C-N 114.917 -1.038 . . . . 24.52 112.369 -175.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.61 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.6 tpp -67.14 -33.11 74.73 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.378 -1.712 . . . . 41.34 106.378 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.95 -37.31 84.05 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 114.594 -1.184 . . . . 51.24 108.483 176.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.524 HG23 ' CD1' ' A' ' 40' ' ' PHE . 99.2 m -61.9 -42.63 99.3 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.677 -1.147 . . . . 70.54 110.442 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.654 ' HD1' HG23 ' A' ' 95' ' ' VAL . 70.0 t-105 -67.32 -41.23 85.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 110.345 -0.243 . . . . 74.2 110.345 179.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.714 ' HA ' HG21 ' A' ' 95' ' ' VAL . 73.5 mttt -56.99 -39.52 74.81 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.391 0.615 . . . . 74.22 111.278 175.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.7 m -70.95 -44.15 66.67 Favored 'General case' 0 N--CA 1.4 -2.936 0 CA-C-N 115.663 -0.698 . . . . 42.43 110.015 177.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.31 -46.12 89.45 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 123.868 0.867 . . . . 45.02 112.475 -178.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.566 HG22 ' HB2' ' A' ' 91' ' ' GLU . 43.7 mm -66.34 -31.17 52.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.155 0 C-N-CA 119.223 -0.991 . . . . 72.03 111.611 -176.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -64.76 -40.78 95.85 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.514 -0.55 . . . . 75.01 109.514 174.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.5 ' HB3' ' HE3' ' A' ' 36' ' ' LYS . 6.4 m-20 -65.19 -42.16 93.85 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 116.459 -0.337 . . . . 73.15 110.322 175.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.465 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -51.97 -55.02 23.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.839 1.256 . . . . 71.24 109.585 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 26.0 p -67.89 -40.46 83.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.279 0.474 . . . . 61.21 112.279 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -63.56 -54.33 37.78 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 123.389 0.676 . . . . 71.44 110.504 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -72.84 -37.12 67.55 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 113.915 1.08 . . . . 74.32 113.915 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.408 HD13 HD12 ' A' ' 25' ' ' LEU . 89.3 mt -85.2 -31.92 22.94 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.976 -0.69 . . . . 72.32 111.985 -177.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -146.36 -100.55 0.09 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.268 -0.973 . . . . 71.22 111.924 -178.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.414 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 76.3 t -141.16 151.44 61.84 Favored Pre-proline 0 C--N 1.307 -1.279 0 N-CA-C 106.853 -1.536 . . . . 74.33 106.853 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -51.31 108.05 0.21 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 121.846 1.697 . . . . 62.3 108.93 168.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 86' ' ' VAL . 86.7 mt -90.95 -22.89 20.63 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 113.973 1.101 . . . . 73.44 113.973 -168.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.98 17.2 9.58 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 123.665 1.698 . . . . 72.23 108.82 -172.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.455 ' O ' HD23 ' A' ' 94' ' ' LEU . 63.8 mtt -120.13 12.92 11.98 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 113.434 -1.712 . . . . 74.23 107.479 175.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.566 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -71.41 -36.14 71.25 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.313 -0.858 . . . . 74.32 111.002 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.742 ' HA ' HG12 ' A' ' 95' ' ' VAL . 35.7 mm -61.18 -46.46 95.81 Favored Pre-proline 0 C--N 1.287 -2.137 0 CA-C-N 115.648 -0.706 . . . . 71.51 112.275 -178.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.446 ' HD2' ' C ' ' A' ' 90' ' ' MET . 76.3 Cg_exo -51.49 -38.57 64.37 Favored 'Trans proline' 0 C--N 1.359 1.113 0 C-N-CA 122.232 1.955 . . . . 63.35 112.134 170.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.508 ' HA ' HD21 ' A' ' 18' ' ' LEU . 4.5 mm? -72.04 -33.28 67.88 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.809 -0.632 . . . . 65.45 111.564 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.742 HG12 ' HA ' ' A' ' 92' ' ' ILE . 3.3 p -78.25 -29.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 122.395 1.093 . . . . 75.12 112.147 177.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.6 t -73.24 4.28 4.73 Favored 'General case' 0 C--N 1.259 -3.336 0 CA-C-N 113.899 -1.5 . . . . 74.33 111.665 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.507 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 14.5 tt -64.33 -28.85 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 75.15 111.197 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 11.5 m95 . . . . . 0 N--CA 1.422 -1.856 0 N-CA-C 105.054 -2.202 . . . . 74.52 105.054 171.878 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.7 mpt? . . . . . 0 N--CA 1.439 -1.013 0 N-CA-C 114.073 1.138 . . . . 70.54 114.073 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -110.14 23.79 13.85 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.297 -0.961 . . . . 75.43 111.131 177.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.99 -14.56 59.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.8 0.81 . . . . 64.33 109.776 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.441 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.5 OUTLIER -65.13 -33.01 74.99 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.033 -0.985 . . . . 65.42 113.175 -178.588 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.9 t -61.78 -37.31 83.88 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.949 0.881 . . . . 73.14 109.897 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.461 ' H ' HD12 ' A' ' 11' ' ' ILE . 2.9 mp -87.5 -43.77 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 114.625 -1.171 . . . . 70.01 112.415 -177.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 12' ' ' ARG . 11.5 mmt180 -81.94 -30.78 31.59 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.028 0.751 . . . . 72.51 113.028 -175.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 64.82 133.39 0.02 OUTLIER 'General case' 0 C--O 1.247 0.952 0 C-N-CA 125.976 1.711 . . . . 75.4 115.374 -178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -72.89 156.3 39.02 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 115.495 -0.775 . . . . 73.2 108.938 175.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.433 ' H ' HD12 ' A' ' 18' ' ' LEU . 44.8 t-20 -157.76 143.39 17.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.092 -1.077 . . . . 74.44 108.092 -174.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -52.84 -28.51 23.19 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.304 1.041 . . . . 52.42 111.442 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -56.63 -39.6 73.92 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.124 0.969 . . . . 62.54 110.158 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.433 HD12 ' H ' ' A' ' 15' ' ' ASN . 34.1 mt -70.67 -36.71 73.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.779 -1.101 . . . . 65.35 110.551 -175.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -69.44 -42.22 75.23 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.408 -0.59 . . . . 75.15 109.408 177.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.04 -48.19 82.93 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.503 -0.317 . . . . 71.05 110.222 177.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.454 ' HE1' HD22 ' A' ' 88' ' ' LEU . 2.3 t-105 -54.5 -50.28 68.18 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.782 -0.645 . . . . 74.14 110.77 175.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -59.79 -53.05 62.5 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 123.74 0.65 . . . . 62.35 109.286 -177.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.4 t -56.48 -50.57 72.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 116.233 -0.439 . . . . 75.02 112.131 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.574 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 97.3 mtt180 -69.63 -41.56 75.48 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.285 0.476 . . . . 73.42 112.285 -174.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.57 -42.91 86.34 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.262 -0.644 . . . . 75.14 109.262 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.561 HD21 HD21 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -70.34 -25.1 63.13 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.961 -0.563 . . . . 62.21 110.437 -179.255 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.9 m -71.56 -18.9 62.22 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.287 -0.634 . . . . 61.13 109.287 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 40.3 mtmt -91.84 1.37 57.22 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.814 0.816 . . . . 44.11 109.188 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -141.03 55.64 5.65 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 114.81 -1.086 . . . . 73.24 110.267 -178.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -67.98 -26.01 37.86 Favored 'Trans proline' 0 C--N 1.363 1.34 0 C-N-CA 121.389 1.393 . . . . 63.45 108.986 -176.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -66.85 -42.07 86.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-N 113.55 -1.659 . . . . 72.32 110.131 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.597 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 80.1 t90 -74.57 -45.47 45.13 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 119.809 -0.757 . . . . 74.12 109.664 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.613 ' O ' HD13 ' A' ' 37' ' ' LEU . 2.9 tm? -57.4 -52.52 65.02 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.392 -1.276 . . . . 65.41 110.537 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.487 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 12.9 p -54.28 -42.59 70.21 Favored 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 112.371 0.508 . . . . 65.21 112.371 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.65 86.91 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 124.254 1.021 . . . . 73.22 112.447 177.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.597 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.2 mmmt -72.13 -31.26 65.83 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.891 0.377 . . . . 72.12 110.394 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.613 HD13 ' O ' ' A' ' 33' ' ' LEU . 5.2 mp -61.49 -31.08 71.05 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 122.679 0.392 . . . . 70.1 111.701 173.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 34' ' ' SER . 28.6 mtm180 -66.23 -35.4 80.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.986 0.898 . . . . 64.2 109.537 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.44 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 50.2 m -75.47 -36.07 60.74 Favored 'General case' 0 N--CA 1.399 -3.0 0 C-N-CA 125.734 1.614 . . . . 73.35 112.648 -178.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.592 ' CD1' HG23 ' A' ' 72' ' ' THR . 66.1 m-85 -94.51 -47.43 6.55 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 113.192 0.812 . . . . 73.43 113.192 -178.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.616 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.0 OUTLIER -101.0 115.92 64.66 Favored Pre-proline 0 N--CA 1.436 -1.157 0 O-C-N 122.315 -0.241 . . . . 53.23 110.699 -176.146 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.14 -25.61 9.97 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.823 1.682 . . . . 71.21 111.248 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.5 m -99.12 23.89 8.53 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.511 1.148 . . . . 73.33 110.875 -174.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.498 ' HB2' ' HB2' ' A' ' 41' ' ' LEU . 4.0 tpt -74.95 104.19 5.45 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 113.846 1.054 . . . . 62.21 113.846 -176.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -94.01 77.02 4.12 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 106.369 -1.715 . . . . 63.31 106.369 170.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.484 HD23 ' HG2' ' A' ' 44' ' ' MET . 3.9 pp -89.22 -17.49 28.96 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.165 -1.38 . . . . 53.41 112.305 -174.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -72.39 -18.43 61.73 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.532 0.682 . . . . 74.53 111.73 -175.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.7 m -100.74 95.03 6.38 Favored 'General case' 0 C--N 1.276 -2.595 0 CA-C-N 115.649 -0.705 . . . . 75.1 110.625 -176.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.8 m -91.76 95.39 9.84 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.547 0.689 . . . . 75.31 109.669 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.21 -48.44 81.48 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.864 -1.062 . . . . 70.14 110.939 176.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.423 ' HB2' HG21 ' A' ' 57' ' ' VAL . 45.4 mt-10 -116.97 164.62 18.02 Favored Pre-proline 0 C--N 1.245 -3.936 0 CA-C-N 113.281 -1.781 . . . . 72.22 106.877 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.8 -150.87 0.04 OUTLIER 'Trans proline' 0 CA--C 1.553 1.453 0 C-N-CA 122.221 1.948 . . . . 75.23 110.812 174.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -75.47 38.08 0.14 Allowed 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 124.189 0.996 . . . . 72.44 112.334 -176.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.17 146.81 91.91 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 123.637 0.775 . . . . 72.32 111.019 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.21 -27.92 78.89 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.724 2.283 . . . . 64.5 111.933 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -68.74 -40.28 79.94 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.533 -0.914 . . . . 75.24 108.533 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.493 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 58.4 t -66.47 -50.36 67.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.717 -1.129 . . . . 73.3 109.042 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.44 ' O ' HD23 ' A' ' 62' ' ' LEU . 47.3 mm -55.15 -39.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-N 114.792 -1.094 . . . . 70.02 109.776 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.497 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 57.0 t-80 -61.89 -28.98 69.9 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.604 -0.725 . . . . 63.32 111.461 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.414 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 25.3 mmt180 -74.22 -40.75 62.24 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 122.317 1.056 . . . . 74.43 108.251 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.565 ' HB3' HD21 ' A' ' 37' ' ' LEU . 41.1 mt-30 -70.25 -43.88 69.61 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 113.555 -1.657 . . . . 65.42 110.534 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.494 HD13 HD12 ' A' ' 65' ' ' LEU . 3.9 mm? -73.42 -30.5 63.27 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.875 -1.057 . . . . 73.15 111.232 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 0.2 OUTLIER -56.42 -43.37 79.34 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.467 1.107 . . . . 54.15 108.858 175.449 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.616 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 34.0 mmt180 -58.48 -37.01 74.63 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.758 -1.11 . . . . 74.33 112.343 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.494 HD12 HD13 ' A' ' 62' ' ' LEU . 88.5 mt -71.82 -44.68 63.48 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 116.552 -0.295 . . . . 62.51 111.571 -177.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -67.38 -27.77 67.38 Favored 'General case' 0 C--O 1.245 0.851 0 N-CA-C 108.851 -0.796 . . . . 72.31 108.851 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.24 81.0 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.245 -0.889 . . . . 73.25 110.709 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.604 HE21 HD12 ' A' ' 41' ' ' LEU . 48.9 mm-40 -60.4 -47.94 83.89 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.054 -0.721 . . . . 73.12 109.054 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.81 141.02 5.43 Favored Glycine 0 N--CA 1.403 -3.539 0 CA-C-N 114.772 -1.104 . . . . 72.23 111.143 -178.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.624 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 21.7 ptp -69.67 -26.61 64.47 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.025 -1.843 . . . . 72.14 106.025 169.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.5 67.01 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.37 -1.286 . . . . 74.12 108.262 173.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.592 HG23 ' CD1' ' A' ' 40' ' ' PHE . 81.2 m -55.39 -40.82 71.85 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 123.399 0.68 . . . . 64.01 110.129 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.5 t-105 -61.26 -49.29 77.68 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 115.765 -0.652 . . . . 72.22 110.247 176.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.624 ' HG3' ' O ' ' A' ' 70' ' ' MET . 91.5 mttt -55.82 -42.48 75.75 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.959 0.409 . . . . 64.53 110.754 176.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 42.3 m -65.88 -44.93 83.88 Favored 'General case' 0 N--CA 1.406 -2.636 0 C-N-CA 123.334 0.654 . . . . 75.11 110.773 179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -58.33 -49.52 76.9 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.718 -0.673 . . . . 73.23 111.006 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.493 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 49.5 mm -64.47 -38.31 82.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 O-C-N 123.349 0.406 . . . . 74.44 110.738 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -69.67 -32.93 71.85 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.198 0.523 . . . . 74.34 110.781 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 67.9 m-20 -74.01 -39.61 63.48 Favored 'General case' 0 C--O 1.193 -1.875 0 C-N-CA 119.867 -0.733 . . . . 70.25 110.163 171.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.561 HD21 HD21 ' A' ' 26' ' ' LEU . 2.8 tm? -50.76 -53.96 27.38 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.924 1.29 . . . . 61.3 111.073 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 25.3 p -63.29 -33.7 76.08 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.623 -0.717 . . . . 75.43 111.662 -178.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -73.47 -54.35 8.46 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 123.554 0.742 . . . . 71.13 111.129 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 42.3 mt-10 -68.61 -36.73 79.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.396 -0.82 . . . . 62.35 112.814 -172.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.6 -10.24 44.06 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.936 -0.706 . . . . 43.32 110.032 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.5 t70 55.95 69.48 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.194 0.998 . . . . 63.01 110.219 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -132.88 129.08 21.01 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 115.082 -0.963 . . . . 61.35 110.666 -177.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -75.89 109.55 2.91 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.115 1.877 . . . . 63.11 110.076 176.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.454 HD22 ' HE1' ' A' ' 21' ' ' TRP . 65.9 mt -86.05 -31.1 22.14 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 120.175 -0.61 . . . . 55.3 109.634 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.7 t70 71.31 -49.68 0.68 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.854 1.261 . . . . 63.33 111.559 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.511 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . 20.6 ptp -116.43 68.56 0.73 Allowed 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.098 0.951 . . . . 61.02 108.55 175.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 36.2 tt0 -70.36 -46.04 64.9 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.354 -1.293 . . . . 63.44 112.13 -172.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.588 ' O ' HG22 ' A' ' 95' ' ' VAL . 44.4 mm -64.43 -42.8 68.88 Favored Pre-proline 0 C--O 1.175 -2.852 0 C-N-CA 123.358 0.663 . . . . 72.2 111.034 -178.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.511 ' HG2' ' HB2' ' A' ' 90' ' ' MET . 3.1 Cg_exo -48.37 -33.33 22.35 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.937 1.758 . . . . 61.22 112.89 167.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 4.5 mm? -68.32 -44.06 76.23 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 108.952 -0.759 . . . . 64.55 108.952 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 92' ' ' ILE . 2.8 m -63.77 -34.47 68.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.278 0 CA-C-O 123.051 1.405 . . . . 72.24 110.712 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.3 m -89.21 7.23 36.45 Favored 'General case' 0 C--N 1.274 -2.713 0 C-N-CA 127.667 2.387 . . . . 53.25 113.453 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.5 tp -60.91 -24.95 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.078 0.551 . . . . 62.31 111.598 -176.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 23.9 m0 . . . . . 0 N--CA 1.432 -1.339 0 C-N-CA 124.961 1.304 . . . . 75.13 112.278 -174.33 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 28.5 ttt . . . . . 0 N--CA 1.432 -1.362 0 CA-C-O 122.913 1.34 . . . . 72.23 109.531 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.524 ' O ' HD13 ' A' ' 11' ' ' ILE . 28.7 t70 -161.85 25.12 0.12 Allowed 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 112.119 -2.31 . . . . 72.23 108.175 -177.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.94 -31.94 64.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.9 1.333 . . . . 60.23 107.468 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.8 pm0 -55.93 -38.88 70.89 Favored 'General case' 0 N--CA 1.422 -1.858 0 CA-C-N 112.768 -2.014 . . . . 71.44 112.216 175.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -66.92 -26.74 67.0 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.779 0.799 . . . . 63.03 111.19 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.524 HD13 ' O ' ' A' ' 7' ' ' ASP . 1.0 OUTLIER -83.51 -24.91 7.85 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.836 0 CA-C-N 115.143 -0.935 . . . . 75.02 110.453 -175.296 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.488 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 38.2 mmt180 -84.68 -65.03 1.06 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.373 -0.376 . . . . 73.22 110.19 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . 0.423 ' HA ' ' O ' ' A' ' 96' ' ' SER . 41.5 mt 50.83 166.08 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 117.196 2.295 . . . . 63.23 117.196 -179.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.6 t30 51.46 87.61 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.907 1.683 . . . . 51.14 113.231 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.538 ' HB3' HD23 ' A' ' 18' ' ' LEU . 46.7 m-80 -125.32 89.86 3.12 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.893 -0.594 . . . . 44.13 110.942 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.82 -39.24 69.94 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.251 -0.431 . . . . 64.33 111.63 -177.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.02 -34.07 76.78 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.274 0.559 . . . . 73.14 110.127 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.627 HD12 HD22 ' A' ' 94' ' ' LEU . 4.6 mm? -67.12 -37.99 84.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.167 -0.924 . . . . 72.34 110.914 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.4 t-105 -66.24 -46.76 76.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.348 -0.387 . . . . 74.31 110.307 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.77 -32.54 74.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.005 -0.543 . . . . 64.24 111.133 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -67.74 -50.17 58.66 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.347 -0.612 . . . . 62.23 109.347 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.1 -52.77 63.1 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.727 0.811 . . . . 63.45 110.077 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.3 t -57.51 -48.62 82.6 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 C-N-CA 122.898 0.479 . . . . 75.44 111.575 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -72.3 -31.68 65.92 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.271 -0.422 . . . . 71.34 111.483 -175.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -72.98 -43.97 61.62 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 107.964 -1.124 . . . . 51.52 107.964 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.471 HD13 HD23 ' A' ' 33' ' ' LEU . 4.8 mt -73.43 -24.23 60.22 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 113.304 0.853 . . . . 74.11 113.304 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . 0.54 ' HA ' ' HB3' ' A' ' 53' ' ' SER . 53.2 p -59.15 -22.04 60.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.515 0.674 . . . . 72.41 109.792 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.6 mtmt -92.43 -15.2 27.48 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.483 -0.781 . . . . 72.24 109.522 -178.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -133.96 51.5 6.6 Favored Pre-proline 0 C--O 1.242 0.701 0 CA-C-N 114.902 -1.044 . . . . 61.23 111.849 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.38 -22.31 29.42 Favored 'Trans proline' 0 C--N 1.366 1.49 0 N-CA-C 108.939 -1.216 . . . . 75.22 108.939 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -66.71 -39.62 88.1 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-N 113.352 -1.749 . . . . 64.34 110.09 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.527 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 70.6 t90 -74.34 -45.49 46.9 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 119.605 -0.838 . . . . 52.23 109.378 178.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.596 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 3.1 tm? -59.05 -49.52 77.57 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.61 -1.177 . . . . 61.11 110.947 -174.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.52 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 21.1 p -58.94 -45.27 90.85 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.029 0.381 . . . . 63.2 112.029 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.95 70.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.109 0.964 . . . . 62.0 111.416 176.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.521 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 26.3 mmmt -72.56 -35.8 68.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.99 -0.284 . . . . 70.41 110.668 178.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.4 mt -59.41 -31.13 68.98 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.969 -0.56 . . . . 73.4 110.855 177.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 34' ' ' SER . 59.7 mtp180 -61.5 -34.82 76.14 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.04 -0.527 . . . . 72.33 112.234 -176.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -87.58 -38.97 15.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.273 -0.421 . . . . 64.13 110.476 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.446 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 76.4 m-85 -73.85 -47.89 35.1 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.066 0.765 . . . . 73.31 113.066 -178.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.533 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.5 mm? -102.43 112.54 65.65 Favored Pre-proline 0 N--CA 1.432 -1.34 0 CA-C-O 120.758 0.313 . . . . 73.25 110.957 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -81.15 3.06 8.11 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.511 2.141 . . . . 74.03 111.373 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 27.6 p -111.53 -2.0 15.64 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.061 -0.972 . . . . 75.43 111.193 -177.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.505 ' HB2' ' HB2' ' A' ' 41' ' ' LEU . 36.9 tpp -65.22 110.07 2.44 Favored 'General case' 0 N--CA 1.413 -2.315 0 N-CA-C 115.489 1.663 . . . . 74.32 115.489 -174.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -108.79 82.92 1.68 Allowed 'General case' 0 N--CA 1.428 -1.532 0 N-CA-C 105.243 -2.132 . . . . 73.41 105.243 165.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.492 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 4.6 pp -81.75 5.01 19.88 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-N 114.58 -1.191 . . . . 73.2 111.486 -173.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -80.34 -9.35 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.999 -1.0 . . . . 63.45 111.452 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.3 p -89.35 77.59 7.36 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.966 0.889 . . . . 71.22 111.931 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.5 m -95.02 83.07 3.87 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.315 -0.857 . . . . 72.53 109.217 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -22.96 57.84 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.74 1.257 . . . . 72.43 111.846 178.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -137.03 161.6 60.48 Favored Pre-proline 1 N--CA 1.374 -4.273 0 N-CA-C 105.678 -1.971 . . . . 63.32 105.678 178.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.408 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.1 Cg_exo -69.57 -143.47 0.02 OUTLIER 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 122.975 2.45 . . . . 73.25 110.923 175.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.54 ' HB3' ' HA ' ' A' ' 27' ' ' SER . 13.0 m -80.59 38.33 0.43 Allowed 'General case' 0 C--N 1.293 -1.853 0 CA-C-O 122.18 0.99 . . . . 43.12 110.66 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.408 ' H ' ' C ' ' A' ' 52' ' ' PRO . 6.7 m-20 -62.35 151.41 82.41 Favored Pre-proline 0 C--N 1.317 -0.823 0 C-N-CA 126.298 1.839 . . . . 75.13 112.802 -178.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -54.07 -43.45 58.17 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 124.011 3.141 . . . . 52.41 114.158 -175.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -73.86 -31.52 63.21 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-O 120.65 0.262 . . . . 55.42 110.372 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -63.7 -52.1 61.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.356 -0.979 . . . . 73.13 108.356 176.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.466 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.0 mm -56.97 -41.44 77.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.708 -1.133 . . . . 75.4 109.259 176.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.456 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 48.7 t-80 -58.92 -36.46 74.76 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-N 115.74 -0.664 . . . . 74.22 112.092 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -64.21 -44.42 92.01 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 108.118 -1.067 . . . . 54.12 108.118 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -67.39 -47.47 70.22 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.208 -1.814 . . . . 73.44 110.885 -172.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.466 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -74.17 -32.04 62.94 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 114.321 -1.309 . . . . 74.33 111.453 -177.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 67.1 t30 -63.16 -44.62 94.95 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.95 0.881 . . . . 54.14 109.847 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.533 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 19.0 mmt180 -57.56 -29.82 64.72 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.193 -1.367 . . . . 63.43 112.943 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.46 -39.18 85.3 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.658 0.266 . . . . 53.42 110.981 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 37.9 t80 -70.96 -29.8 65.91 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.566 -0.901 . . . . 74.43 108.566 178.442 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -19.94 65.1 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.738 -0.664 . . . . 70.54 110.529 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -79.84 -49.09 12.47 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 108.517 -0.92 . . . . 63.14 108.517 173.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.44 141.61 6.52 Favored Glycine 0 CA--C 1.479 -2.179 0 CA-C-N 115.001 -0.999 . . . . 71.02 111.526 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.521 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 59.5 ttp -67.74 -29.5 68.74 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.15 -1.796 . . . . 71.1 106.15 171.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.92 -32.95 34.48 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 113.707 -1.588 . . . . 63.31 109.026 177.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.412 HG23 ' CD1' ' A' ' 40' ' ' PHE . 98.7 m -60.4 -38.56 84.35 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.254 -0.647 . . . . 61.31 109.254 175.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.613 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.2 t-105 -61.57 -54.2 46.24 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 123.609 0.568 . . . . 72.12 109.739 175.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 70' ' ' MET . 85.9 mttt -53.97 -45.25 71.31 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.146 0.578 . . . . 71.05 111.935 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -65.34 -45.74 83.0 Favored 'General case' 0 N--CA 1.408 -2.558 0 C-N-CA 123.095 0.558 . . . . 74.44 111.104 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.446 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 81.0 t80 -57.49 -45.36 84.99 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.555 -0.748 . . . . 74.33 110.739 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.568 HG21 ' HB2' ' A' ' 94' ' ' LEU . 49.2 mm -63.5 -33.11 59.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 116.103 -0.499 . . . . 72.12 111.347 -178.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -66.16 -42.61 88.75 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.627 -0.829 . . . . 73.51 109.368 175.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 2.2 m-20 -64.12 -38.23 90.3 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 120.731 0.3 . . . . 64.42 110.427 175.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.6 tm? -53.66 -55.56 24.96 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 124.66 1.184 . . . . 72.31 109.863 177.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 87' ' ' PRO . 26.8 p -68.53 -40.24 80.84 Favored 'General case' 0 N--CA 1.42 -1.948 0 CA-C-N 116.15 -0.477 . . . . 72.21 111.674 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -65.86 -48.04 72.89 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.856 -0.611 . . . . 73.54 112.558 -174.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 6.1 mt-10 -80.69 -26.89 37.24 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.126 -0.63 . . . . 73.33 112.06 -174.194 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.3 mt -85.97 -37.39 19.05 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 120.442 -0.503 . . . . 64.42 111.098 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -148.82 -100.3 0.08 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 121.042 -0.263 . . . . 71.13 110.969 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -141.19 164.21 37.07 Favored Pre-proline 0 C--N 1.314 -0.962 0 N-CA-C 108.108 -1.071 . . . . 64.22 108.108 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.482 ' HA ' ' SG ' ' A' ' 81' ' ' CYS . 50.1 Cg_exo -57.8 114.89 2.16 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.898 1.732 . . . . 72.5 108.18 170.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.62 -19.09 29.84 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 113.304 0.853 . . . . 53.24 113.304 -169.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 78.7 -0.1 2.47 Favored 'General case' 0 N--CA 1.506 2.339 0 CA-C-O 123.542 1.639 . . . . 73.42 108.401 -173.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.452 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 27.8 ttt -105.75 6.26 31.65 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 113.157 -1.838 . . . . 75.44 108.071 -179.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.664 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -66.73 -46.53 75.18 Favored 'General case' 0 C--O 1.199 -1.601 0 CA-C-N 116.128 -0.487 . . . . 64.3 111.884 -178.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.456 ' O ' HG22 ' A' ' 95' ' ' VAL . 39.9 mm -59.09 -44.57 98.88 Favored Pre-proline 0 C--O 1.185 -2.332 0 CA-C-O 118.646 -0.693 . . . . 72.2 110.081 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.452 ' HD2' ' C ' ' A' ' 90' ' ' MET . 52.5 Cg_exo -47.63 -42.41 29.64 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 121.994 1.796 . . . . 72.32 112.342 169.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.627 HD22 HD12 ' A' ' 18' ' ' LEU . 4.4 mm? -67.01 -39.84 87.15 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.976 0.417 . . . . 72.33 110.616 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.664 HG13 ' O ' ' A' ' 91' ' ' GLU . 2.9 m -68.19 -29.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 122.824 1.297 . . . . 73.43 110.895 -178.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.488 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 24.5 t -82.92 5.13 22.93 Favored 'General case' 0 C--N 1.276 -2.629 0 C-N-CA 127.274 2.23 . . . . 62.3 111.68 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 17.3 tt -50.21 -48.16 24.54 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 113.439 0.903 . . . . 73.15 113.439 -173.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 4.1 p90 . . . . . 0 CA--C 1.499 -0.981 0 C-N-CA 126.339 1.856 . . . . 74.44 107.031 174.181 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.1 mpt? . . . . . 0 C--O 1.233 0.218 0 N-CA-C 108.493 -0.929 . . . . 72.41 108.493 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.418 ' O ' HD13 ' A' ' 11' ' ' ILE . 3.2 m-20 -105.12 25.71 10.23 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.266 0.839 . . . . 64.33 113.266 -174.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.431 ' HB3' ' HB ' ' A' ' 92' ' ' ILE . . . -77.2 -9.18 58.62 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 122.482 1.134 . . . . 51.01 109.778 175.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.482 ' HB3' ' OG ' ' A' ' 96' ' ' SER . 0.0 OUTLIER -69.19 -30.42 68.6 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.005 -1.452 . . . . 73.12 112.267 179.178 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.607 ' HB2' HD12 ' A' ' 11' ' ' ILE . 70.6 m -66.78 -32.45 73.75 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 122.271 1.034 . . . . 63.53 109.443 177.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.607 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.0 OUTLIER -84.38 -51.45 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.364 0 CA-C-N 113.888 -1.506 . . . . 61.15 110.918 -173.538 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -112.72 -6.92 13.84 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 115.003 1.483 . . . . 71.43 115.003 -173.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 53.29 -92.62 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.062 0.945 . . . . 75.44 113.18 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 7.8 p30 -170.37 170.55 7.03 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 124.513 1.125 . . . . 64.15 108.053 -179.34 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.421 ' H ' HD12 ' A' ' 18' ' ' LEU . 46.8 t30 -152.67 152.58 31.91 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.08 -38.79 92.58 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 123.752 0.821 . . . . 75.4 111.076 -177.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -61.3 -29.28 69.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.29 -0.414 . . . . 51.31 111.811 -178.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.539 HD21 ' SD ' ' A' ' 90' ' ' MET . 83.4 mt -65.81 -44.93 84.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.491 -0.559 . . . . 71.44 109.491 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.445 ' HB2' HD11 ' A' ' 97' ' ' ILE . 61.3 t-105 -69.48 -36.88 76.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.48 -0.782 . . . . 74.54 109.842 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.35 -44.09 88.8 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 116.215 -0.448 . . . . 53.53 111.249 178.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.545 ' CH2' ' HG ' ' A' ' 25' ' ' LEU . 70.1 t90 -60.76 -48.13 83.18 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.684 -0.858 . . . . 71.13 108.684 176.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.441 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -54.4 -53.22 56.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.93 -1.032 . . . . 70.44 109.294 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.0 t -60.13 -44.66 95.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 112.407 0.521 . . . . 75.44 112.407 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.485 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 42.2 ttm180 -69.95 -45.28 67.78 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 120.596 -0.441 . . . . 75.24 111.029 -176.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.545 ' HG ' ' CH2' ' A' ' 21' ' ' TRP . 2.7 tm? -67.82 -40.32 83.8 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.917 -0.401 . . . . 75.23 109.917 -175.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.661 HD13 HD23 ' A' ' 33' ' ' LEU . 6.8 mt -71.0 -25.59 62.75 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 120.957 0.408 . . . . 72.03 111.804 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.0 t -68.93 -17.35 63.94 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.606 -0.887 . . . . 73.23 108.606 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 30.1 mtmt -101.66 -2.63 29.91 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.733 -0.667 . . . . 74.01 110.02 177.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -135.53 57.62 20.66 Favored Pre-proline 0 C--O 1.243 0.756 0 CA-C-N 116.139 -0.482 . . . . 71.43 111.185 -178.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -67.98 -28.47 35.37 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 121.307 1.338 . . . . 74.44 108.774 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.88 -44.27 96.55 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-N 113.16 -1.836 . . . . 75.42 110.624 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.519 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 78.2 t90 -74.85 -45.84 40.4 Favored 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 119.92 -0.712 . . . . 75.02 110.055 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.661 HD23 HD13 ' A' ' 26' ' ' LEU . 2.6 tm? -60.32 -47.14 87.3 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.536 -1.211 . . . . 72.04 111.104 -173.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.608 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 50.1 m -57.43 -48.77 78.24 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 123.191 0.307 . . . . 73.21 111.222 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.02 -39.56 69.24 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.19 0.996 . . . . 71.22 111.854 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.519 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.7 mmmt -73.0 -33.25 65.68 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.784 -0.366 . . . . 70.33 111.091 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.2 mt -62.01 -32.46 72.94 Favored 'General case' 0 C--O 1.183 -2.401 0 N-CA-C 109.986 -0.375 . . . . 74.42 109.986 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 34' ' ' SER . 67.6 mtt180 -63.21 -30.47 71.61 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.13 0.491 . . . . 74.33 111.482 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 t -87.47 -35.72 18.07 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 115.48 -0.782 . . . . 73.55 110.536 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.73 ' CD1' HG23 ' A' ' 72' ' ' THR . 56.9 m-85 -86.64 -49.14 7.73 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 113.009 0.744 . . . . 73.32 113.009 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 8.6 mp -88.99 114.08 58.7 Favored Pre-proline 0 C--N 1.3 -1.561 0 C-N-CA 123.834 0.854 . . . . 62.42 109.228 179.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.97 -32.38 13.66 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.678 1.585 . . . . 74.43 110.333 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.4 m -105.59 29.13 6.81 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 115.22 -0.9 . . . . 63.54 109.472 -177.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.503 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -44.89 101.49 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.965 1.306 . . . . 60.11 114.311 -174.497 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.45 72.8 6.05 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.333 1.063 . . . . 75.12 108.775 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.409 HD22 ' HB3' ' A' ' 34' ' ' SER . 3.4 pp -96.52 -16.12 21.28 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.327 -1.306 . . . . 74.41 112.192 -178.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -87.12 -1.88 58.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.797 0.808 . . . . 75.53 111.796 -173.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.02 73.59 1.25 Allowed 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.461 -0.495 . . . . 44.52 110.656 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.1 m -101.32 83.97 2.55 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-O 121.595 0.712 . . . . 55.35 109.666 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -30.41 70.66 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 114.715 -1.129 . . . . 73.04 112.172 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -120.74 169.5 8.7 Favored Pre-proline 1 N--CA 1.377 -4.078 0 N-CA-C 106.337 -1.727 . . . . 62.32 106.337 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -81.12 -151.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.804 1.669 . . . . 71.11 110.869 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.5 m -76.47 38.74 0.19 Allowed 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 124.29 1.036 . . . . 74.55 112.607 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -65.88 151.62 94.76 Favored Pre-proline 0 N--CA 1.447 -0.599 0 C-N-CA 123.472 0.709 . . . . 72.24 112.152 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.9 -42.01 60.19 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 123.866 3.044 . . . . 73.35 114.369 -176.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -74.35 -27.9 60.89 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 120.792 0.33 . . . . 74.1 110.9 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 95.0 t -69.84 -47.19 71.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 107.937 -1.134 . . . . 62.45 107.937 177.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.447 ' O ' HD23 ' A' ' 62' ' ' LEU . 45.9 mm -58.91 -47.66 88.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.557 -1.202 . . . . 74.1 109.507 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -54.89 -37.54 66.43 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.548 -0.751 . . . . 74.22 111.594 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 22.5 ttt85 -60.61 -48.1 83.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.607 0.718 . . . . 52.11 110.887 177.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -66.21 -45.05 82.09 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.675 -1.148 . . . . 74.34 110.712 -176.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.8 mm? -74.18 -31.17 62.57 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.385 -1.28 . . . . 72.13 111.454 -176.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -60.51 -42.42 96.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.716 0.769 . . . . 70.33 109.693 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -60.03 -31.02 69.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.605 -1.18 . . . . 72.14 112.69 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.23 -44.54 71.8 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 110.011 -0.366 . . . . 73.32 110.011 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.745 -0.661 . . . . 64.42 109.307 176.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.12 -29.73 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.436 -0.802 . . . . 62.11 111.651 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.565 ' HB2' HG21 ' A' ' 72' ' ' THR . 35.2 mm-40 -68.86 -45.71 70.35 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 121.437 0.637 . . . . 62.05 109.366 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -174.42 142.1 6.23 Favored Glycine 0 N--CA 1.408 -3.185 0 CA-C-N 115.051 -0.977 . . . . 73.23 111.643 -175.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.449 ' O ' ' HZ3' ' A' ' 98' ' ' TRP . 0.0 OUTLIER -67.5 -30.18 69.8 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 105.843 -1.91 . . . . 62.34 105.843 170.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.93 -35.33 64.59 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.866 -1.515 . . . . 73.34 108.824 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.73 HG23 ' CD1' ' A' ' 40' ' ' PHE . 54.1 m -59.18 -45.52 90.82 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 115.434 -0.803 . . . . 65.41 110.654 175.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.56 ' HD1' HG23 ' A' ' 95' ' ' VAL . 66.2 t-105 -66.47 -38.61 87.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 121.095 -0.242 . . . . 73.21 110.457 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.639 ' HA ' HG21 ' A' ' 95' ' ' VAL . 89.1 mttt -56.7 -48.76 76.97 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.264 0.554 . . . . 73.52 110.603 174.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 47.2 m -62.79 -42.27 99.63 Favored 'General case' 0 N--CA 1.4 -2.969 0 CA-C-N 114.771 -1.104 . . . . 74.11 110.455 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.81 -47.98 82.64 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 115.012 -0.994 . . . . 73.23 111.69 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.414 HG22 ' HG3' ' A' ' 91' ' ' GLU . 49.7 mm -65.55 -34.75 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 119.551 -0.86 . . . . 64.23 110.903 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -63.95 -37.7 88.37 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.022 -0.535 . . . . 73.33 110.272 177.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 84.2 m-20 -74.37 -42.62 59.04 Favored 'General case' 0 C--O 1.192 -1.96 0 CA-C-N 116.517 -0.31 . . . . 71.52 110.731 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -50.13 -53.99 23.75 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.518 1.527 . . . . 64.42 109.947 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 45.0 t -66.59 -32.12 73.26 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.693 -0.685 . . . . 43.22 110.958 -179.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -76.19 -55.13 5.86 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.892 -0.595 . . . . 74.15 111.631 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 21.4 mt-10 -75.33 -25.26 57.66 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 113.132 0.79 . . . . 63.42 113.132 -170.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.528 HD13 HD12 ' A' ' 25' ' ' LEU . 94.4 mt -88.0 12.14 14.13 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.857 0.688 . . . . 71.13 112.857 -176.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.8 t70 72.58 -54.75 0.69 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.675 1.19 . . . . 65.13 113.428 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.62 116.34 39.6 Favored Pre-proline 0 C--N 1.308 -1.197 0 C-N-CA 123.129 0.572 . . . . 63.44 111.302 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -82.96 80.76 2.57 Favored 'Trans proline' 0 N--CA 1.43 -2.242 0 C-N-CA 121.674 1.583 . . . . 74.01 110.786 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.529 ' CD1' ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -67.57 -25.65 65.9 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.653 -0.703 . . . . 63.35 111.864 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.492 ' O ' HD22 ' A' ' 88' ' ' LEU . 9.4 t70 63.06 -164.14 0.26 Allowed 'General case' 0 CA--C 1.551 0.993 0 O-C-N 124.303 1.002 . . . . 74.14 109.13 175.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.539 ' SD ' HD21 ' A' ' 18' ' ' LEU . 41.3 ttm 60.4 34.01 20.65 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 123.085 1.422 . . . . 74.1 108.363 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.414 ' HG3' HG22 ' A' ' 77' ' ' ILE . 35.2 tt0 -53.75 -44.99 70.44 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.46 2.304 . . . . 64.41 112.703 -174.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.736 ' HA ' HG12 ' A' ' 95' ' ' VAL . 41.5 mm -71.33 -50.33 11.12 Favored Pre-proline 0 C--O 1.197 -1.658 0 CA-C-O 118.701 -0.666 . . . . 71.02 111.774 -177.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.501 ' HB2' ' HG2' ' A' ' 90' ' ' MET . 47.3 Cg_exo -51.8 -34.21 53.8 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 121.524 1.482 . . . . 65.44 112.147 169.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.437 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 3.6 mm? -65.14 -42.66 93.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.743 0.306 . . . . 72.51 110.897 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.736 HG12 ' HA ' ' A' ' 92' ' ' ILE . 2.5 p -70.51 -36.5 66.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 122.39 1.09 . . . . 72.44 111.54 176.017 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.482 ' OG ' ' HB3' ' A' ' 9' ' ' GLU . 69.7 m -71.21 5.91 1.94 Allowed 'General case' 0 C--N 1.251 -3.709 0 CA-C-N 114.26 -1.336 . . . . 71.22 113.61 176.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.445 HD11 ' HB2' ' A' ' 19' ' ' TRP . 4.0 tp -67.83 -18.95 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 123.95 0.9 . . . . 74.45 109.288 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . 0.449 ' HZ3' ' O ' ' A' ' 70' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.237 0.411 0 C-N-CA 124.617 1.167 . . . . 70.41 113.833 -176.627 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 31.5 tpp . . . . . 0 C--O 1.205 -1.256 0 CA-C-O 121.531 0.682 . . . . 60.33 109.26 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -87.84 23.7 1.96 Allowed 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.773 -0.649 . . . . 63.15 111.433 -176.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.4 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -79.24 -21.24 46.46 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 122.066 0.936 . . . . 73.01 109.21 174.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.511 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.8 OUTLIER -60.85 -30.53 70.18 Favored 'General case' 0 C--O 1.202 -1.407 0 CA-C-N 114.232 -1.349 . . . . 74.21 112.955 -179.26 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.617 ' HB2' HD12 ' A' ' 11' ' ' ILE . 65.9 m -58.22 -38.68 77.28 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 122.186 0.993 . . . . 71.51 110.141 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.617 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.2 mp -79.74 -37.21 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.855 0 CA-C-N 113.413 -1.721 . . . . 64.15 109.94 -175.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -89.84 -4.56 57.52 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.979 -0.555 . . . . 55.12 111.201 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.4 mt 65.88 140.41 0.03 OUTLIER 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.532 1.933 . . . . 63.12 115.207 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -83.64 81.76 8.61 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.597 -2.371 . . . . 75.01 104.597 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.443 ' H ' HD23 ' A' ' 18' ' ' LEU . 25.5 t-20 -103.95 154.7 19.35 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-N 115.568 -0.742 . . . . 62.32 111.998 -171.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -52.85 -29.04 25.75 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.917 1.687 . . . . 62.44 111.607 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -57.7 -42.51 83.87 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.738 0.815 . . . . 74.25 110.365 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.623 HD12 HD22 ' A' ' 94' ' ' LEU . 3.0 mm? -67.01 -40.09 87.21 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.882 -0.599 . . . . 64.41 109.835 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -66.86 -47.51 71.67 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.287 -0.87 . . . . 75.3 109.731 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.14 -37.18 86.53 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.25 -0.432 . . . . 75.41 111.543 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -64.1 -50.45 68.24 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 110.27 -0.271 . . . . 74.2 110.27 175.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 40.7 tp -60.31 -53.01 62.7 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.721 -0.672 . . . . 62.41 110.166 -178.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.0 t -58.93 -42.17 85.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 C-N-CA 123.299 0.64 . . . . 54.21 112.592 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 52.5 ttt180 -70.98 -45.36 64.17 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.019 -0.672 . . . . 74.41 110.73 -176.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -66.25 -39.65 89.65 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.181 -0.674 . . . . 71.32 109.181 -177.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.589 HD13 HD23 ' A' ' 33' ' ' LEU . 7.9 mt -72.14 -25.48 61.73 Favored 'General case' 0 C--N 1.307 -1.283 0 N-CA-C 112.817 0.673 . . . . 72.3 112.817 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -68.13 -21.67 64.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.245 -1.02 . . . . 51.54 108.245 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 29.5 mtmt -92.26 -5.72 51.83 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.531 0.681 . . . . 54.42 109.948 178.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.434 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.4 m-80 -135.65 53.81 9.14 Favored Pre-proline 0 C--O 1.242 0.693 0 CA-C-N 115.403 -0.817 . . . . 53.02 112.06 -177.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.7 Cg_exo -68.96 -22.28 36.05 Favored 'Trans proline' 0 C--N 1.36 1.165 0 N-CA-C 108.881 -1.238 . . . . 64.23 108.881 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -67.55 -44.87 77.23 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 113.717 -1.583 . . . . 72.33 110.006 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.451 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 66.3 t90 -74.9 -44.9 46.24 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 119.708 -0.797 . . . . 71.41 110.062 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.589 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -58.01 -48.02 81.3 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.464 -1.244 . . . . 64.22 111.452 -173.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.697 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 19.6 p -54.5 -53.44 54.39 Favored 'General case' 0 C--O 1.21 -1.009 0 O-C-N 123.673 0.608 . . . . 75.24 111.791 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.61 -40.9 63.18 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.528 1.131 . . . . 63.41 112.687 176.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.451 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.3 mmmt -74.07 -30.51 62.41 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 120.288 -0.565 . . . . 75.12 111.543 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 95.4 mt -62.32 -37.95 87.56 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 108.836 -0.801 . . . . 73.3 108.836 172.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.697 ' HG3' ' O ' ' A' ' 34' ' ' SER . 74.7 mtp180 -62.54 -31.34 72.1 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.41 0.624 . . . . 62.24 111.199 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 39.4 m -73.07 -33.92 65.94 Favored 'General case' 0 N--CA 1.401 -2.897 0 C-N-CA 125.014 1.326 . . . . 64.12 111.814 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.618 ' CD1' HG23 ' A' ' 72' ' ' THR . 60.7 m-85 -95.93 -51.38 4.48 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.661 -0.7 . . . . 71.2 112.589 -176.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.549 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -96.71 111.26 56.78 Favored Pre-proline 0 N--CA 1.429 -1.522 0 N-CA-C 108.581 -0.896 . . . . 71.22 108.581 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.61 -11.93 16.9 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.582 2.188 . . . . 72.53 112.615 -177.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.5 p -114.34 29.52 7.96 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 123.619 0.768 . . . . 73.14 112.161 -176.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.674 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -47.51 111.51 0.43 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 115.222 1.564 . . . . 74.34 115.222 -175.624 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.48 65.83 0.69 Allowed 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 104.758 -2.312 . . . . 71.43 104.758 170.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.674 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.9 pp -91.96 -17.28 25.38 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.628 -1.624 . . . . 71.12 111.341 -171.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.0 -9.08 54.01 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.352 -0.84 . . . . 71.35 112.112 -174.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.0 m -80.15 89.13 5.42 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 115.484 -0.78 . . . . 62.53 112.17 -177.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -111.82 82.87 1.69 Allowed 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.6 -0.889 . . . . 74.4 108.6 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.86 -46.2 90.45 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 122.449 1.118 . . . . 65.13 111.708 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.493 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 53.9 mm-40 -101.26 168.92 8.43 Favored Pre-proline 0 C--N 1.244 -3.996 0 N-CA-C 105.469 -2.049 . . . . 63.14 105.469 175.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 54' ' ' ASN . 23.4 Cg_exo -67.51 -144.33 0.02 OUTLIER 'Trans proline' 0 CA--C 1.551 1.354 0 C-N-CA 122.616 2.211 . . . . 71.54 112.826 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -76.12 36.87 0.15 Allowed 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.079 0.952 . . . . 61.43 111.409 -177.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.482 ' O ' HG12 ' A' ' 58' ' ' ILE . 5.2 m-20 -67.45 149.06 98.56 Favored Pre-proline 0 N--CA 1.432 -1.33 0 C-N-CA 126.162 1.785 . . . . 74.03 112.419 -175.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . 0.538 ' HG2' ' OE2' ' A' ' 56' ' ' GLU . 16.1 Cg_endo -61.99 -28.24 80.43 Favored 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.016 2.477 . . . . 61.11 111.598 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.538 ' OE2' ' HG2' ' A' ' 55' ' ' PRO . 3.4 mp0 -67.53 -37.9 83.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.526 -0.916 . . . . 73.35 108.526 177.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.493 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 84.9 t -74.29 -36.64 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 114.4 -1.273 . . . . 74.22 109.574 -178.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 54' ' ' ASN . 48.6 mm -64.72 -44.78 96.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.527 -0.76 . . . . 63.02 109.147 174.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . 0.453 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 59.8 t-80 -56.79 -40.84 76.64 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 123.254 0.621 . . . . 71.12 110.437 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.474 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 3.2 tpt180 -53.66 -48.19 69.66 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 125.16 1.384 . . . . 72.32 110.954 177.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.524 ' HB3' HD11 ' A' ' 37' ' ' LEU . 62.8 mt-30 -70.72 -50.97 30.6 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.869 -1.06 . . . . 65.3 110.756 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.426 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.2 mm? -66.78 -30.42 70.62 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 114.562 -1.199 . . . . 71.11 112.695 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 56.9 t30 -52.95 -40.39 63.62 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 125.132 1.373 . . . . 72.12 110.717 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.549 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 29.3 mmt180 -60.43 -30.76 69.83 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 72.13 112.976 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.03 -38.14 72.58 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.347 . . . . 42.43 110.886 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -71.71 -27.83 63.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.283 -0.636 . . . . 73.34 109.283 177.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.71 -31.94 72.23 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 115.189 -0.914 . . . . 72.34 109.665 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.405 ' CB ' HG21 ' A' ' 72' ' ' THR . 8.7 mm-40 -70.84 -54.44 11.56 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 109.273 -0.64 . . . . 71.21 109.273 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -177.96 146.56 7.6 Favored Glycine 0 N--CA 1.417 -2.614 0 C-N-CA 120.447 -0.882 . . . . 70.24 113.111 -175.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -69.73 -26.76 64.48 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 106.056 -1.831 . . . . 55.0 106.056 169.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.83 -31.61 63.3 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 113.658 -1.61 . . . . 64.43 108.189 175.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.618 HG23 ' CD1' ' A' ' 40' ' ' PHE . 51.6 m -71.25 -39.67 71.48 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 115.538 -0.756 . . . . 64.04 111.07 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.494 ' HD1' ' O ' ' A' ' 95' ' ' VAL . 47.3 t-105 -63.9 -35.01 79.24 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 107.696 -1.224 . . . . 72.43 107.696 174.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.941 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 78.5 tttt -62.23 -45.85 91.5 Favored 'General case' 1 N--CA 1.366 -4.671 0 N-CA-C 114.832 1.419 . . . . 73.32 114.832 173.292 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.2 m -62.75 -34.95 78.26 Favored 'General case' 0 N--CA 1.41 -2.425 0 CA-C-O 122.081 0.943 . . . . 71.12 109.342 175.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . 0.417 ' HB3' ' O ' ' A' ' 73' ' ' TRP . 73.2 t80 -62.26 -52.44 63.72 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 113.835 -1.529 . . . . 60.4 112.623 -178.708 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.709 HG13 ' HA ' ' A' ' 95' ' ' VAL . 50.2 mm -68.04 -29.13 43.65 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 C-N-CA 119.022 -1.071 . . . . 74.21 111.094 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -63.76 -41.22 98.02 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.188 -0.46 . . . . 73.23 110.93 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -76.12 -37.04 58.57 Favored 'General case' 0 C--O 1.21 -1.015 0 C-N-CA 120.412 -0.515 . . . . 73.2 110.307 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.49 -54.21 24.03 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.989 1.315 . . . . 71.04 109.388 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.462 ' SG ' HD13 ' A' ' 88' ' ' LEU . 60.1 m -64.16 -38.36 90.77 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.405 -0.816 . . . . 71.55 111.654 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -75.57 -48.18 23.46 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.067 -0.515 . . . . 75.0 111.404 -175.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -76.48 -33.66 58.68 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 114.918 1.451 . . . . 74.2 114.918 -175.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.6 mt -83.14 -21.63 33.54 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.661 -0.815 . . . . 74.03 111.324 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 70.89 -9.06 0.87 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.321 1.048 . . . . 62.31 112.935 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.02 137.56 94.65 Favored Pre-proline 0 N--CA 1.437 -1.11 0 N-CA-C 109.092 -0.707 . . . . 75.13 109.092 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -84.41 102.81 0.9 Allowed 'Trans proline' 0 N--CA 1.436 -1.854 0 C-N-CA 121.755 1.637 . . . . 61.23 112.978 -177.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.462 HD13 ' SG ' ' A' ' 81' ' ' CYS . 4.5 mp -90.96 -41.07 11.33 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 107.936 -1.135 . . . . 61.44 107.936 173.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.9 t70 68.71 -54.33 0.55 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.531 1.532 . . . . 74.43 112.923 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 64.4 mtt -96.94 82.3 3.22 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.593 -0.892 . . . . 53.05 108.593 175.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -71.3 -34.31 70.5 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 125.735 1.614 . . . . 73.14 112.257 -176.093 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.563 ' HB ' ' HD3' ' A' ' 93' ' ' PRO . 50.1 mm -49.66 -52.07 54.04 Favored Pre-proline 0 CA--C 1.572 1.792 0 C-N-CA 125.004 1.322 . . . . 72.52 113.475 -173.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.563 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 13.8 Cg_exo -58.84 -37.94 91.12 Favored 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 121.526 1.484 . . . . 74.31 111.649 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.636 ' O ' HG22 ' A' ' 97' ' ' ILE . 4.2 mm? -64.04 -37.46 87.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.567 0.747 . . . . 42.53 111.286 176.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.941 ' CG2' ' HA ' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -85.69 -27.64 6.32 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.179 0 CA-C-O 121.877 0.846 . . . . 74.5 112.712 -171.234 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . 0.447 ' CB ' ' HG2' ' A' ' 9' ' ' GLU . 9.4 t -101.66 5.3 41.43 Favored 'General case' 0 C--N 1.256 -3.485 0 C-N-CA 119.245 -0.982 . . . . 72.33 111.279 -177.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.636 HG22 ' O ' ' A' ' 94' ' ' LEU . 15.5 tt -77.14 -49.62 22.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 112.643 0.609 . . . . 73.44 112.643 -177.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.2 m0 . . . . . 0 CA--C 1.56 1.36 0 C-N-CA 126.23 1.812 . . . . 64.32 113.124 -176.577 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.543 ' SD ' ' HB3' ' A' ' 74' ' ' LYS . 34.6 tpp . . . . . 0 C--O 1.216 -0.673 0 CA-C-O 121.621 0.724 . . . . 73.24 110.53 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -109.03 24.96 12.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.743 -0.662 . . . . 75.32 110.606 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.514 ' HA ' HD13 ' A' ' 11' ' ' ILE . . . -79.46 -7.43 58.41 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.111 0.958 . . . . 72.0 109.721 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.408 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -69.85 -30.05 67.44 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.937 1.295 . . . . 75.3 111.791 -178.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.735 ' HB2' HD12 ' A' ' 11' ' ' ILE . 49.6 m -57.39 -29.32 63.99 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 125.418 1.487 . . . . 73.33 110.348 174.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.735 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -88.13 -34.28 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.218 0 CA-C-N 114.126 -1.397 . . . . 74.31 111.666 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -75.22 -66.63 0.74 Allowed 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.223 1.564 . . . . 74.34 115.223 -167.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 54.9 177.09 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 115.31 1.596 . . . . 70.11 115.31 -178.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 38.7 t30 68.92 126.66 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 125.317 1.447 . . . . 64.51 110.472 -176.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.534 ' HB2' HG13 ' A' ' 97' ' ' ILE . 9.1 p30 -150.84 28.21 0.69 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 114.315 1.228 . . . . 74.45 114.315 -173.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.48 -49.97 67.07 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.294 -0.963 . . . . 60.51 113.288 -176.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -75.52 -33.03 60.69 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.246 -1.02 . . . . 73.45 108.246 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.646 HD21 ' HA ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -55.76 -46.61 77.83 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 113.73 -1.577 . . . . 74.05 111.262 178.865 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -59.57 -48.15 82.8 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.431 -0.804 . . . . 74.51 110.986 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.71 65.91 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.2 -0.455 . . . . 73.34 111.362 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.42 ' HE1' HD21 ' A' ' 88' ' ' LEU . 42.1 t-105 -71.1 -51.4 25.33 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 110.269 -0.271 . . . . 70.11 110.269 175.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.91 -51.17 67.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.023 -0.535 . . . . 73.32 110.473 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.5 t -60.11 -45.14 96.15 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-N 115.602 -0.727 . . . . 75.3 112.73 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 75.7 ttt180 -71.82 -41.93 67.61 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.483 -0.487 . . . . 74.2 110.864 -177.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.498 HD12 HD13 ' A' ' 84' ' ' LEU . 1.9 tm? -65.66 -41.91 91.96 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.255 0.55 . . . . 73.43 109.864 -177.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.662 HD13 HD23 ' A' ' 33' ' ' LEU . 4.3 mt -72.17 -24.96 61.52 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.342 0.497 . . . . 73.43 112.342 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.8 t -67.04 -24.65 66.02 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 108.4 -0.963 . . . . 71.14 108.4 177.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 59.5 mttt -87.02 -12.95 45.85 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.612 -0.722 . . . . 44.22 109.66 178.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.416 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.6 m-80 -129.97 54.06 13.43 Favored Pre-proline 0 N--CA 1.444 -0.747 0 CA-C-N 115.353 -0.84 . . . . 64.24 113.208 -173.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.416 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.0 Cg_exo -69.48 -22.2 33.72 Favored 'Trans proline' 0 C--N 1.357 1.003 0 N-CA-C 108.24 -1.485 . . . . 64.45 108.24 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.83 -41.8 91.32 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.593 -1.639 . . . . 74.34 109.893 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.5 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 76.5 t90 -75.3 -43.64 49.9 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.518 -0.873 . . . . 74.45 109.934 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.662 HD23 HD13 ' A' ' 26' ' ' LEU . 1.9 tm? -60.69 -40.16 91.16 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.38 -1.282 . . . . 73.42 111.191 -173.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.543 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 51.0 p -53.46 -53.52 50.26 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.196 0.31 . . . . 74.1 111.21 176.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.432 ' HA ' ' NE ' ' A' ' 38' ' ' ARG . . . -52.1 -48.62 64.65 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.519 1.528 . . . . 74.43 112.192 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 69.0 mmtt -69.27 -32.03 70.95 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 120.424 -0.51 . . . . 34.31 111.921 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.566 HD12 HD22 ' A' ' 46' ' ' LEU . 37.4 mt -67.15 -31.05 71.22 Favored 'General case' 0 C--O 1.187 -2.212 0 C-N-CA 120.127 -0.629 . . . . 74.43 110.367 173.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 34' ' ' SER . 24.6 mtm180 -61.79 -33.61 74.42 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.792 0.806 . . . . 74.22 109.589 177.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . 0.41 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 75.3 m -78.4 -29.66 47.34 Favored 'General case' 0 N--CA 1.398 -3.073 0 C-N-CA 125.126 1.37 . . . . 64.33 113.174 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.571 ' CD1' HG23 ' A' ' 72' ' ' THR . 52.5 m-85 -102.16 -46.63 4.78 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 112.863 0.69 . . . . 74.31 112.863 -178.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 8.7 mp -91.29 135.59 28.03 Favored Pre-proline 0 C--N 1.294 -1.84 0 C-N-CA 124.491 1.116 . . . . 52.15 110.701 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -90.86 -14.44 1.89 Allowed 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.343 2.029 . . . . 60.02 110.453 169.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.2 p -114.01 28.2 8.94 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 124.44 1.096 . . . . 71.22 111.531 -175.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.488 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -68.43 113.2 5.78 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.664 -1.153 . . . . 73.54 112.733 -177.295 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -147.14 75.55 1.38 Allowed 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 114.364 -1.289 . . . . 71.15 109.008 173.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.566 HD22 HD12 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -92.81 -12.29 31.55 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.126 -1.397 . . . . 65.44 108.744 -179.268 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.98 -16.66 63.79 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.264 -1.335 . . . . 72.45 111.538 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 51.8 t -79.72 92.95 5.47 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 106.98 -1.489 . . . . 64.43 106.98 173.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.5 m -91.32 86.34 6.09 Favored 'General case' 0 N--CA 1.411 -2.378 0 CA-C-O 121.783 0.802 . . . . 72.02 111.733 -176.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -41.57 82.05 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.867 1.318 . . . . 74.12 108.597 173.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.586 ' HG3' ' CG2' ' A' ' 57' ' ' VAL . 2.5 pt-20 -137.34 163.37 49.38 Favored Pre-proline 0 C--N 1.258 -3.386 0 CA-C-N 112.216 -2.265 . . . . 63.14 108.097 170.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 51' ' ' GLU . 57.8 Cg_endo -69.42 -156.43 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.814 2.343 . . . . 64.11 113.057 -177.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 m -75.59 38.75 0.15 Allowed 'General case' 0 C--O 1.251 1.157 0 C-N-CA 124.616 1.166 . . . . 71.3 112.571 -176.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.462 ' HB2' HG23 ' A' ' 57' ' ' VAL . 95.8 m-20 -58.47 152.06 46.65 Favored Pre-proline 0 N--CA 1.436 -1.17 0 C-N-CA 125.5 1.52 . . . . 72.41 111.025 177.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.73 -39.11 90.95 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.514 2.809 . . . . 75.45 112.732 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -72.75 -31.96 65.31 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.683 -0.69 . . . . 72.43 110.05 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.586 ' CG2' ' HG3' ' A' ' 51' ' ' GLU . 67.5 t -69.66 -46.33 75.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.298 -0.864 . . . . 61.34 108.89 178.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.444 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.5 mm -59.45 -46.92 92.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.037 -0.983 . . . . 75.54 109.338 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -55.93 -39.68 72.04 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.791 0.436 . . . . 73.35 111.483 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -64.07 -39.82 94.92 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.349 0.595 . . . . 64.04 111.2 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.45 HE21 HG12 ' A' ' 57' ' ' VAL . 78.2 mt-30 -70.81 -45.49 64.51 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.019 -0.992 . . . . 74.13 110.395 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -66.14 -31.08 71.71 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.254 -1.339 . . . . 51.34 111.509 -178.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -52.75 -43.06 65.51 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.869 1.268 . . . . 74.13 110.57 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.88 -30.09 63.55 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.305 -1.316 . . . . 73.24 113.076 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.439 HD12 HD13 ' A' ' 62' ' ' LEU . 90.9 mt -72.34 -42.29 65.51 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-O 120.623 0.249 . . . . 62.42 111.431 -177.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -70.55 -28.14 64.68 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.367 -0.975 . . . . 65.34 108.367 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.56 -41.07 96.54 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.079 -0.964 . . . . 44.25 109.841 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.497 ' HB2' HG21 ' A' ' 72' ' ' THR . 43.5 mm-40 -63.96 -47.19 81.4 Favored 'General case' 0 N--CA 1.426 -1.666 0 N-CA-C 109.641 -0.503 . . . . 63.23 109.641 176.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -176.92 143.44 6.31 Favored Glycine 0 N--CA 1.407 -3.261 0 C-N-CA 120.356 -0.926 . . . . 73.34 113.841 -176.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -69.87 -27.11 64.55 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 106.565 -1.643 . . . . 74.44 106.565 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.05 -37.66 58.03 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.407 -1.269 . . . . 34.33 108.473 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.571 HG23 ' CD1' ' A' ' 40' ' ' PHE . 94.0 m -59.6 -35.66 74.76 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.093 -0.958 . . . . 75.24 110.754 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.559 ' CD1' HG23 ' A' ' 95' ' ' VAL . 58.5 t-105 -63.88 -42.69 97.44 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 109.668 -0.493 . . . . 75.23 109.668 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.782 ' HA ' HG21 ' A' ' 95' ' ' VAL . 50.3 mttt -62.84 -47.09 84.9 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.198 0.599 . . . . 75.55 110.887 177.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.7 m -61.32 -40.8 95.55 Favored 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 115.914 -0.584 . . . . 71.12 110.882 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -60.64 -50.65 72.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.363 -0.835 . . . . 64.2 111.016 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.532 HG13 ' HA ' ' A' ' 95' ' ' VAL . 32.4 mm -66.88 -33.38 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 120.482 -0.487 . . . . 63.42 111.528 -175.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -60.63 -43.16 97.85 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.862 -0.422 . . . . 52.12 109.862 176.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.3 m-20 -71.66 -42.11 67.92 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.98 -0.554 . . . . 72.43 111.274 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.45 ' HA ' ' CZ2' ' A' ' 32' ' ' TRP . 2.4 tm? -50.45 -54.62 20.7 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.346 1.458 . . . . 72.35 109.774 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 88' ' ' LEU . 46.9 t -67.55 -32.21 72.83 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.806 -1.088 . . . . 73.1 111.24 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -72.85 -44.58 61.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.448 -0.796 . . . . 74.3 111.65 -176.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 9.8 mt-10 -89.24 -19.67 25.09 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 113.98 1.104 . . . . 63.55 113.98 -171.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.498 HD13 HD12 ' A' ' 25' ' ' LEU 0.255 85.3 mt -82.16 49.13 1.35 Allowed 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 115.658 1.725 . . . . 70.23 115.658 -174.579 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.464 ' OD2' HG23 ' A' ' 86' ' ' VAL . 26.6 t70 71.73 -73.11 0.1 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.684 1.364 . . . . 43.43 114.684 173.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.464 HG23 ' OD2' ' A' ' 85' ' ' ASP . 71.3 t -99.77 124.46 43.94 Favored Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 122.385 -0.197 . . . . 73.44 110.917 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.28 107.06 0.76 Allowed 'Trans proline' 0 C--O 1.252 1.202 0 C-N-CA 122.845 2.363 . . . . 74.12 111.481 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.44 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 4.8 mp -64.45 -38.87 92.55 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.312 -0.858 . . . . 70.4 109.606 179.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.9 t70 65.38 9.94 6.13 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-O 122.818 1.294 . . . . 45.31 111.333 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.455 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 25.5 ptm -124.43 39.95 3.85 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 107.657 -1.238 . . . . 74.2 107.657 177.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -40.13 95.05 Favored 'General case' 0 C--O 1.203 -1.386 0 CA-C-N 114.021 -1.445 . . . . 63.04 111.003 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.729 ' HA ' HG12 ' A' ' 95' ' ' VAL . 31.1 mm -64.53 -48.33 74.76 Favored Pre-proline 0 C--N 1.29 -2.003 0 CA-C-O 119.088 -0.482 . . . . 70.41 111.518 179.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.455 ' HD2' ' C ' ' A' ' 90' ' ' MET . 84.6 Cg_exo -51.23 -38.44 61.4 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 121.507 1.471 . . . . 75.23 111.01 170.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.646 ' HA ' HD21 ' A' ' 18' ' ' LEU . 3.2 mm? -63.48 -46.47 86.0 Favored 'General case' 0 C--O 1.188 -2.178 0 O-C-N 123.371 0.42 . . . . 74.12 112.076 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.782 HG21 ' HA ' ' A' ' 74' ' ' LYS . 5.7 p -68.79 -31.53 51.12 Favored 'Isoleucine or valine' 0 C--O 1.251 1.18 0 CA-C-O 122.377 1.084 . . . . 72.23 112.817 -178.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.5 t -62.36 -6.86 3.59 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 113.329 -1.759 . . . . 62.14 111.621 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.534 HG13 ' HB2' ' A' ' 15' ' ' ASN . 15.3 tt -61.21 -28.58 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 124.333 1.053 . . . . 75.35 111.869 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 34.0 t-105 . . . . . 0 C--N 1.315 -0.91 0 C-N-CA 120.539 -0.465 . . . . 72.13 111.478 -174.449 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.503 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 2.1 mpt? . . . . . 0 C--O 1.213 -0.832 0 N-CA-C 111.343 0.127 . . . . 74.23 111.343 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -81.16 24.58 0.52 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 113.055 0.761 . . . . 74.41 113.055 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.433 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.46 -17.66 56.0 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.425 -0.583 . . . . 74.31 109.425 174.116 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 6' ' ' MET . 0.3 OUTLIER -54.18 -43.63 70.85 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.078 0.951 . . . . 74.45 111.527 178.973 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -55.83 -31.54 62.81 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 124.743 1.217 . . . . 72.42 111.224 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.433 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.2 mp -87.6 -34.84 7.65 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 C-N-CA 124.825 1.25 . . . . 65.34 111.521 -176.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -91.63 -44.27 9.14 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 115.436 1.643 . . . . 75.33 115.436 -171.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 64.44 171.01 0.19 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.778 0.831 . . . . 75.22 112.989 -174.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . 0.414 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 4.4 p-10 -108.56 -176.97 3.19 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 112.724 0.638 . . . . 65.31 112.724 -175.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.5 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 45.2 t-20 -155.26 142.95 19.78 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.557 -0.905 . . . . 74.34 108.557 -176.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.83 -29.83 67.19 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.779 0.659 . . . . 71.53 112.779 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -68.41 -32.85 73.18 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 122.405 1.098 . . . . 62.03 108.959 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.529 HD21 ' HA ' ' A' ' 94' ' ' LEU . 7.0 tt -69.92 -35.11 74.31 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 113.158 -1.837 . . . . 74.34 109.568 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 59.2 t-105 -63.63 -44.97 92.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.596 -0.52 . . . . 75.43 109.596 175.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.46 -40.99 93.18 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.033 -0.531 . . . . 74.14 110.308 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -57.49 -50.57 72.64 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.643 -0.708 . . . . 65.53 110.704 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.48 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 57.4 tp -59.53 -51.32 70.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.059 -0.519 . . . . 74.23 110.609 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.54 -51.4 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.095 -0.502 . . . . 71.13 111.984 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 31.3 mmt180 -70.27 -38.46 75.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.964 0.357 . . . . 75.33 111.964 -174.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -66.47 -41.52 88.89 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.881 -0.785 . . . . 75.3 108.881 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.701 HD13 HD23 ' A' ' 33' ' ' LEU . 5.4 mt -70.71 -24.89 62.73 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.412 0.523 . . . . 71.32 112.412 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.1 m -68.46 -20.91 64.65 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.024 -0.732 . . . . 73.11 109.024 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 34.1 mtmt -92.06 -3.56 55.61 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.799 -0.637 . . . . 63.31 109.31 177.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.437 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 54.1 m-80 -137.53 54.08 7.48 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 115.641 -0.709 . . . . 65.42 111.945 -177.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 13.4 Cg_exo -70.41 -19.86 32.5 Favored 'Trans proline' 0 C--N 1.358 1.044 0 N-CA-C 108.643 -1.329 . . . . 71.53 108.643 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -69.56 -43.93 71.9 Favored 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.06 -1.427 . . . . 51.55 109.731 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.0 t90 -74.77 -43.05 56.87 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 120.133 -0.627 . . . . 74.33 110.196 177.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.701 HD23 HD13 ' A' ' 26' ' ' LEU . 2.4 tm? -59.77 -45.78 91.2 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.178 -0.919 . . . . 72.33 111.016 -173.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.407 ' HB2' HD22 ' A' ' 46' ' ' LEU . 32.1 p -62.54 -35.37 79.23 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 112.025 0.38 . . . . 25.12 112.025 178.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.53 99.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.469 0.652 . . . . 65.24 110.391 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.9 mmtt -72.48 -31.7 65.61 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 120.234 -0.586 . . . . 73.02 111.714 175.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 73.0 mt -58.43 -50.84 72.25 Favored 'General case' 0 C--O 1.201 -1.462 0 CA-C-O 119.864 -0.112 . . . . 72.34 111.229 176.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -60.4 -30.49 69.63 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.232 0.826 . . . . 74.52 113.232 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.4 m -72.38 -50.13 28.83 Favored 'General case' 1 N--CA 1.375 -4.214 0 CA-C-N 114.55 -1.204 . . . . 74.14 112.078 176.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.437 ' CD1' HG23 ' A' ' 72' ' ' THR . 55.5 m-85 -80.8 -43.89 19.37 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.507 0.929 . . . . 72.4 113.507 -175.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.6 ' HG ' ' OE1' ' A' ' 68' ' ' GLN . 6.5 mp -79.43 124.78 83.89 Favored Pre-proline 0 C--N 1.287 -2.116 0 C-N-CA 124.125 0.97 . . . . 62.11 111.605 -176.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -82.08 -10.33 11.45 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.875 1.716 . . . . 70.42 107.957 168.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 p -111.48 29.33 7.92 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 127.29 2.236 . . . . 74.31 109.987 -178.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.314 0.0 OUTLIER -54.0 92.41 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 116.502 2.038 . . . . 73.14 116.502 -179.401 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . 0.641 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 8.7 m-20 -118.44 81.65 1.72 Allowed 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.607 -1.627 . . . . 74.4 106.607 174.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.407 HD22 ' HB2' ' A' ' 34' ' ' SER . 3.7 pp -95.51 -6.52 40.37 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.161 -1.381 . . . . 62.45 111.52 -176.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.78 4.0 49.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.391 -0.822 . . . . 75.34 110.375 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . 0.641 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 64.3 m -88.32 30.46 0.88 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.414 0.626 . . . . 73.4 111.57 -177.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -80.2 89.51 5.46 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 109.236 -0.653 . . . . 64.2 109.236 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.37 -25.51 65.11 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.049 -0.978 . . . . 72.52 112.584 178.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -132.58 167.75 21.15 Favored Pre-proline 1 N--CA 1.378 -4.039 0 CA-C-N 113.925 -1.489 . . . . 65.44 107.176 178.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -63.79 -141.06 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.388 2.725 . . . . 72.03 113.285 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -76.21 37.65 0.16 Allowed 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.773 0.829 . . . . 65.33 111.963 -177.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.465 ' HB2' HG23 ' A' ' 57' ' ' VAL . 6.4 m120 -67.64 145.78 98.3 Favored Pre-proline 0 C--N 1.301 -1.519 0 C-N-CA 124.497 1.119 . . . . 55.51 111.491 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.1 -38.2 92.57 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.413 2.742 . . . . 71.2 113.187 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.08 -28.69 60.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.741 0.305 . . . . 61.42 110.359 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.465 HG23 ' HB2' ' A' ' 54' ' ' ASN . 86.1 t -66.04 -50.9 66.04 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.511 0 N-CA-C 107.835 -1.172 . . . . 74.53 107.835 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.4 mm -59.67 -42.7 89.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.329 -1.305 . . . . 63.13 109.873 177.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -58.44 -36.29 73.42 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.978 -0.556 . . . . 63.12 111.592 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 31.7 ttm-85 -63.16 -41.79 99.3 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.951 0.882 . . . . 71.12 110.731 177.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 74.6 mt-30 -67.23 -39.65 86.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.547 -1.206 . . . . 74.4 110.313 -177.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.462 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -74.09 -31.05 62.65 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.8 -1.091 . . . . 72.04 110.676 177.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.433 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 8.6 t30 -61.87 -35.51 78.51 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 124.247 1.019 . . . . 70.22 109.364 178.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -58.26 -55.84 29.85 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 114.98 -1.009 . . . . 74.4 110.257 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.599 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 79.6 mt -57.27 -33.83 68.02 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.929 0.491 . . . . 74.32 111.327 -177.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -57.15 -45.86 83.21 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.554 -0.748 . . . . 72.13 109.561 176.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.4 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 61.51 110.811 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.6 ' OE1' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -60.25 -47.68 84.98 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 123.842 0.857 . . . . 73.4 111.067 177.046 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 166.47 138.46 2.44 Favored Glycine 0 N--CA 1.411 -3.03 0 C-N-CA 119.867 -1.159 . . . . 55.2 112.695 -178.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.442 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -70.29 -27.07 64.11 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 105.913 -1.884 . . . . 75.41 105.913 170.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.4 67.59 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.111 -1.404 . . . . 54.03 108.044 175.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.495 HG21 ' HB3' ' A' ' 68' ' ' GLN . 98.7 m -64.93 -34.43 78.38 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.356 -0.838 . . . . 52.45 110.087 177.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.642 ' HD1' HG23 ' A' ' 95' ' ' VAL . 33.1 t-105 -66.56 -39.52 88.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.503 -0.554 . . . . 73.43 109.503 179.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.778 ' HA ' HG21 ' A' ' 95' ' ' VAL . 84.3 mttt -57.17 -52.0 67.06 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 122.874 0.469 . . . . 74.41 111.084 174.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.6 m -58.09 -41.82 84.31 Favored 'General case' 0 N--CA 1.411 -2.383 0 CA-C-O 121.791 0.805 . . . . 62.41 110.13 178.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -61.12 -49.96 75.16 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 114.497 -1.229 . . . . 74.12 111.567 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.538 HG21 ' O ' ' A' ' 91' ' ' GLU . 49.1 mm -68.15 -31.38 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 119.676 -0.809 . . . . 65.13 112.01 -175.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -62.04 -37.47 85.04 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.195 0.521 . . . . 73.21 109.745 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.21 -35.92 47.9 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.426 -0.51 . . . . 75.51 111.733 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -53.02 -54.88 28.77 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 124.657 1.183 . . . . 75.1 109.004 178.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 14.8 p -68.34 -36.82 79.82 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.839 -0.618 . . . . 63.2 112.605 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.66 -54.43 7.44 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.932 -0.576 . . . . 54.13 112.029 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -76.31 -21.31 56.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.93 1.085 . . . . 75.13 113.93 -172.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.33 19.21 2.83 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 112.21 0.448 . . . . 72.12 112.21 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 72.94 -63.33 0.44 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.478 1.511 . . . . 75.25 112.65 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.5 m -72.63 120.69 82.04 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-O 121.115 0.483 . . . . 74.34 112.087 -176.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -72.1 117.38 5.11 Favored 'Trans proline' 0 N--CA 1.44 -1.652 0 C-N-CA 121.813 1.675 . . . . 55.24 109.719 177.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.5 mt -79.97 -28.94 39.5 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 116.231 -0.44 . . . . 75.2 110.231 -178.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.9 t70 71.66 -44.47 0.59 Allowed 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 126.116 1.766 . . . . 74.3 111.301 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.489 ' O ' HD23 ' A' ' 94' ' ' LEU . 67.8 mtt -84.22 47.92 1.41 Allowed 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 125.192 1.397 . . . . 72.13 110.273 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.538 ' O ' HG21 ' A' ' 77' ' ' ILE . 10.7 pt-20 -70.68 -35.63 72.91 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.254 0.55 . . . . 74.42 111.147 -178.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.778 ' HA ' HG12 ' A' ' 95' ' ' VAL . 24.4 mm -63.96 -47.8 79.61 Favored Pre-proline 0 C--O 1.184 -2.354 0 CA-C-O 118.292 -0.861 . . . . 60.12 111.028 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.463 ' HD2' ' C ' ' A' ' 90' ' ' MET . 25.4 Cg_exo -48.76 -37.41 35.44 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 122.098 1.865 . . . . 73.13 112.176 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.529 ' HA ' HD21 ' A' ' 18' ' ' LEU . 4.5 mm? -67.51 -36.42 81.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.193 0.597 . . . . 74.35 111.287 175.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.778 HG21 ' HA ' ' A' ' 74' ' ' LYS . 7.5 p -84.58 -32.69 7.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-O 122.178 0.99 . . . . 71.24 113.026 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.5 t -63.13 -6.5 4.28 Favored 'General case' 0 C--N 1.271 -2.845 0 CA-C-N 113.935 -1.484 . . . . 73.55 112.427 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.414 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 13.8 tt -71.63 -17.36 19.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-O 121.829 0.823 . . . . 53.32 109.654 177.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.43 -1.469 0 N-CA-C 104.899 -2.26 . . . . 70.2 104.899 175.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.538 ' SD ' HD12 ' A' ' 92' ' ' ILE . 47.8 tpp . . . . . 0 CA--C 1.551 0.99 0 CA-C-O 122.57 1.176 . . . . 74.41 110.005 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . 0.455 ' O ' HD13 ' A' ' 11' ' ' ILE . 52.4 m-20 -118.88 24.76 10.65 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-N 114.157 -1.383 . . . . 75.02 108.524 177.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.52 -19.74 52.26 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.935 -0.765 . . . . 45.4 108.935 175.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.476 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -53.66 -45.5 70.28 Favored 'General case' 0 C--O 1.207 -1.148 0 N-CA-C 114.735 1.383 . . . . 75.41 114.735 -177.248 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . 0.539 ' HB2' HD12 ' A' ' 11' ' ' ILE . 73.0 m -65.24 -35.91 82.51 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-O 121.74 0.781 . . . . 72.44 111.895 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.539 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.4 -41.06 14.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 C-N-CA 124.383 1.073 . . . . 55.55 111.852 -172.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmm180 -103.18 7.89 38.59 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.846 0.858 . . . . 72.43 112.008 -172.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -43.78 126.43 4.65 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.571 1.322 . . . . 71.33 114.571 -173.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -152.36 132.07 13.17 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 103.642 -2.725 . . . . 70.35 103.642 174.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -118.84 -61.37 1.66 Allowed 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.667 -0.813 . . . . 63.41 112.841 -174.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -71.11 -48.4 52.43 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.349 0.499 . . . . 62.14 112.349 -171.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -66.1 -35.83 81.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.871 0.844 . . . . 51.22 109.557 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -70.43 -42.32 71.72 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 114.304 -1.316 . . . . 74.12 110.051 -178.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -60.0 -51.37 69.95 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.575 -0.528 . . . . 72.32 109.575 175.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -57.71 -48.54 79.28 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.79 -0.641 . . . . 73.11 111.119 -178.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.693 ' CH2' ' HB2' ' A' ' 25' ' ' LEU . 7.7 t-105 -56.25 -50.91 69.98 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 123.252 0.345 . . . . 72.13 111.276 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.89 -42.73 94.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 110.358 -0.238 . . . . 63.43 110.358 -176.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.41 -46.04 97.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.248 -0.433 . . . . 65.34 110.787 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.594 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 67.0 mtt180 -62.85 -48.17 80.18 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 109.786 -0.45 . . . . 73.02 109.786 178.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.693 ' HB2' ' CH2' ' A' ' 21' ' ' TRP . 30.1 tp -55.45 -48.56 74.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.693 1.197 . . . . 72.44 111.705 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.582 HD13 HD23 ' A' ' 33' ' ' LEU . 9.8 mt -73.65 -23.98 59.93 Favored 'General case' 0 C--N 1.281 -2.393 0 CA-C-N 115.475 -0.784 . . . . 63.42 112.73 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.6 t -75.22 -16.93 60.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 107.735 -1.209 . . . . 62.2 107.735 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.594 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 39.1 mtmt -90.61 -13.81 33.65 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.361 -0.607 . . . . 64.23 109.361 174.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.482 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.0 m-80 -137.34 49.48 2.84 Favored Pre-proline 0 C--O 1.241 0.657 0 CA-C-N 115.489 -0.778 . . . . 65.01 112.187 -175.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.482 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.1 Cg_exo -71.33 -20.79 27.41 Favored 'Trans proline' 0 C--N 1.362 1.265 0 N-CA-C 108.522 -1.376 . . . . 65.15 108.522 -178.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.14 -39.45 78.83 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 113.851 -1.522 . . . . 74.42 109.839 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.559 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 61.4 t90 -74.08 -40.13 62.97 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 118.872 -1.131 . . . . 74.02 109.136 178.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.582 HD23 HD13 ' A' ' 26' ' ' LEU . 1.4 tm? -62.84 -39.86 95.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 114.674 -1.148 . . . . 75.5 109.783 -175.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.502 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 65.9 m -53.28 -49.53 66.75 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 123.468 0.48 . . . . 74.33 111.024 175.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.46 -46.09 73.25 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.332 1.053 . . . . 64.52 112.002 177.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.424 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 67.5 mmtt -68.6 -35.33 77.18 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 121.054 -0.258 . . . . 74.41 111.433 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.9 mt -60.24 -34.31 73.51 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 122.333 -0.229 . . . . 61.04 110.523 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . 0.502 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -61.75 -35.93 79.54 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.635 0.731 . . . . 63.11 110.264 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.1 m -78.69 -28.52 45.23 Favored 'General case' 0 N--CA 1.402 -2.856 0 C-N-CA 125.362 1.465 . . . . 73.41 113.055 -177.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.602 ' CD1' HG23 ' A' ' 72' ' ' THR . 61.4 m-85 -102.44 -45.8 4.97 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.75 1.019 . . . . 54.42 113.75 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.0 125.53 70.28 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 114.359 1.244 . . . . 74.34 114.359 -173.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.64 -0.3 5.83 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 122.555 2.17 . . . . 53.25 108.396 166.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 p -106.89 17.48 23.06 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 126.297 1.839 . . . . 52.35 109.902 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.24 92.07 0.04 OUTLIER 'General case' 0 N--CA 1.41 -2.459 0 CA-C-N 114.168 -1.378 . . . . 73.24 111.269 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -129.47 56.6 1.7 Allowed 'General case' 0 CA--C 1.484 -1.588 0 N-CA-C 102.811 -3.033 . . . . 72.1 102.811 169.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 pp -90.2 -18.4 25.8 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.484 -1.689 . . . . 52.25 110.051 -171.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.94 -19.88 64.19 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 114.729 -1.123 . . . . 55.33 109.833 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 49.2 t -100.85 107.78 19.4 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.504 -1.225 . . . . 74.33 107.762 177.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.4 m -133.28 117.39 17.31 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.677 0.751 . . . . 73.34 110.799 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.97 -15.04 62.98 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.5 -1.227 . . . . 73.13 114.028 -178.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -137.0 165.86 31.62 Favored Pre-proline 0 N--CA 1.382 -3.848 0 N-CA-C 107.423 -1.325 . . . . 64.42 107.423 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.67 -149.51 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.241 1.961 . . . . 73.43 110.737 175.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.2 m -76.2 37.9 0.17 Allowed 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.019 0.928 . . . . 61.13 112.61 -176.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.41 ' HB2' HG23 ' A' ' 57' ' ' VAL . 80.3 m-20 -63.69 153.01 84.96 Favored Pre-proline 0 N--CA 1.448 -0.562 0 C-N-CA 123.968 0.907 . . . . 74.12 112.196 -177.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.79 -44.56 43.98 Favored 'Trans proline' 0 C--N 1.363 1.301 0 C-N-CA 123.828 3.019 . . . . 65.31 113.341 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -73.92 -23.1 59.49 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 112.301 0.482 . . . . 71.44 112.301 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 91.6 t -75.59 -36.87 35.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.093 -1.077 . . . . 71.4 108.093 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 mm -64.53 -45.59 95.16 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.036 -1.098 . . . . 72.21 108.036 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -54.16 -42.7 69.89 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.011 0.924 . . . . 74.4 110.462 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.639 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 36.2 ttt180 -54.5 -49.11 70.93 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.583 1.553 . . . . 73.34 110.831 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 90.4 mt-30 -64.58 -48.71 73.96 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.298 -0.865 . . . . 74.23 111.173 -177.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.514 HD12 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -72.13 -30.55 65.17 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.86 -1.064 . . . . 64.14 111.546 -175.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -53.35 -50.5 64.9 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 124.382 1.073 . . . . 71.43 111.01 175.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -54.92 -32.28 61.05 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.007 -1.451 . . . . 62.43 112.831 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.7 mt -72.18 -43.46 64.51 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.559 -0.291 . . . . 52.13 111.019 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . 0.52 ' CE1' ' HG2' ' A' ' 70' ' ' MET . 78.1 t80 -68.04 -30.21 69.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.768 -0.827 . . . . 70.04 108.768 177.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.56 68.73 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.038 -0.983 . . . . 42.12 110.777 176.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.44 ' HB2' HG21 ' A' ' 72' ' ' THR . 10.3 mm-40 -70.93 -55.43 8.4 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 108.748 -0.834 . . . . 72.34 108.748 174.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.63 145.97 9.13 Favored Glycine 0 CA--C 1.476 -2.364 0 CA-C-N 115.147 -0.933 . . . . 64.25 112.016 -175.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.52 ' HG2' ' CE1' ' A' ' 66' ' ' PHE . 66.3 mtm -70.52 -27.97 64.58 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 105.51 -2.033 . . . . 72.12 105.51 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . 0.504 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . . . -74.13 -39.4 63.35 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.342 -1.754 . . . . 72.54 108.719 175.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.602 HG23 ' CD1' ' A' ' 40' ' ' PHE . 66.8 m -58.87 -42.05 88.53 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.693 -0.685 . . . . 75.11 109.286 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.532 ' HD1' HG23 ' A' ' 95' ' ' VAL . 70.4 t-105 -65.88 -40.51 91.65 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 116.307 -0.406 . . . . 70.44 111.556 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.713 ' CB ' HG21 ' A' ' 95' ' ' VAL . 14.7 ptpt -67.93 -41.89 81.86 Favored 'General case' 0 CA--C 1.506 -0.72 0 O-C-N 121.518 -0.739 . . . . 71.23 112.22 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.3 m -63.69 -37.15 86.27 Favored 'General case' 0 N--CA 1.406 -2.674 0 CA-C-N 115.332 -0.849 . . . . 73.51 110.171 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.41 -50.72 71.7 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.174 -0.921 . . . . 71.13 111.557 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.511 HG21 ' O ' ' A' ' 91' ' ' GLU . 47.3 mm -62.55 -32.12 54.29 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.407 0.622 . . . . 64.55 111.013 -176.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -57.61 -45.75 84.94 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.826 -1.079 . . . . 70.42 110.151 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 10.5 m-20 -78.19 -38.42 43.37 Favored 'General case' 0 C--O 1.21 -0.974 0 CA-C-N 116.407 -0.36 . . . . 72.54 111.408 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.559 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.2 tm? -50.07 -55.01 16.57 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 125.492 1.517 . . . . 74.22 110.552 -178.698 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . 0.434 ' SG ' ' HG3' ' A' ' 91' ' ' GLU . 51.3 m -67.83 -32.68 73.39 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.893 -0.594 . . . . 73.44 111.701 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -70.73 -51.51 26.82 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.61 -0.723 . . . . 73.32 111.163 -177.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 13.4 mt-10 -79.23 -17.43 54.8 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 112.98 0.733 . . . . 61.24 112.98 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.4 11.11 22.54 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.168 0.509 . . . . 54.43 111.431 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 69.62 -59.71 0.49 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.142 1.534 . . . . 53.24 115.142 172.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 31.1 m -70.29 132.53 87.87 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 112.343 0.497 . . . . 63.13 112.343 -175.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 86' ' ' VAL . 17.3 Cg_exo -68.11 109.4 1.95 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.468 2.112 . . . . 71.24 109.252 175.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.5 mt -79.75 -44.17 21.21 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 116.503 -0.317 . . . . 74.34 111.435 -174.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 26.0 t0 71.18 161.99 0.24 Allowed 'General case' 0 C--O 1.243 0.76 0 C-N-CA 125.259 1.424 . . . . 74.43 109.945 -175.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 65.86 23.22 11.36 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.572 -0.529 . . . . 53.01 109.572 -171.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.629 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 33.4 tt0 -56.28 -37.75 70.25 Favored 'General case' 0 C--O 1.21 -0.992 0 C-N-CA 125.641 1.576 . . . . 71.25 111.359 -177.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.553 ' HA ' HG12 ' A' ' 95' ' ' VAL . 38.5 mm -72.16 -48.78 10.18 Favored Pre-proline 0 C--N 1.274 -2.705 0 O-C-N 120.983 -1.073 . . . . 73.33 109.996 178.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.476 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 68.1 Cg_exo -51.35 -29.9 32.19 Favored 'Trans proline' 0 CA--C 1.563 1.928 0 C-N-CA 121.311 1.341 . . . . 73.22 111.844 166.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.629 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 9.2 mp -59.63 -36.5 76.47 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.835 -0.432 . . . . 62.25 109.835 171.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.713 HG21 ' CB ' ' A' ' 74' ' ' LYS . 3.7 p -85.88 -41.63 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-O 122.375 1.083 . . . . 54.34 113.246 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.2 m -71.4 7.17 1.45 Allowed 'General case' 0 C--N 1.246 -3.904 0 C-N-CA 125.189 1.396 . . . . 65.44 113.845 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 15.1 tt -73.34 -17.9 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 N-CA-C 114.193 1.183 . . . . 75.5 114.193 -172.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 96.0 m95 . . . . . 0 C--N 1.315 -0.915 0 N-CA-C 114.738 1.385 . . . . 74.4 114.738 -174.13 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' MET . . . . . 0.403 ' HG3' HD11 ' A' ' 92' ' ' ILE . 22.5 ttt . . . . . 0 C--O 1.22 -0.487 0 CA-C-O 122.005 0.907 . . . . 63.21 109.698 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -91.29 25.83 2.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.267 -0.879 . . . . 71.43 109.926 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . 0.423 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -76.7 -10.35 59.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.937 -1.029 . . . . 52.02 108.882 173.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . 0.615 ' OE2' ' HE2' ' A' ' 74' ' ' LYS . 6.1 pt-20 -58.64 -38.68 78.62 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.241 -0.891 . . . . 74.4 109.697 175.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 50.0 m -57.78 -26.73 62.33 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.226 1.41 . . . . 71.44 111.165 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ILE . . . . . 0.423 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -88.04 -27.59 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.471 -1.241 . . . . 74.21 110.66 -176.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -82.55 -66.82 0.84 Allowed 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.793 1.034 . . . . 73.11 113.793 -172.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 43.99 -172.19 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.508 1.67 . . . . 71.11 115.508 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.9 t30 40.19 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 126.679 1.992 . . . . 74.4 115.843 171.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -179.48 108.24 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.57 0.7 . . . . 75.24 110.356 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -71.98 -28.42 63.4 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 124.636 1.174 . . . . 61.45 112.526 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -58.6 -27.6 64.8 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.782 0.66 . . . . 63.32 112.782 -174.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.48 ' HB2' HD12 ' A' ' 97' ' ' ILE . 3.1 mm? -64.32 -36.3 83.68 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 121.099 -0.24 . . . . 73.44 110.519 176.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TRP . . . . . 0.514 ' HB2' HD11 ' A' ' 97' ' ' ILE . 74.7 t-105 -69.63 -49.58 52.54 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.128 -0.487 . . . . 75.44 110.219 -176.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.27 -39.75 91.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.136 -0.484 . . . . 61.12 110.813 179.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TRP . . . . . 0.502 ' HE1' ' HG ' ' A' ' 88' ' ' LEU . 13.6 t-105 -60.85 -50.32 73.89 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.202 -0.454 . . . . 74.25 110.306 176.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -57.63 -53.07 62.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 124.073 0.858 . . . . 70.34 109.418 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.1 t -58.41 -47.36 88.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.873 -0.603 . . . . 60.13 112.227 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.489 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 74.7 mtp180 -69.18 -44.42 72.22 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 112.163 0.431 . . . . 63.4 112.163 -176.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.476 HD12 HD13 ' A' ' 84' ' ' LEU . 1.8 tm? -67.57 -39.84 84.9 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.199 -0.667 . . . . 75.23 109.199 -176.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 4.7 mt -73.9 -25.1 59.83 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.165 -0.471 . . . . 75.41 112.233 177.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -67.02 -20.99 65.95 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.176 -1.046 . . . . 64.42 108.176 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 33.5 mtmt -91.79 -15.21 28.61 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.548 0.69 . . . . 62.34 109.716 177.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.447 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -129.84 51.86 8.28 Favored Pre-proline 0 C--O 1.241 0.647 0 CA-C-N 115.375 -0.829 . . . . 61.41 112.683 -175.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.447 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.8 Cg_exo -68.56 -20.66 40.88 Favored 'Trans proline' 0 C--N 1.365 1.416 0 N-CA-C 108.546 -1.367 . . . . 64.32 108.546 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -63.25 -43.21 98.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 113.187 -1.824 . . . . 75.32 109.549 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TRP . . . . . 0.458 ' HE1' ' HG3' ' A' ' 83' ' ' GLU . 67.8 t90 -76.02 -47.7 23.82 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 121.943 0.878 . . . . 65.54 110.419 176.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.488 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.3 tm? -58.89 -44.29 91.12 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.181 -1.372 . . . . 62.35 112.221 -172.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.7 p -52.76 -54.15 37.98 Favored 'General case' 0 C--N 1.316 -0.879 0 O-C-N 123.54 0.525 . . . . 64.22 111.67 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.24 -45.49 76.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.108 1.363 . . . . 72.41 111.703 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -64.6 -43.9 92.32 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 112.511 0.56 . . . . 74.52 112.511 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.578 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 77.2 mt -55.54 -39.68 70.87 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 123.382 0.426 . . . . 72.14 111.135 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -62.29 -26.23 68.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.387 0.613 . . . . 73.03 112.224 -178.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.6 t -83.52 -22.26 32.51 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.693 -0.685 . . . . 54.52 110.311 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' PHE . . . . . 0.458 ' CD1' HG23 ' A' ' 72' ' ' THR . 48.4 m-85 -98.05 -57.42 2.22 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.281 -0.418 . . . . 64.23 111.784 -178.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.561 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.4 mm? -85.34 113.19 49.14 Favored Pre-proline 0 N--CA 1.423 -1.778 0 N-CA-C 109.009 -0.737 . . . . 74.31 109.009 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.17 -33.38 72.56 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.276 2.651 . . . . 72.41 115.532 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.49 28.22 8.9 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 121.912 0.863 . . . . 61.2 112.525 -176.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' A' ' 37' ' ' LEU . 23.2 ttm -89.25 106.55 18.51 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 115.275 1.583 . . . . 75.24 115.275 -175.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -111.78 79.23 1.19 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.214 -2.143 . . . . 50.14 105.214 169.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.19 -2.0 57.96 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.145 -0.934 . . . . 41.44 111.727 -173.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -78.39 45.84 0.59 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 122.818 1.294 . . . . 73.0 112.678 -174.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -117.04 97.92 6.19 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 107.118 -1.438 . . . . 63.15 107.118 174.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.2 m -81.86 83.72 7.11 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-O 121.86 0.838 . . . . 74.12 112.053 -175.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.74 -33.55 58.11 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-O 122.529 1.157 . . . . 65.2 110.837 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -137.48 167.51 20.32 Favored Pre-proline 0 N--CA 1.384 -3.769 0 C-N-CA 126.695 1.998 . . . . 72.14 106.501 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -81.93 -148.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 122.001 1.801 . . . . 72.32 110.664 174.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.4 m -76.26 37.28 0.16 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 124.291 1.036 . . . . 73.22 111.776 -176.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASN . . . . . 0.483 ' HB2' HG23 ' A' ' 57' ' ' VAL . 76.5 m-20 -64.18 148.25 95.85 Favored Pre-proline 0 N--CA 1.44 -0.975 0 C-N-CA 123.605 0.762 . . . . 73.31 112.983 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -58.31 -35.12 99.04 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 123.479 2.786 . . . . 65.41 112.68 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -72.6 -31.27 65.05 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.171 0.51 . . . . 71.4 109.96 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.483 HG23 ' HB2' ' A' ' 54' ' ' ASN . 94.6 t -67.8 -52.03 44.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.347 -0.983 . . . . 73.41 108.347 177.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 47.1 mm -55.06 -43.45 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 114.478 -1.237 . . . . 72.31 109.849 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -58.71 -40.53 83.98 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.133 -0.94 . . . . 72.34 111.039 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.416 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 37.0 ttt180 -64.81 -37.55 88.01 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.681 0.753 . . . . 72.52 110.554 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.451 ' O ' ' HB2' ' A' ' 64' ' ' ARG . 94.5 mt-30 -72.66 -48.68 37.29 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 114.492 -1.231 . . . . 72.34 111.525 -176.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -67.36 -30.61 70.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 115.269 -0.878 . . . . 62.34 110.885 -178.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ASN . . . . . 0.416 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 3.5 t-20 -54.06 -46.08 71.86 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.658 1.183 . . . . 74.23 110.222 174.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ARG . . . . . 0.561 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 26.1 mmt180 -56.39 -36.65 69.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 114.626 -1.17 . . . . 62.35 112.594 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LEU . . . . . 0.511 HD12 HD13 ' A' ' 62' ' ' LEU . 97.8 mt -71.04 -31.0 67.34 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.7 0.259 . . . . 62.12 111.7 -177.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -59.32 -35.74 74.37 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.055 -0.72 . . . . 74.2 109.055 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.82 -27.41 60.28 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 115.072 -0.967 . . . . 73.21 112.103 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.419 ' CB ' HG21 ' A' ' 72' ' ' THR . 5.1 mm-40 -70.66 -52.7 19.47 Favored 'General case' 0 N--CA 1.423 -1.778 0 C-N-CA 120.824 -0.35 . . . . 63.11 111.36 -179.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.42 143.75 5.32 Favored Glycine 0 CA--C 1.477 -2.319 0 C-N-CA 118.835 -1.65 . . . . 61.44 114.537 -173.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.418 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.2 ptm -67.38 -30.67 70.51 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.887 -1.523 . . . . 71.2 106.887 168.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.7 -37.37 59.54 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 114.36 -1.291 . . . . 40.43 108.538 177.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' THR . . . . . 0.458 HG23 ' CD1' ' A' ' 40' ' ' PHE . 86.6 m -62.19 -38.73 90.21 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 114.912 -1.04 . . . . 65.14 111.089 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' TRP . . . . . 0.518 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 39.8 t-105 -68.25 -36.06 78.86 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.491 -0.559 . . . . 71.15 109.491 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . 0.615 ' HE2' ' OE2' ' A' ' 9' ' ' GLU . 85.5 mttt -58.17 -52.27 66.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 120.763 0.316 . . . . 74.4 110.199 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -60.34 -38.48 83.91 Favored 'General case' 0 N--CA 1.405 -2.688 0 CA-C-N 115.433 -0.803 . . . . 72.21 111.136 179.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -61.14 -50.58 72.63 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-N 115.112 -0.949 . . . . 74.51 110.798 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ILE . . . . . 0.509 HG21 ' O ' ' A' ' 91' ' ' GLU . 46.5 mm -70.15 -30.89 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.627 -0.829 . . . . 53.03 110.573 -177.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.84 -47.47 82.59 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.376 -0.829 . . . . 74.31 109.874 176.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -73.28 -37.25 66.32 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.951 -0.568 . . . . 74.32 111.239 177.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LEU . . . . . 0.417 HD12 HD21 ' A' ' 88' ' ' LEU . 1.9 tm? -50.45 -54.27 23.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.846 1.259 . . . . 74.31 109.449 178.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.6 m -66.71 -44.4 81.76 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.687 -0.688 . . . . 65.13 111.347 -178.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -61.62 -54.24 45.59 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.291 0.567 . . . . 65.42 111.097 -175.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . 0.458 ' HG3' ' HE1' ' A' ' 32' ' ' TRP . 22.5 mm-40 -70.21 -40.62 74.43 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.173 -0.921 . . . . 74.41 113.485 -175.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.476 HD13 HD12 ' A' ' 25' ' ' LEU . 82.6 mt -80.32 -39.8 27.98 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 120.011 -0.676 . . . . 53.35 112.63 -174.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -169.2 -96.62 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.03 0.377 . . . . 65.13 110.821 179.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . 0.492 ' HB ' ' HD2' ' A' ' 87' ' ' PRO . 34.8 m -141.04 173.28 5.04 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 104.945 -2.243 . . . . 63.14 104.945 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.492 ' HD2' ' HB ' ' A' ' 86' ' ' VAL . 5.6 Cg_endo -50.89 105.48 0.1 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 121.859 1.706 . . . . 71.21 110.3 171.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LEU . . . . . 0.588 HD22 ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -50.39 -53.3 30.28 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 125.314 1.446 . . . . 74.32 111.227 -172.446 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -154.2 48.81 0.62 Allowed 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 104.344 -2.465 . . . . 50.11 104.344 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' MET . . . . . 0.518 ' O ' HD23 ' A' ' 94' ' ' LEU . 65.7 mtt 74.31 146.14 0.08 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.655 -2.066 . . . . 71.34 109.84 -170.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLU . . . . . 0.509 ' O ' HG21 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -71.73 -35.18 70.08 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.273 1.035 . . . . 73.41 110.817 178.107 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.684 ' HA ' HG12 ' A' ' 95' ' ' VAL . 31.3 mm -59.42 -49.8 90.58 Favored Pre-proline 0 C--N 1.279 -2.487 0 CA-C-N 114.353 -1.294 . . . . 74.33 114.043 -172.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . 0.407 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 74.8 Cg_exo -54.85 -35.46 88.78 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.211 1.941 . . . . 74.51 111.259 174.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 90' ' ' MET . 4.0 mm? -71.42 -33.6 69.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.845 -1.07 . . . . 63.42 110.916 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' VAL . . . . . 0.684 HG12 ' HA ' ' A' ' 92' ' ' ILE . 4.3 p -83.59 -33.63 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 C-N-CA 119.355 -0.938 . . . . 71.24 112.3 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.3 t -55.71 -26.39 44.98 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 113.768 -1.56 . . . . 54.14 112.068 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.514 HD11 ' HB2' ' A' ' 19' ' ' TRP . 12.0 tt -69.02 -30.38 46.45 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.096 0 CA-C-N 116.505 -0.316 . . . . 45.35 110.59 -177.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 16.7 t90 . . . . . 0 C--O 1.244 0.812 0 C-N-CA 127.265 2.226 . . . . 72.42 116.019 -177.172 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.506 -0.513 0 N-CA-C 111.002 -0.839 . . . . 74.44 111.002 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 12.0 Cg_exo -71.67 126.91 12.52 Favored 'Trans proline' 0 C--O 1.237 0.436 0 C-N-CA 122.909 2.406 . . . . 52.04 110.541 178.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 81.7 mt -115.27 123.18 48.12 Favored 'General case' 0 C--N 1.29 -1.988 0 N-CA-C 109.611 -0.514 . . . . 71.01 109.611 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -70.73 -42.65 61.48 Favored Glycine 0 N--CA 1.44 -1.044 0 N-CA-C 109.891 -1.283 . . . . 52.41 109.891 177.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 33.8 p -119.84 177.56 4.92 Favored 'General case' 0 N--CA 1.429 -1.517 0 N-CA-C 108.548 -0.908 . . . . 42.15 108.548 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.41 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 42.8 tpp -115.33 9.77 15.72 Favored 'General case' 0 C--N 1.311 -1.081 0 CA-C-O 122.065 0.936 . . . . 73.2 108.98 -178.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -74.8 24.85 0.09 Allowed 'General case' 0 C--N 1.311 -1.084 0 N-CA-C 114.338 1.236 . . . . 75.41 114.338 -174.511 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.429 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.2 -15.1 59.63 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-O 122.411 1.1 . . . . 51.51 109.588 178.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 96' ' ' SER . 1.1 pt-20 -65.35 -41.71 93.57 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 113.808 -1.542 . . . . 71.22 111.52 -178.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 12.2 m -74.89 -17.23 60.61 Favored 'General case' 0 C--N 1.295 -1.785 0 CA-C-N 115.448 -0.797 . . . . 70.43 109.857 -177.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.429 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.9 mm -87.48 -50.67 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.849 0 CA-C-O 122.138 0.971 . . . . 60.3 108.887 -176.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.3 mmt180 -84.72 6.7 23.2 Favored 'General case' 0 C--N 1.316 -0.86 0 CA-C-N 113.911 -1.495 . . . . 72.13 113.148 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -44.14 122.53 2.96 Favored 'General case' 0 C--N 1.313 -0.996 0 C-N-CA 124.902 1.281 . . . . 71.55 112.798 -177.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.407 ' OD1' ' HG ' ' A' ' 18' ' ' LEU . 28.0 t-20 -162.86 150.73 13.73 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 104.559 -2.385 . . . . 71.32 104.559 176.096 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . 0.28 21.8 p30 -145.72 -44.5 0.21 Allowed 'General case' 0 C--N 1.306 -1.312 0 N-CA-C 115.562 1.69 . . . . 73.24 115.562 -179.654 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.52 -46.32 90.47 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-N 119.201 0.91 . . . . 71.32 111.833 -178.03 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -67.29 -44.23 79.78 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.985 -0.552 . . . . 74.03 109.832 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.407 ' HG ' ' OD1' ' A' ' 14' ' ' ASN . 89.5 mt -66.07 -39.54 90.16 Favored 'General case' 0 C--O 1.218 -0.572 0 CA-C-N 115.375 -0.829 . . . . 73.32 111.58 -177.669 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 73.0 t-105 -65.42 -43.84 89.29 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 110.274 -0.269 . . . . 75.35 110.274 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.98 -44.36 96.25 Favored 'General case' 0 C--O 1.243 0.746 0 CA-C-O 120.863 0.363 . . . . 72.34 110.666 -179.6 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 17.9 t-105 -60.45 -48.59 81.1 Favored 'General case' 0 C--O 1.244 0.781 0 CA-C-N 115.587 -0.733 . . . . 75.31 110.583 175.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.463 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 33.9 tp -58.4 -53.04 62.81 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.675 -0.693 . . . . 73.4 109.862 -179.137 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 46.9 t -53.85 -46.09 63.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.367 0 C-N-CA 123.528 0.731 . . . . 64.13 112.441 -179.167 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.552 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 3.9 mmp_? -72.4 -43.39 63.97 Favored 'General case' 0 C--O 1.215 -0.753 0 C-N-CA 120.18 -0.608 . . . . 72.53 112.396 -177.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.426 HD12 HD13 ' A' ' 84' ' ' LEU . 2.1 tm? -68.21 -42.34 80.0 Favored 'General case' 0 C--N 1.312 -1.052 0 CA-C-O 121.047 0.451 . . . . 62.32 109.81 -176.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.677 HD13 HD21 ' A' ' 33' ' ' LEU . 1.2 mt -68.56 -25.75 65.06 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 122.854 0.461 . . . . 72.42 110.936 178.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 45.4 t -71.56 -18.53 62.24 Favored 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 108.99 -0.744 . . . . 75.32 108.99 177.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.552 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.32 -2.29 52.44 Favored 'General case' 0 N--CA 1.43 -1.433 0 CA-C-O 121.725 0.774 . . . . 74.44 109.489 178.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.428 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.4 m-80 -137.92 50.21 3.11 Favored Pre-proline 0 C--N 1.325 -0.483 0 CA-C-N 115.165 -0.925 . . . . 73.11 111.78 -177.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.428 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.2 Cg_exo -65.62 -23.98 56.13 Favored 'Trans proline' 0 C--N 1.368 1.601 0 C-N-CA 121.604 1.536 . . . . 65.2 109.197 -176.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -66.1 -39.58 90.09 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 112.997 -1.911 . . . . 71.13 111.095 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.803 ' HE3' HD22 ' A' ' 33' ' ' LEU . 84.4 t90 -76.06 -44.73 37.64 Favored 'General case' 0 CA--C 1.482 -1.667 0 N-CA-C 107.492 -1.299 . . . . 75.24 107.492 -175.157 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.803 HD22 ' HE3' ' A' ' 32' ' ' TRP . 3.5 mm? -53.4 -56.96 12.51 Favored 'General case' 0 N--CA 1.407 -2.601 0 CA-C-N 113.015 -1.902 . . . . 64.52 113.61 -178.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.552 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 3.4 p -53.74 -44.64 70.11 Favored 'General case' 0 C--O 1.211 -0.948 0 O-C-N 123.927 0.767 . . . . 63.31 111.133 -177.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -59.04 -50.92 72.23 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.673 1.589 . . . . 41.12 111.22 179.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.51 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.1 mmmt -69.28 -35.79 76.41 Favored 'General case' 0 CA--C 1.5 -0.95 0 CA-C-N 115.956 -0.565 . . . . 72.51 111.691 179.681 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.649 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 97.2 mt -60.61 -30.97 70.18 Favored 'General case' 0 N--CA 1.43 -1.458 0 O-C-N 123.09 0.244 . . . . 52.34 110.817 178.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.552 ' HG3' ' O ' ' A' ' 34' ' ' SER . 10.3 mtp180 -66.85 -26.75 67.06 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 121.328 0.585 . . . . 73.55 111.906 -178.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 48.0 t -78.4 -38.01 42.65 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.716 -0.674 . . . . 74.52 109.434 179.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.493 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 86.5 m-85 -80.31 -59.47 2.69 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.676 -0.693 . . . . 75.0 111.404 -179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.5 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.1 mm? -89.33 110.89 42.04 Favored Pre-proline 0 N--CA 1.432 -1.35 0 N-CA-C 109.269 -0.641 . . . . 63.22 109.269 -179.207 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -70.85 -19.65 30.64 Favored 'Trans proline' 0 CA--C 1.53 0.281 0 C-N-CA 122.218 1.945 . . . . 73.23 111.851 -177.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 25.2 p -114.13 28.58 8.65 Favored 'General case' 0 C--N 1.303 -1.416 0 CA-C-N 115.086 -0.961 . . . . 71.42 109.935 -177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.844 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.0 OUTLIER -43.33 99.24 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 O-C-N 124.941 1.4 . . . . 64.02 112.351 -175.432 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -90.09 60.06 4.71 Favored 'General case' 0 C--N 1.288 -2.069 0 CA-C-O 123.088 1.423 . . . . 71.24 108.368 177.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.844 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.4 pp -81.03 -9.78 59.79 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 113.23 -1.805 . . . . 71.44 110.799 -176.234 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.25 -14.16 60.14 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.743 -1.117 . . . . 64.35 110.218 178.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.4 t -85.87 103.79 14.94 Favored 'General case' 0 C--N 1.293 -1.881 0 CA-C-N 115.348 -0.842 . . . . 51.52 108.861 178.469 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 23.1 t -142.13 81.56 1.76 Allowed 'General case' 0 N--CA 1.428 -1.563 0 N-CA-C 107.878 -1.156 . . . . 70.02 107.878 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -64.37 -39.58 94.16 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.84 -1.073 . . . . 73.22 111.743 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -119.25 155.85 53.26 Favored Pre-proline 0 N--CA 1.383 -3.819 0 CA-C-N 113.346 -1.752 . . . . 61.11 106.918 176.02 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_endo -64.16 -145.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.558 1.677 0 C-N-CA 124.013 3.142 . . . . 52.42 112.164 174.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 25.0 m -74.73 38.37 0.12 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 123.864 0.866 . . . . 62.41 113.28 -175.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 57' ' ' VAL . 4.5 m-20 -62.08 149.52 86.18 Favored Pre-proline 0 N--CA 1.435 -1.196 0 C-N-CA 124.417 1.087 . . . . 72.42 110.544 177.565 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -49.45 -46.83 24.85 Favored 'Trans proline' 0 C--N 1.356 0.971 0 C-N-CA 123.613 2.876 . . . . 65.44 113.703 -177.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.1 mm-40 -74.34 -23.77 59.08 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.866 0.691 . . . . 64.35 112.866 -179.495 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.46 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 87.0 t -72.7 -39.51 60.39 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.219 0 N-CA-C 108.289 -1.004 . . . . 70.35 108.289 177.257 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -64.11 -48.01 87.65 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.896 0 N-CA-C 108.136 -1.061 . . . . 72.14 108.136 173.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 23.5 t-160 -52.03 -43.12 63.58 Favored 'General case' 0 C--O 1.214 -0.812 0 C-N-CA 123.93 0.892 . . . . 74.33 110.708 177.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.406 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 65.2 ttt-85 -54.73 -41.37 70.29 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 124.084 0.953 . . . . 61.44 111.897 178.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.46 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.8 mt-30 -73.31 -39.45 65.3 Favored 'General case' 0 C--N 1.299 -1.606 0 CA-C-N 115.225 -0.898 . . . . 71.24 110.509 -175.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -75.29 -31.09 60.59 Favored 'General case' 0 C--N 1.294 -1.81 0 CA-C-N 114.603 -1.18 . . . . 73.34 110.883 179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.406 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 28.6 t-20 -53.89 -47.03 71.52 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.691 1.196 . . . . 73.22 110.602 175.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.5 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 32.2 mmt-85 -53.84 -36.62 62.76 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-N 113.659 -1.61 . . . . 74.21 111.888 178.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 78.3 mt -72.05 -36.68 69.67 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-O 120.95 0.405 . . . . 63.43 111.051 -178.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 75.9 t80 -66.43 -25.21 66.64 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.392 -0.822 . . . . 75.3 109.086 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -75.58 -31.27 59.91 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 115.431 -0.804 . . . . 72.15 110.832 176.271 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 10.1 mm-40 -69.28 -57.17 5.68 Favored 'General case' 0 N--CA 1.429 -1.498 0 CA-C-O 121.436 0.636 . . . . 70.42 109.869 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -172.55 141.66 6.37 Favored Glycine 0 CA--C 1.466 -2.987 0 CA-C-N 115.122 -0.944 . . . . 21.25 111.387 -174.143 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.488 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 1.9 mpt? -70.45 -30.67 67.57 Favored 'General case' 0 C--N 1.29 -1.99 0 N-CA-C 106.318 -1.734 . . . . 74.4 106.318 172.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.93 -29.01 58.19 Favored 'General case' 0 N--CA 1.439 -1.015 0 CA-C-N 113.437 -1.71 . . . . 74.41 108.11 176.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . . . . . . . . . 90.3 m -70.47 -34.03 71.94 Favored 'General case' 0 N--CA 1.442 -0.839 0 CA-C-N 115.241 -0.89 . . . . 62.34 109.421 178.397 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.581 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 69.7 t-105 -63.67 -46.89 83.51 Favored 'General case' 0 N--CA 1.445 -0.719 0 N-CA-C 109.198 -0.668 . . . . 63.5 109.198 175.182 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.488 ' HG3' ' O ' ' A' ' 70' ' ' MET . 82.8 mttt -58.56 -36.0 73.24 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 115.968 -0.56 . . . . 65.45 111.521 177.989 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.43 ' O ' ' HB3' ' A' ' 78' ' ' ASN . 49.0 m -72.7 -47.22 48.97 Favored 'General case' 0 N--CA 1.408 -2.57 0 C-N-CA 123.147 0.579 . . . . 65.4 110.953 177.732 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.493 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 81.4 t80 -55.79 -50.44 70.48 Favored 'General case' 0 CA--C 1.511 -0.551 0 C-N-CA 123.328 0.651 . . . . 55.51 111.73 179.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.637 HG21 ' HB2' ' A' ' 94' ' ' LEU . 41.0 mm -62.87 -30.75 50.26 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-N 115.944 -0.571 . . . . 72.15 111.19 -176.709 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.43 ' HB3' ' O ' ' A' ' 75' ' ' SER . 3.6 t-20 -58.86 -46.51 87.58 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 109.422 -0.584 . . . . 64.1 109.422 175.728 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 80.8 m-20 -73.16 -39.65 65.48 Favored 'General case' 0 C--O 1.198 -1.646 0 CA-C-N 115.487 -0.778 . . . . 70.32 110.445 -179.561 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.428 HD21 HD21 ' A' ' 26' ' ' LEU . 2.3 tm? -50.33 -53.87 25.72 Favored 'General case' 0 C--N 1.309 -1.173 0 C-N-CA 124.776 1.23 . . . . 74.51 109.249 177.617 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 62.6 m -64.98 -36.53 84.69 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.893 -0.594 . . . . 55.31 111.266 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -73.36 -54.2 8.91 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-O 120.98 0.419 . . . . 64.02 111.658 -176.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -74.98 -24.02 58.37 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.641 -0.709 . . . . 73.54 112.298 -172.01 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.426 HD13 HD12 ' A' ' 25' ' ' LEU . 85.4 mt -91.22 4.51 52.1 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.31 -0.556 . . . . 74.2 112.014 179.204 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 10.6 t70 72.12 -46.84 0.65 Allowed 'General case' 0 N--CA 1.501 2.095 0 N-CA-C 114.221 1.193 . . . . 50.05 114.221 174.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.453 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 47.3 t -56.88 126.68 73.04 Favored Pre-proline 0 C--N 1.315 -0.909 0 C-N-CA 124.488 1.115 . . . . 73.12 112.864 -175.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 86' ' ' VAL . 5.3 Cg_endo -86.75 102.09 0.58 Allowed 'Trans proline' 0 N--CA 1.44 -1.64 0 C-N-CA 122.466 2.111 . . . . 60.44 110.426 173.173 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 4.5 mp -69.81 -53.15 19.55 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 116.211 -0.449 . . . . 54.14 109.84 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 24.1 t70 173.96 -50.77 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.557 1.143 . . . . 63.4 107.968 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.9 ttt -177.47 153.12 0.88 Allowed 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 104.89 -2.263 . . . . 53.13 104.89 -178.917 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.547 ' O ' HG13 ' A' ' 95' ' ' VAL . 1.1 pm0 -71.46 -42.37 68.23 Favored 'General case' 0 C--O 1.206 -1.216 0 CA-C-N 118.696 0.68 . . . . 73.32 112.342 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.637 ' O ' HG22 ' A' ' 95' ' ' VAL . 35.1 mm -54.23 -39.39 74.22 Favored Pre-proline 0 CA--C 1.594 2.66 0 C-N-CA 125.486 1.514 . . . . 64.25 114.118 -175.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_exo -52.3 -41.8 64.12 Favored 'Trans proline' 0 N--CA 1.487 1.124 0 C-N-CA 122.126 1.884 . . . . 72.14 111.035 170.503 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.637 ' HB2' HG21 ' A' ' 77' ' ' ILE . 3.7 mm? -76.29 -25.03 54.45 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.756 -1.111 . . . . 75.22 110.128 179.676 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.637 HG22 ' O ' ' A' ' 92' ' ' ILE . 4.6 m -74.62 -29.02 22.74 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.128 0 CA-C-O 122.43 1.11 . . . . 63.04 110.789 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.478 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 6.0 t -81.76 1.18 35.73 Favored 'General case' 0 C--N 1.275 -2.631 0 CA-C-N 113.846 -1.524 . . . . 64.52 111.476 -179.706 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 18.2 tt -57.38 -30.84 36.77 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.228 0 N-CA-C 112.981 0.734 . . . . 73.43 112.981 -173.09 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 24.5 p-90 -92.97 13.71 19.84 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 112.362 0.504 . . . . 74.31 112.362 -177.697 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -80.99 -127.84 0.82 Allowed Glycine 0 N--CA 1.44 -1.081 0 C-N-CA 121.19 -0.529 . . . . 62.41 112.32 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -51.78 130.28 33.45 Favored 'Trans proline' 0 C--N 1.354 0.845 0 C-N-CA 123.434 2.756 . . . . 70.22 112.527 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . 0.297 1.5 ptm180 . . . . . 0 C--O 1.254 1.326 0 C-N-CA 125.754 1.622 . . . . 73.13 113.462 -177.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.411 ' O ' ' HG ' ' A' ' 3' ' ' LEU . . . . . . . . 0 CA--C 1.486 -1.759 0 N-CA-C 108.109 -1.997 . . . . 15.03 108.109 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -56.22 99.35 0.07 OUTLIER 'Trans proline' 0 C--N 1.353 0.799 0 C-N-CA 122.952 2.435 . . . . 74.41 113.95 -174.777 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.411 ' HG ' ' O ' ' A' ' 1' ' ' GLY . 89.0 mt -115.64 -73.59 0.64 Allowed 'General case' 0 N--CA 1.427 -1.597 0 N-CA-C 108.003 -1.11 . . . . 64.52 108.003 178.248 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 80.74 -56.3 4.76 Favored Glycine 0 N--CA 1.442 -0.946 0 CA-C-N 115.922 -0.581 . . . . 31.22 111.925 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.1 m -56.27 129.14 39.09 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 124.165 0.986 . . . . 73.53 110.625 179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 64.9 mtt -75.54 -6.93 52.71 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 112.227 0.455 . . . . 74.34 112.227 179.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -104.24 23.5 12.99 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-O 120.919 0.39 . . . . 72.43 110.08 174.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.444 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -77.95 -17.58 57.04 Favored 'General case' 0 N--CA 1.469 0.491 0 CA-C-O 122.812 1.292 . . . . 73.22 108.857 176.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.546 ' HB2' ' HB2' ' A' ' 96' ' ' SER . 0.8 OUTLIER -59.17 -45.65 90.44 Favored 'General case' 0 C--N 1.294 -1.848 0 CA-C-N 113.178 -1.828 . . . . 74.51 114.088 -177.745 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 65.0 m -76.22 -16.49 59.82 Favored 'General case' 0 C--N 1.304 -1.378 0 CA-C-O 121.311 0.577 . . . . 73.31 110.663 -179.417 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.444 HG12 ' HA ' ' A' ' 8' ' ' ALA . 3.0 mm -82.47 -44.26 19.35 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.467 0 CA-C-O 121.937 0.875 . . . . 64.31 108.938 -176.214 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmt180 -102.19 7.27 40.92 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 114.678 -1.146 . . . . 75.54 111.984 -175.287 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -35.21 122.31 0.58 Allowed 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 126.279 1.831 . . . . 51.31 115.028 -172.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 51.1 t-20 -145.2 151.6 38.67 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 103.479 -2.786 . . . . 74.22 103.479 175.58 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 40.0 t30 -128.7 -72.58 0.6 Allowed 'General case' 0 C--N 1.298 -1.642 0 CA-C-N 118.636 0.653 . . . . 72.43 112.244 -174.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -63.2 -38.21 90.26 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.32 0.859 . . . . 73.41 113.32 -171.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -66.29 -37.84 86.37 Favored 'General case' 0 CA--C 1.505 -0.768 0 CA-C-O 121.886 0.85 . . . . 55.52 110.542 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.421 HD13 HD22 ' A' ' 94' ' ' LEU . 86.4 mt -75.32 -40.79 58.09 Favored 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 114.639 -1.164 . . . . 73.51 110.238 -178.34 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 44.5 t-105 -64.39 -42.07 96.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.045 -0.525 . . . . 75.4 110.49 179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.69 -40.88 93.82 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-N 116.355 -0.384 . . . . 53.31 110.689 178.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.0 t-105 -60.89 -50.55 72.95 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 115.756 -0.656 . . . . 74.12 110.685 176.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -57.82 -53.04 62.65 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 115.505 -0.77 . . . . 43.43 109.287 -178.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 58.5 t -62.32 -42.4 95.29 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.192 0 CA-C-N 115.583 -0.735 . . . . 72.12 112.774 -177.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 20.4 tpt180 -72.62 -41.68 65.28 Favored 'General case' 0 C--N 1.319 -0.745 0 O-C-N 121.93 -0.482 . . . . 74.21 111.411 -177.691 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.572 HD12 HD13 ' A' ' 84' ' ' LEU . 2.0 tm? -69.78 -40.89 75.78 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 109.601 -0.518 . . . . 74.42 109.601 -176.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.491 HD13 HD23 ' A' ' 33' ' ' LEU . 5.9 mt -69.36 -25.13 64.03 Favored 'General case' 0 CA--C 1.494 -1.2 0 N-CA-C 112.398 0.518 . . . . 54.31 112.398 176.738 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.3 t -67.58 -19.67 65.28 Favored 'General case' 0 N--CA 1.442 -0.846 0 N-CA-C 108.677 -0.86 . . . . 52.33 108.677 175.784 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 35.3 mtmt -99.03 -2.1 38.07 Favored 'General case' 0 N--CA 1.432 -1.352 0 CA-C-N 115.635 -0.712 . . . . 65.24 109.491 179.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.418 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.2 m-80 -145.49 52.85 1.7 Allowed Pre-proline 0 C--O 1.243 0.74 0 N-CA-C 112.717 0.636 . . . . 73.24 112.717 -175.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.418 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 15.8 Cg_exo -68.16 -22.83 40.2 Favored 'Trans proline' 0 C--N 1.356 0.926 0 N-CA-C 108.864 -1.245 . . . . 54.31 108.864 179.35 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -65.64 -43.63 88.85 Favored 'General case' 0 N--CA 1.436 -1.154 0 CA-C-N 113.477 -1.692 . . . . 63.12 110.583 179.661 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.593 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.4 t90 -71.6 -43.18 66.71 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 108.832 -0.803 . . . . 75.44 108.832 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.632 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.6 tm? -58.28 -44.81 88.64 Favored 'General case' 0 N--CA 1.435 -1.176 0 CA-C-N 114.395 -1.275 . . . . 75.12 109.053 -176.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.514 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.0 m -60.17 -48.54 81.31 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-N 116.358 -0.383 . . . . 75.33 111.249 176.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.49 -39.6 70.65 Favored 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 123.742 0.817 . . . . 64.24 111.785 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.593 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.0 mmmt -75.57 -35.95 60.51 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 121.048 -0.261 . . . . 62.25 111.217 177.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 66.3 mt -58.76 -30.34 67.44 Favored 'General case' 0 C--O 1.203 -1.392 0 N-CA-C 110.466 -0.198 . . . . 63.04 110.466 175.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 34' ' ' SER . 88.5 mtt180 -58.55 -26.56 63.69 Favored 'General case' 0 C--O 1.223 -0.29 0 O-C-N 123.259 0.35 . . . . 60.54 111.624 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 28.3 t -88.42 -50.15 6.49 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 109.641 -0.503 . . . . 73.21 109.641 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.444 ' CD1' HG23 ' A' ' 72' ' ' THR . 75.5 m-85 -70.05 -46.06 65.77 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 113.476 0.917 . . . . 73.34 113.476 -175.388 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.538 HD23 ' H ' ' A' ' 45' ' ' ASP . 9.3 mp -87.7 113.47 54.57 Favored Pre-proline 0 C--N 1.312 -1.062 0 C-N-CA 123.993 0.917 . . . . 73.0 110.056 -178.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.413 ' HD2' ' HA ' ' A' ' 41' ' ' LEU . 30.0 Cg_endo -61.81 -29.9 83.61 Favored 'Trans proline' 0 N--CA 1.482 0.813 0 C-N-CA 123.712 2.941 . . . . 64.33 114.155 -174.615 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 40.1 p -112.55 7.04 18.76 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-O 121.39 0.614 . . . . 61.22 110.308 -178.406 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.417 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 26.5 mtt 41.7 91.06 0.01 OUTLIER 'General case' 0 N--CA 1.42 -1.947 0 C-N-CA 127.312 2.245 . . . . 63.34 112.188 -172.799 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.538 ' H ' HD23 ' A' ' 41' ' ' LEU . 35.3 t70 -98.11 59.54 1.39 Allowed 'General case' 0 C--N 1.295 -1.783 0 N-CA-C 107.406 -1.331 . . . . 73.42 107.406 176.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -96.34 -11.47 25.79 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 113.657 -1.611 . . . . 72.34 111.78 -175.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 8.1 p-10 -80.45 37.61 0.4 Allowed 'General case' 0 C--N 1.308 -1.227 0 C-N-CA 124.436 1.094 . . . . 73.1 111.87 -175.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.6 m -91.85 -0.34 57.51 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 115.804 -0.635 . . . . 72.44 111.495 -179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 72.7 m -91.44 64.65 5.11 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-O 121.454 0.645 . . . . 73.02 112.23 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.413 ' HD1' ' HG3' ' A' ' 51' ' ' GLU . 0.1 OUTLIER -82.41 -32.47 29.08 Favored 'General case' 0 CA--C 1.493 -1.239 0 CA-C-O 122.67 1.224 . . . . 73.44 109.557 173.5 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.421 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 44.6 mt-10 -93.76 172.8 5.4 Favored Pre-proline 0 C--N 1.264 -3.126 0 CA-C-N 112.487 -2.142 . . . . 53.11 106.574 176.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.421 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 39.8 Cg_endo -66.45 -169.87 0.19 Allowed 'Trans proline' 0 N--CA 1.454 -0.835 0 C-N-CA 121.27 1.314 . . . . 62.24 111.85 174.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 21.0 m -78.18 38.55 0.29 Allowed 'General case' 0 C--N 1.296 -1.736 0 C-N-CA 123.488 0.715 . . . . 64.05 112.248 -175.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.615 ' HB2' HG23 ' A' ' 57' ' ' VAL . 96.1 m-20 -57.65 149.72 50.37 Favored Pre-proline 0 N--CA 1.438 -1.067 0 C-N-CA 123.984 0.914 . . . . 73.44 111.931 -177.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_exo -44.79 -51.86 6.85 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 124.144 3.23 . . . . 72.33 113.011 177.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -73.22 -26.27 61.07 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 113.416 0.895 . . . . 53.22 113.416 -179.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.615 HG23 ' HB2' ' A' ' 54' ' ' ASN . 72.2 t -65.65 -38.64 82.81 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.789 0 N-CA-C 108.575 -0.898 . . . . 71.5 108.575 175.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.9 mm -70.53 -50.21 46.92 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.659 0 CA-C-N 115.478 -0.783 . . . . 74.5 109.812 176.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 14.2 t-160 -52.73 -39.99 62.64 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.241 1.017 . . . . 74.35 110.953 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 39.8 ttm180 -57.57 -40.62 79.35 Favored 'General case' 0 C--N 1.306 -1.31 0 C-N-CA 125.079 1.352 . . . . 63.44 111.856 178.418 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.519 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 58.9 mt-30 -76.12 -39.46 55.1 Favored 'General case' 0 C--N 1.307 -1.274 0 CA-C-N 115.657 -0.702 . . . . 75.01 110.602 -177.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -64.46 -30.66 71.69 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 114.933 -1.031 . . . . 63.41 111.26 -179.76 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.423 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 47.4 t30 -55.58 -34.37 64.74 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.834 1.254 . . . . 73.31 111.165 177.768 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 21.6 mmt180 -63.32 -30.16 71.34 Favored 'General case' 0 C--N 1.306 -1.283 0 CA-C-N 115.644 -0.707 . . . . 74.34 111.969 -179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.0 mt -73.09 -31.89 64.64 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-O 121.086 0.469 . . . . 73.23 110.212 178.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.495 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 70.9 t80 -61.92 -29.83 70.49 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.294 -0.866 . . . . 73.55 109.117 177.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -82.21 -21.52 36.37 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 114.868 -1.06 . . . . 74.0 111.781 179.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 18.4 mm-40 -82.37 -47.18 12.62 Favored 'General case' 0 N--CA 1.419 -2.021 0 O-C-N 122.148 -0.345 . . . . 72.35 111.389 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 174.66 142.86 4.2 Favored Glycine 0 CA--C 1.473 -2.586 0 C-N-CA 120.275 -0.964 . . . . 62.45 112.56 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.548 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.64 -31.18 68.03 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 106.95 -1.5 . . . . 70.2 106.95 170.492 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.81 -39.5 64.05 Favored 'General case' 0 N--CA 1.437 -1.085 0 CA-C-N 114.595 -1.184 . . . . 60.23 108.264 177.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.444 HG23 ' CD1' ' A' ' 40' ' ' PHE . 96.1 m -58.1 -40.61 81.6 Favored 'General case' 0 N--CA 1.435 -1.184 0 CA-C-N 115.084 -0.962 . . . . 54.22 110.217 176.226 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.446 ' HE1' HG22 ' A' ' 97' ' ' ILE . 65.4 t-105 -61.65 -46.89 87.85 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 115.97 -0.559 . . . . 73.04 109.906 177.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.548 ' HG3' ' O ' ' A' ' 70' ' ' MET . 34.7 mtmt -60.79 -42.79 98.25 Favored 'General case' 0 C--O 1.237 0.421 0 CA-C-N 116.549 -0.296 . . . . 72.4 111.359 179.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.4 m -66.06 -42.24 89.74 Favored 'General case' 0 N--CA 1.412 -2.36 0 C-N-CA 123.04 0.536 . . . . 74.24 111.128 178.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.429 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 79.0 t80 -61.49 -51.25 69.42 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 115.518 -0.765 . . . . 74.01 111.574 178.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.553 HG21 ' HB2' ' A' ' 94' ' ' LEU . 41.9 mm -61.7 -33.28 56.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-N 116.303 -0.408 . . . . 72.43 111.878 -175.895 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.57 -45.2 94.0 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 109.127 -0.694 . . . . 74.02 109.127 176.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.443 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 85.2 m-20 -68.1 -40.15 82.66 Favored 'General case' 0 C--O 1.195 -1.808 0 CA-C-N 115.475 -0.784 . . . . 75.54 110.704 179.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.497 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 1.5 tm? -50.04 -51.4 42.61 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.039 1.336 . . . . 74.41 108.894 177.035 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 72.8 m -67.39 -36.9 82.24 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 114.95 -1.023 . . . . 53.32 112.187 -179.19 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -76.59 -40.1 50.54 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 123.398 0.679 . . . . 75.51 112.209 -176.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.443 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 38.8 mt-10 -85.75 -29.25 24.01 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.773 1.027 . . . . 71.21 113.773 -172.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.572 HD13 HD12 ' A' ' 25' ' ' LEU . 95.8 mt -90.81 -28.26 18.33 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 113.706 1.002 . . . . 63.43 113.706 -174.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -148.34 -169.58 3.38 Favored 'General case' 0 C--N 1.283 -2.284 0 N-CA-C 104.602 -2.37 . . . . 75.1 104.602 -177.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.0 m -82.17 134.17 49.58 Favored Pre-proline 0 C--N 1.283 -2.284 0 N-CA-C 107.421 -1.326 . . . . 71.3 107.421 175.252 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_exo -22.93 100.31 0.01 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 1 C-N-CA 126.096 4.53 . . . . 71.05 114.171 -174.619 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 89.8 mt -64.16 -34.26 77.66 Favored 'General case' 0 CA--C 1.502 -0.896 0 CA-C-N 115.257 -0.883 . . . . 74.33 110.48 -176.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 36.3 t70 58.19 37.13 26.22 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-O 123.126 1.441 . . . . 74.25 110.889 173.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -143.46 32.35 1.32 Allowed 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 106.712 -1.588 . . . . 73.21 106.712 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.584 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -70.69 -39.76 73.3 Favored 'General case' 0 C--O 1.192 -1.938 0 CA-C-N 114.38 -1.282 . . . . 73.44 112.971 -174.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.537 ' O ' HG22 ' A' ' 95' ' ' VAL . 44.5 mm -55.74 -45.73 99.84 Favored Pre-proline 0 CA--C 1.574 1.886 0 C-N-CA 123.783 0.833 . . . . 72.15 112.107 -175.396 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 79.9 Cg_exo -50.95 -37.53 56.53 Favored 'Trans proline' 0 CA--C 1.555 1.573 0 C-N-CA 121.921 1.747 . . . . 64.32 111.566 171.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.553 ' HB2' HG21 ' A' ' 77' ' ' ILE . 4.3 mm? -76.68 -31.69 57.43 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.838 -0.619 . . . . 73.41 110.911 176.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.584 HG13 ' O ' ' A' ' 91' ' ' GLU . 6.5 m -66.54 -29.47 46.61 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.301 0 CA-C-O 122.566 1.174 . . . . 73.1 110.815 -177.484 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.546 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 31.3 t -75.47 -16.23 60.34 Favored 'General case' 0 C--N 1.27 -2.88 0 CA-C-N 113.379 -1.737 . . . . 72.32 113.077 179.887 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.459 HG22 ' O ' ' A' ' 94' ' ' LEU . 10.7 tt -72.38 -5.28 6.0 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 CA-C-O 121.362 0.601 . . . . 72.02 111.617 -172.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.495 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 47.2 t90 -51.68 -47.64 63.77 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 125.166 1.386 . . . . 71.03 110.4 -179.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -161.05 175.74 37.68 Favored Glycine 0 N--CA 1.425 -2.034 0 N-CA-C 109.528 -1.429 . . . . 61.42 109.528 178.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 3.4 Cg_exo -80.41 101.51 1.33 Allowed 'Trans proline' 0 N--CA 1.449 -1.14 0 C-N-CA 122.296 1.997 . . . . 74.23 110.543 176.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 75.8 ttt180 . . . . . 0 N--CA 1.411 -2.408 0 N-CA-C 108.597 -0.89 . . . . 74.02 108.597 179.898 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.501 -0.84 0 N-CA-C 110.777 -0.929 . . . . 64.14 110.777 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_exo -66.7 108.75 1.5 Allowed 'Trans proline' 0 C--O 1.251 1.163 0 C-N-CA 122.365 2.043 . . . . 71.32 111.332 179.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 97.9 mt 70.97 160.5 0.22 Allowed 'General case' 0 C--O 1.249 1.069 0 C-N-CA 125.32 1.448 . . . . 75.13 112.42 178.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.95 89.07 1.49 Allowed Glycine 0 CA--C 1.486 -1.763 0 N-CA-C 110.039 -1.224 . . . . 54.13 110.039 179.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.1 m 66.69 96.96 0.05 Allowed 'General case' 0 N--CA 1.449 -0.507 0 C-N-CA 124.058 0.943 . . . . 62.01 108.905 -174.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.1 ttt -85.91 59.81 5.86 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-O 123.511 1.624 . . . . 73.11 111.067 -174.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.521 ' O ' HD13 ' A' ' 11' ' ' ILE . 10.2 m-20 -141.82 24.25 2.04 Favored 'General case' 0 C--N 1.273 -2.75 0 CA-C-N 111.596 -2.547 . . . . 62.44 106.099 173.294 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.472 ' O ' ' HG2' ' A' ' 12' ' ' ARG . . . -74.41 -34.75 63.34 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-N 113.852 -1.522 . . . . 74.1 107.641 -178.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.558 ' HB3' HG23 ' A' ' 92' ' ' ILE . 1.7 pm0 -51.47 -45.35 62.72 Favored 'General case' 0 C--N 1.306 -1.285 0 CA-C-N 113.68 -1.6 . . . . 74.14 112.093 179.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.4 m -56.62 -40.6 75.66 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.362 1.065 . . . . 71.34 111.051 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.521 HD13 ' O ' ' A' ' 7' ' ' ASP . 1.2 mp -83.92 -43.21 17.71 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.024 0 CA-C-N 113.958 -1.474 . . . . 73.22 111.022 -175.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.472 ' HG2' ' O ' ' A' ' 8' ' ' ALA . 35.9 mmt180 -69.1 -65.52 0.7 Allowed 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 116.032 1.864 . . . . 74.3 116.032 -170.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.549 ' O ' ' HA ' ' A' ' 93' ' ' PRO . 2.5 tm? -176.45 141.1 0.39 Allowed 'General case' 0 N--CA 1.471 0.613 0 CA-C-N 119.114 0.87 . . . . 61.54 110.991 -172.232 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.46 ' N ' HD13 ' A' ' 13' ' ' LEU . 6.7 p30 -153.65 138.0 16.67 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 106.593 -1.632 . . . . 54.3 106.593 168.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -152.63 153.13 32.72 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.379 -0.528 . . . . 70.22 110.581 -175.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.4 -30.56 71.29 Favored 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 124.112 0.965 . . . . 72.32 112.073 -178.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -65.7 -26.03 67.58 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.142 0.496 . . . . 74.14 111.692 -179.547 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 79.2 mt -73.81 -35.61 64.9 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.782 -0.821 . . . . 71.54 108.782 178.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.473 ' HB2' ' CD1' ' A' ' 97' ' ' ILE . 77.0 t-105 -65.38 -45.38 84.28 Favored 'General case' 0 CA--C 1.516 -0.348 0 CA-C-N 115.423 -0.808 . . . . 73.24 109.086 177.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -58.33 -42.68 87.33 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.67 -0.696 . . . . 72.22 110.992 178.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 7.1 t-105 -59.93 -50.83 72.22 Favored 'General case' 0 N--CA 1.466 0.374 0 O-C-N 123.848 0.717 . . . . 73.01 110.715 175.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 48.0 tp -59.14 -51.43 70.07 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.514 -0.767 . . . . 72.15 110.075 -178.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.2 t -60.14 -42.8 91.36 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.981 0 CA-C-N 115.514 -0.767 . . . . 71.25 112.018 -179.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.513 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 0.7 OUTLIER -69.45 -45.89 67.99 Favored 'General case' 0 C--N 1.315 -0.902 0 N-CA-C 109.322 -0.622 . . . . 72.44 109.322 -176.432 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.413 ' CD1' HD13 ' A' ' 84' ' ' LEU . 2.2 tm? -65.93 -42.32 90.24 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 109.534 -0.543 . . . . 55.43 109.534 -177.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.644 HD13 HD23 ' A' ' 33' ' ' LEU . 7.6 mt -72.5 -25.49 61.42 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 112.942 0.719 . . . . 62.35 112.942 178.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 42.6 t -68.03 -20.14 64.96 Favored 'General case' 0 N--CA 1.44 -0.958 0 N-CA-C 108.336 -0.987 . . . . 65.22 108.336 176.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.2 mtmt -92.78 -7.22 47.13 Favored 'General case' 0 N--CA 1.44 -0.942 0 CA-C-N 115.666 -0.697 . . . . 75.31 109.955 177.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.425 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 43.7 m-80 -136.74 54.13 8.43 Favored Pre-proline 0 C--O 1.243 0.724 0 CA-C-N 115.986 -0.552 . . . . 55.53 112.162 -174.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.425 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.4 Cg_exo -68.84 -23.71 34.95 Favored 'Trans proline' 0 C--N 1.36 1.175 0 C-N-CA 121.309 1.339 . . . . 63.21 109.081 -179.31 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -62.7 -44.61 95.78 Favored 'General case' 0 N--CA 1.439 -1.001 0 CA-C-N 113.93 -1.486 . . . . 75.23 109.637 177.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.612 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.4 t90 -74.57 -45.13 47.38 Favored 'General case' 0 N--CA 1.444 -0.773 0 CA-C-O 121.453 0.644 . . . . 74.35 109.967 -177.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.644 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -60.21 -45.31 93.61 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 114.738 -1.119 . . . . 63.42 110.687 -174.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.485 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 48.7 m -57.39 -46.53 83.34 Favored 'General case' 0 CA--C 1.546 0.826 0 O-C-N 123.236 0.335 . . . . 51.22 111.19 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.94 -40.54 80.75 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 124.287 1.035 . . . . 62.12 111.573 176.749 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.612 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.6 mmmt -73.94 -29.96 62.3 Favored 'General case' 0 C--N 1.309 -1.163 0 C-N-CA 120.822 -0.351 . . . . 74.31 111.876 178.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.2 mt -62.66 -30.27 71.25 Favored 'General case' 0 C--O 1.2 -1.552 0 N-CA-C 109.71 -0.478 . . . . 74.33 109.71 173.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.485 ' HG3' ' O ' ' A' ' 34' ' ' SER . 70.8 mtt180 -62.87 -31.13 72.1 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.947 0.403 . . . . 74.14 111.395 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 33.8 t -85.28 -39.04 18.17 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-O 121.34 0.591 . . . . 75.22 110.826 -179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.6 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.0 m-85 -84.65 -46.45 11.49 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 113.175 0.806 . . . . 74.41 113.175 -176.464 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 mp -89.74 119.43 69.46 Favored Pre-proline 0 C--N 1.304 -1.377 0 C-N-CA 123.328 0.651 . . . . 65.12 110.489 -178.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -64.51 -41.49 19.81 Favored 'Trans proline' 0 C--N 1.324 -0.714 0 C-N-CA 122.218 1.945 . . . . 72.33 110.872 176.797 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.0 t -86.5 -8.92 57.17 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.494 -0.775 . . . . 60.54 112.594 -176.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.445 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 12.4 mtt 28.75 91.5 0.01 OUTLIER 'General case' 0 C--O 1.236 0.395 0 C-N-CA 126.632 1.973 . . . . 65.22 112.89 -173.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 29.5 p-10 -99.65 61.62 1.16 Allowed 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 123.263 1.506 . . . . 51.13 110.309 177.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 pp -89.19 -19.64 25.19 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 113.157 -1.838 . . . . 72.45 110.494 -176.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -96.55 5.39 50.87 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-O 122.305 1.05 . . . . 74.32 108.809 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 41.9 t -85.7 21.8 1.77 Allowed 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.965 -1.016 . . . . 60.23 109.354 178.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 19.6 m -73.14 94.04 1.89 Allowed 'General case' 0 N--CA 1.426 -1.641 0 CA-C-O 122.03 0.919 . . . . 73.23 108.899 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -71.3 -20.45 62.2 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 114.405 -1.271 . . . . 72.34 113.149 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.534 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 37.9 mt-10 -137.04 170.39 10.89 Favored Pre-proline 0 N--CA 1.38 -3.942 0 N-CA-C 107.307 -1.368 . . . . 75.31 107.307 -178.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_endo -61.04 -151.43 0.01 OUTLIER 'Trans proline' 0 CA--C 1.562 1.894 0 C-N-CA 123.605 2.87 . . . . 54.33 112.962 175.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.6 p -75.33 37.18 0.13 Allowed 'General case' 0 CA--C 1.554 1.134 0 C-N-CA 124.004 0.922 . . . . 65.22 112.663 -176.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.414 ' O ' HG12 ' A' ' 58' ' ' ILE . 78.5 m-20 -71.65 148.69 92.9 Favored Pre-proline 0 N--CA 1.431 -1.399 0 C-N-CA 123.987 0.915 . . . . 74.23 112.591 -176.45 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_endo -59.88 -34.26 95.53 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 123.296 2.664 . . . . 73.34 113.132 -177.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -75.19 -23.82 57.73 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.35 0.595 . . . . 73.13 110.996 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.534 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 95.7 t -74.01 -45.26 49.12 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.071 0 N-CA-C 108.047 -1.094 . . . . 54.23 108.047 176.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.414 HG12 ' O ' ' A' ' 54' ' ' ASN . 47.5 mm -58.67 -37.64 66.84 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.85 0 CA-C-N 114.227 -1.351 . . . . 74.1 109.787 176.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.6 t-80 -54.38 -43.74 71.66 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.712 -0.676 . . . . 73.35 111.6 178.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.52 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 2.0 tpp180 -54.9 -54.46 42.28 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.968 0.907 . . . . 74.41 110.791 176.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 76.8 mt-30 -59.46 -42.59 92.35 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 114.296 -1.32 . . . . 72.53 111.79 -176.479 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.452 HD12 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -79.64 -30.85 41.45 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 115.418 -0.81 . . . . 71.43 111.535 -177.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.52 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 22.7 t-20 -53.42 -48.25 68.9 Favored 'General case' 0 CA--C 1.507 -0.702 0 C-N-CA 124.896 1.278 . . . . 71.12 110.177 174.105 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 28.0 mmt180 -55.07 -30.91 60.63 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 113.549 -1.66 . . . . 73.35 112.978 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.1 mt -72.16 -42.47 65.89 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 120.526 0.203 . . . . 71.44 111.283 -178.356 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.582 ' CD1' ' HB3' ' A' ' 98' ' ' TRP . 55.5 t80 -71.32 -24.95 62.22 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 121.638 0.732 . . . . 73.32 109.028 176.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.82 -28.38 64.58 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.159 -0.928 . . . . 71.14 109.875 175.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.557 ' HB2' HG21 ' A' ' 72' ' ' THR . 37.3 mm-40 -74.79 -56.77 4.43 Favored 'General case' 0 N--CA 1.409 -2.49 0 N-CA-C 108.217 -1.031 . . . . 71.34 108.217 173.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -168.97 145.84 9.79 Favored Glycine 0 CA--C 1.479 -2.187 0 CA-C-N 115.495 -0.775 . . . . 53.23 112.147 -175.308 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.584 ' SD ' ' HD3' ' A' ' 100' ' ' PRO . 56.7 ttp -68.8 -32.27 71.88 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 105.606 -1.998 . . . . 74.23 105.606 170.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.41 -38.7 68.32 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 113.623 -1.626 . . . . 72.22 108.3 176.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.6 HG23 ' CD1' ' A' ' 40' ' ' PHE . 96.8 m -57.36 -40.76 78.78 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.577 -0.738 . . . . 61.23 110.167 175.472 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.476 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.5 t-105 -61.51 -50.62 71.97 Favored 'General case' 0 CA--C 1.541 0.622 0 N-CA-C 110.35 -0.241 . . . . 72.31 110.35 177.735 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 70' ' ' MET . 80.6 mttt -55.38 -45.14 76.58 Favored 'General case' 0 N--CA 1.473 0.684 0 CA-C-O 121.111 0.482 . . . . 74.13 111.151 178.308 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.2 m -66.97 -40.58 87.51 Favored 'General case' 0 N--CA 1.406 -2.658 0 C-N-CA 123.845 0.858 . . . . 73.12 111.495 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.444 ' HZ ' ' CD2' ' A' ' 33' ' ' LEU . 81.9 t80 -61.26 -47.77 84.51 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.876 -0.602 . . . . 75.44 110.903 177.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 73' ' ' TRP . 49.6 mm -62.7 -33.47 60.14 Favored 'Isoleucine or valine' 0 C--O 1.244 0.795 0 CA-C-O 121.311 0.577 . . . . 62.33 110.055 -179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -63.41 -39.27 94.06 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-N 115.376 -0.829 . . . . 63.33 109.184 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 73.3 m-20 -75.33 -42.97 53.14 Favored 'General case' 0 C--O 1.194 -1.817 0 N-CA-C 110.252 -0.277 . . . . 74.34 110.252 178.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.404 HD21 HD21 ' A' ' 26' ' ' LEU . 1.5 tm? -49.86 -53.97 22.39 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 125.495 1.518 . . . . 72.33 109.212 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.466 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 52.7 t -63.31 -35.7 81.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.456 -0.793 . . . . 75.44 111.321 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 73.7 t80 -76.2 -54.6 6.56 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 121.183 0.516 . . . . 73.34 111.335 -177.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -71.05 -39.31 72.33 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.539 -0.755 . . . . 64.43 112.627 -172.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.413 HD13 ' CD1' ' A' ' 25' ' ' LEU . 96.4 mt -82.58 -8.4 59.61 Favored 'General case' 0 C--N 1.314 -0.941 0 C-N-CA 120.397 -0.521 . . . . 64.32 109.912 179.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.8 t70 49.86 68.66 0.71 Allowed 'General case' 0 CA--C 1.516 -0.352 0 C-N-CA 125.503 1.521 . . . . 60.23 112.86 179.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 45.6 t -137.31 116.86 10.32 Favored Pre-proline 0 C--N 1.296 -1.754 0 N-CA-C 105.967 -1.864 . . . . 65.04 105.967 177.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_exo -69.49 103.74 1.16 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 C-N-CA 121.768 1.645 . . . . 75.31 109.638 179.533 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.466 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 44.1 mt -81.18 -46.98 14.05 Favored 'General case' 0 C--N 1.311 -1.072 0 C-N-CA 120.715 -0.394 . . . . 74.22 110.815 -175.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.0 t70 70.13 -45.14 0.58 Allowed 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 124.756 1.223 . . . . 74.41 110.961 -173.174 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 25.7 mmt -87.95 40.38 0.94 Allowed 'General case' 0 C--N 1.301 -1.539 0 C-N-CA 124.453 1.101 . . . . 64.1 110.096 178.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.641 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -69.19 -46.32 67.74 Favored 'General case' 0 C--O 1.191 -2.006 0 C-N-CA 120.437 -0.505 . . . . 75.12 111.356 -177.144 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.558 HG23 ' HB3' ' A' ' 9' ' ' GLU . 33.2 mm -64.49 -43.37 71.2 Favored Pre-proline 0 CA--C 1.567 1.6 0 C-N-CA 124.202 1.001 . . . . 73.11 109.632 178.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.549 ' HA ' ' O ' ' A' ' 13' ' ' LEU . 65.0 Cg_exo -50.22 -37.16 48.66 Favored 'Trans proline' 0 CA--C 1.565 2.03 0 C-N-CA 121.346 1.364 . . . . 62.54 112.167 167.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.448 ' O ' HG22 ' A' ' 97' ' ' ILE . 3.8 mm? -70.82 -40.46 72.46 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 116.589 -0.278 . . . . 70.23 110.479 173.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.641 HG13 ' O ' ' A' ' 91' ' ' GLU . 4.4 m -65.1 -33.93 67.09 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.035 0 CA-C-O 122.629 1.204 . . . . 75.04 110.562 -179.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.463 ' HB2' ' HB2' ' A' ' 9' ' ' GLU . 23.0 t -64.27 -19.8 65.64 Favored 'General case' 0 C--N 1.28 -2.417 0 CA-C-N 113.467 -1.697 . . . . 44.22 112.701 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.473 ' CD1' ' HB2' ' A' ' 19' ' ' TRP . 13.5 tt -68.24 -26.78 34.83 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.773 0 C-N-CA 120.169 -0.612 . . . . 52.2 111.043 -174.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.582 ' HB3' ' CD1' ' A' ' 66' ' ' PHE . 57.5 m95 -118.84 90.14 3.27 Favored 'General case' 0 N--CA 1.42 -1.936 0 CA-C-O 121.796 0.808 . . . . 73.41 110.854 175.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -157.06 -164.16 13.29 Favored Glycine 0 N--CA 1.421 -2.323 0 N-CA-C 109.764 -1.334 . . . . 64.53 109.764 179.451 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.584 ' HD3' ' SD ' ' A' ' 70' ' ' MET . 2.9 Cg_endo -82.37 36.78 0.63 Allowed 'Trans proline' 0 CA--C 1.532 0.405 0 C-N-CA 123.642 2.895 . . . . 65.52 112.92 -178.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . 0.282 0.0 OUTLIER . . . . . 0 N--CA 1.474 0.771 0 C-N-CA 125.172 1.389 . . . . 71.13 114.554 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.503 -0.697 0 N-CA-C 110.623 -0.991 . . . . 71.23 110.623 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 12.5 Cg_exo -69.16 119.34 6.33 Favored 'Trans proline' 0 N--CA 1.462 -0.338 0 C-N-CA 122.484 2.123 . . . . 72.43 111.164 -178.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.2 tp -95.37 112.35 24.08 Favored 'General case' 0 N--CA 1.433 -1.298 0 CA-C-O 120.925 0.393 . . . . 71.15 109.995 179.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -140.21 168.85 24.98 Favored Glycine 0 N--CA 1.427 -1.942 0 N-CA-C 110.466 -1.054 . . . . 71.13 110.466 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 50.0 m 64.29 97.48 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 124.257 1.023 . . . . 54.35 112.069 -179.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 49.8 tpp -76.71 -10.87 59.69 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-O 122.021 0.915 . . . . 73.43 110.326 -177.35 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -110.99 24.81 12.47 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.034 -0.985 . . . . 73.41 110.203 178.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.498 ' HA ' HD13 ' A' ' 11' ' ' ILE . . . -75.79 -12.7 60.23 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 122.772 1.272 . . . . 72.33 109.128 175.627 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.11 -30.35 71.42 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 113.191 -1.822 . . . . 72.42 112.347 177.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 60.0 m -59.29 -47.46 85.3 Favored 'General case' 0 C--N 1.307 -1.248 0 CA-C-O 122.464 1.126 . . . . 63.44 110.184 176.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.546 ' H ' HD12 ' A' ' 11' ' ' ILE . 4.2 mp -72.84 -42.08 61.02 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.237 0 CA-C-N 114.177 -1.374 . . . . 64.33 112.426 -175.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.2 mmt180 -76.69 -34.07 58.21 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 112.123 0.416 . . . . 73.43 112.123 -178.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 40.2 mt 67.05 171.72 0.26 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.975 1.31 . . . . 72.5 113.595 -175.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.2 p-10 -89.23 170.19 10.81 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 115.568 -0.742 . . . . 73.11 110.079 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.401 ' OD1' ' HB2' ' A' ' 17' ' ' ASN . 22.0 t-20 -159.26 133.59 7.75 Favored 'General case' 0 C--N 1.319 -0.744 0 N-CA-C 110.082 -0.34 . . . . 74.52 110.082 -178.536 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -69.49 -32.68 71.71 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 113.028 0.751 . . . . 74.11 113.028 -176.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . 0.401 ' HB2' ' OD1' ' A' ' 15' ' ' ASN . 16.2 m120 -64.05 -35.45 80.77 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 109.499 -0.556 . . . . 75.23 109.499 177.84 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 91.7 mt -66.71 -36.12 81.73 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.801 -0.636 . . . . 41.24 110.226 177.001 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.8 t-105 -65.45 -45.51 83.5 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 116.248 -0.433 . . . . 71.55 110.089 177.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.65 -39.66 92.16 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.234 -0.439 . . . . 74.4 110.329 177.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.407 ' CZ2' HD23 ' A' ' 88' ' ' LEU . 2.6 t-105 -56.96 -50.18 73.42 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 115.674 -0.694 . . . . 72.5 110.2 174.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -58.12 -53.15 61.53 Favored 'General case' 0 N--CA 1.448 -0.571 0 O-C-N 124.191 0.932 . . . . 73.13 109.307 -179.258 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.4 t -55.57 -51.61 56.27 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.541 0 N-CA-C 111.922 0.341 . . . . 64.21 111.922 -178.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 79.2 mtp180 -71.97 -34.18 68.74 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 112.483 0.549 . . . . 74.45 112.483 -174.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.431 HD22 ' HE2' ' A' ' 28' ' ' LYS . 1.9 tm? -73.79 -46.47 45.27 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.048 -1.093 . . . . 54.1 108.048 -176.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.466 ' HA ' ' OD1' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -65.95 -25.18 67.0 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 123.905 0.882 . . . . 72.33 110.439 -179.207 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 58.1 m -64.2 -17.61 63.71 Favored 'General case' 0 C--O 1.242 0.668 0 CA-C-O 121.224 0.535 . . . . 72.24 110.246 174.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.452 ' C ' ' HD3' ' A' ' 30' ' ' PRO . 30.1 mtmt -100.78 0.97 39.78 Favored 'General case' 0 N--CA 1.426 -1.626 0 N-CA-C 109.227 -0.657 . . . . 74.32 109.227 -179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.466 ' OD1' ' HA ' ' A' ' 26' ' ' LEU . 5.2 m120 -125.19 45.75 1.47 Allowed Pre-proline 0 CA--C 1.547 0.855 0 CA-C-N 115.629 -0.714 . . . . 70.32 110.315 -175.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.452 ' HD3' ' C ' ' A' ' 28' ' ' LYS . 2.8 Cg_endo -71.3 -20.61 27.71 Favored 'Trans proline' 0 C--N 1.355 0.89 0 CA-C-N 121.321 1.508 . . . . 55.43 110.484 -173.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -75.83 -42.53 49.46 Favored 'General case' 0 N--CA 1.427 -1.603 0 CA-C-N 114.264 -1.335 . . . . 74.52 109.247 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.6 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 81.8 t90 -75.96 -47.75 23.86 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.735 -0.666 . . . . 65.34 111.1 -179.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.505 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -56.71 -49.23 75.77 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 114.81 -1.087 . . . . 74.51 111.064 -173.61 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.634 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.5 p -54.44 -49.11 70.79 Favored 'General case' 0 C--N 1.321 -0.632 0 O-C-N 123.56 0.537 . . . . 75.22 111.522 178.642 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.47 -45.88 66.3 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 124.837 1.255 . . . . 71.25 112.501 177.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.6 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.8 mmmt -71.1 -30.25 66.29 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 120.567 0.222 . . . . 60.5 110.595 178.563 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.511 HD11 ' HB3' ' A' ' 61' ' ' GLN . 87.4 mt -66.91 -35.62 80.41 Favored 'General case' 0 C--O 1.202 -1.437 0 N-CA-C 109.776 -0.453 . . . . 61.01 109.776 174.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.634 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -60.45 -33.77 73.03 Favored 'General case' 0 N--CA 1.468 0.469 0 CA-C-O 121.977 0.894 . . . . 64.14 109.825 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.437 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 59.6 m -74.32 -50.69 17.77 Favored 'General case' 0 N--CA 1.394 -3.267 0 C-N-CA 125.222 1.409 . . . . 51.33 112.626 178.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.564 ' CD1' HG23 ' A' ' 72' ' ' THR . 51.9 m-85 -78.43 -44.78 23.87 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.604 0.964 . . . . 71.42 113.604 -177.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.474 HD23 ' HA ' ' A' ' 44' ' ' MET . 7.9 mp -85.69 129.03 56.34 Favored Pre-proline 0 C--N 1.301 -1.518 0 C-N-CA 123.578 0.751 . . . . 74.14 112.157 -176.796 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.404 ' HD3' ' HA ' ' A' ' 41' ' ' LEU . 10.0 Cg_endo -93.18 -16.15 0.83 Allowed 'Trans proline' 0 CA--C 1.556 1.606 0 C-N-CA 122.372 2.048 . . . . 60.21 110.874 169.182 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 17.8 p -114.4 28.61 8.62 Favored 'General case' 0 C--N 1.32 -0.686 0 C-N-CA 124.307 1.043 . . . . 64.41 111.535 -176.37 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.474 ' HA ' HD23 ' A' ' 41' ' ' LEU . 1.4 mpp? -37.66 110.0 0.11 Allowed 'General case' 0 CA--C 1.504 -0.823 0 C-N-CA 126.238 1.815 . . . . 65.34 114.181 -173.498 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -113.31 56.56 0.69 Allowed 'General case' 0 C--N 1.291 -1.973 0 N-CA-C 106.791 -1.559 . . . . 75.45 106.791 170.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.3 pp -95.07 -15.96 23.03 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.576 -1.647 . . . . 50.15 110.846 -174.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -85.91 -2.22 58.05 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 122.003 0.906 . . . . 73.11 109.795 -179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.7 m -81.51 39.25 0.53 Allowed 'General case' 0 C--N 1.304 -1.407 0 CA-C-N 115.2 -0.909 . . . . 62.31 111.481 -178.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.1 t -87.69 76.81 8.78 Favored 'General case' 0 N--CA 1.424 -1.732 0 CA-C-O 121.901 0.858 . . . . 62.22 108.822 178.822 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -65.91 -38.52 88.93 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 122.732 1.253 . . . . 60.05 110.933 176.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 -113.53 160.62 30.97 Favored Pre-proline 1 N--CA 1.379 -4.019 0 N-CA-C 105.478 -2.045 . . . . 64.22 105.478 176.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -69.22 -141.48 0.02 OUTLIER 'Trans proline' 0 CA--C 1.534 0.492 0 C-N-CA 122.803 2.335 . . . . 44.01 112.353 179.317 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -75.78 38.36 0.16 Allowed 'General case' 0 C--N 1.296 -1.721 0 C-N-CA 123.999 0.92 . . . . 73.31 112.88 -175.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.49 ' HB2' HG23 ' A' ' 57' ' ' VAL . 6.3 m-20 -60.03 143.52 87.98 Favored Pre-proline 0 N--CA 1.427 -1.594 0 C-N-CA 123.997 0.919 . . . . 74.13 109.52 175.493 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.5 Cg_endo -54.08 -40.92 79.57 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 123.339 2.693 . . . . 64.23 113.704 -175.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -74.86 -30.28 61.3 Favored 'General case' 0 CA--C 1.514 -0.415 0 O-C-N 122.32 -0.237 . . . . 74.24 110.948 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.49 HG23 ' HB2' ' A' ' 54' ' ' ASN . 84.0 t -66.46 -44.86 90.25 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.447 0 N-CA-C 108.249 -1.019 . . . . 72.44 108.249 177.583 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 44.7 mm -64.45 -49.09 82.32 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 CA-C-N 114.564 -1.198 . . . . 72.23 109.385 176.581 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.0 t-160 -56.24 -35.4 67.34 Favored 'General case' 0 C--O 1.206 -1.214 0 CA-C-N 116.281 -0.418 . . . . 75.53 111.123 -179.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.496 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.5 ttt180 -58.93 -44.33 91.31 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-O 121.557 0.694 . . . . 72.05 111.206 176.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.511 ' HB3' HD11 ' A' ' 37' ' ' LEU . 59.0 mt-30 -72.21 -38.42 69.0 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 115.211 -0.904 . . . . 74.42 110.142 -176.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -72.05 -30.18 64.9 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-N 114.891 -1.049 . . . . 72.54 110.439 178.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.552 ' O ' ' HB3' ' A' ' 66' ' ' PHE . 9.2 t30 -61.64 -32.58 72.74 Favored 'General case' 0 CA--C 1.513 -0.449 0 C-N-CA 124.648 1.179 . . . . 71.35 109.398 176.45 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -67.52 -33.36 74.92 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 115.154 -0.93 . . . . 70.12 111.899 177.182 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 86.6 mt -72.29 -37.93 68.87 Favored 'General case' 0 CA--C 1.506 -0.748 0 N-CA-C 109.11 -0.7 . . . . 64.33 109.11 176.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.552 ' HB3' ' O ' ' A' ' 63' ' ' ASN . 34.9 t80 -52.88 -43.92 66.48 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 114.483 -1.235 . . . . 72.51 108.415 174.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.81 -16.7 60.69 Favored 'General case' 0 C--N 1.318 -0.804 0 CA-C-N 114.975 -1.012 . . . . 73.23 113.345 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.459 ' HB2' HG21 ' A' ' 72' ' ' THR . 39.0 mm-40 -82.98 -44.3 15.42 Favored 'General case' 0 N--CA 1.428 -1.539 0 CA-C-N 118.671 0.668 . . . . 64.03 110.571 177.647 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 173.03 143.13 4.08 Favored Glycine 0 CA--C 1.475 -2.433 0 C-N-CA 120.019 -1.086 . . . . 53.12 112.678 -175.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.566 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.4 ptt? -70.47 -27.27 64.1 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 106.684 -1.599 . . . . 74.41 106.684 170.425 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.85 -34.36 57.85 Favored 'General case' 0 N--CA 1.439 -0.981 0 CA-C-N 114.391 -1.277 . . . . 75.5 108.16 176.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.564 HG23 ' CD1' ' A' ' 40' ' ' PHE . 93.3 m -63.6 -36.12 82.76 Favored 'General case' 0 N--CA 1.439 -0.979 0 CA-C-N 115.387 -0.824 . . . . 52.13 109.41 174.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 72.3 t-105 -63.12 -50.88 68.72 Favored 'General case' 0 N--CA 1.449 -0.504 0 N-CA-C 109.636 -0.505 . . . . 72.14 109.636 176.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.566 ' HG3' ' O ' ' A' ' 70' ' ' MET . 84.3 mttt -54.75 -42.23 71.4 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-N 115.839 -0.619 . . . . 72.34 111.294 176.72 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -65.31 -47.68 75.73 Favored 'General case' 0 N--CA 1.411 -2.398 0 C-N-CA 123.256 0.622 . . . . 74.22 111.142 178.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -59.34 -51.08 71.46 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 115.332 -0.849 . . . . 75.0 111.104 -178.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 49.2 mm -64.79 -36.91 78.81 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 O-C-N 123.411 0.444 . . . . 73.3 110.842 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.2 t30 -58.55 -46.31 87.12 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.05 -0.523 . . . . 74.03 110.083 177.109 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.502 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 72.1 m-20 -72.14 -39.33 68.86 Favored 'General case' 0 C--O 1.185 -2.306 0 C-N-CA 120.795 -0.362 . . . . 70.42 110.94 177.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.421 HD23 ' CH2' ' A' ' 32' ' ' TRP . 2.5 tm? -49.79 -54.2 20.64 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.963 1.305 . . . . 73.23 110.535 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.44 ' SG ' HD11 ' A' ' 88' ' ' LEU . 59.1 m -63.18 -32.26 73.61 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.073 -0.967 . . . . 42.24 111.246 -179.266 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -76.2 -52.86 9.18 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.631 -0.713 . . . . 74.44 111.14 179.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.502 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 28.9 mt-10 -66.76 -44.68 80.77 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 123.846 0.858 . . . . 43.24 112.582 -173.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 79.8 mt -80.28 -10.81 59.76 Favored 'General case' 0 C--O 1.242 0.684 0 C-N-CA 120.164 -0.614 . . . . 74.32 109.456 178.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 37.5 t70 55.74 71.15 0.57 Allowed 'General case' 0 C--O 1.238 0.493 0 CA-C-N 114.079 -1.418 . . . . 75.2 111.612 178.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.7 t -124.86 104.95 29.84 Favored Pre-proline 0 C--N 1.303 -1.419 0 CA-C-N 114.701 -1.136 . . . . 72.11 108.52 -178.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -75.98 73.04 5.02 Favored 'Trans proline' 0 N--CA 1.449 -1.101 0 C-N-CA 122.011 1.807 . . . . 63.25 111.092 177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.44 HD11 ' SG ' ' A' ' 81' ' ' CYS . 0.3 OUTLIER -95.87 -24.35 16.48 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 114.024 1.12 . . . . 64.13 114.024 -178.4 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 62.41 17.83 9.8 Favored 'General case' 0 N--CA 1.497 1.884 0 CA-C-O 121.977 0.894 . . . . 71.22 111.247 -179.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.521 ' O ' HD23 ' A' ' 94' ' ' LEU . 63.8 mtt -113.12 17.52 18.67 Favored 'General case' 0 C--N 1.309 -1.152 0 CA-C-N 114.794 -1.093 . . . . 72.22 109.969 -177.557 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.637 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.0 OUTLIER -60.9 -56.07 25.49 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 116.218 -0.446 . . . . 71.11 111.165 -175.7 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.535 ' O ' HG22 ' A' ' 95' ' ' VAL . 35.2 mm -66.64 -42.84 48.1 Favored Pre-proline 0 CA--C 1.571 1.764 0 C-N-CA 123.181 0.592 . . . . 72.12 110.728 179.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_exo -48.05 -41.85 32.99 Favored 'Trans proline' 0 CA--C 1.557 1.638 0 C-N-CA 121.759 1.64 . . . . 62.3 111.943 168.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.698 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 4.3 mm? -69.45 -36.2 76.38 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 122.795 0.438 . . . . 72.0 110.804 173.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.637 HG13 ' O ' ' A' ' 91' ' ' GLU . 5.8 m -68.21 -35.02 69.65 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.231 0 CA-C-O 121.986 0.898 . . . . 72.42 110.156 179.649 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.8 t -59.53 -26.42 65.32 Favored 'General case' 0 C--N 1.307 -1.245 0 C-N-CA 125.501 1.52 . . . . 71.2 110.99 179.113 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.698 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 2.7 mt -50.09 -47.46 24.27 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.995 0 C-N-CA 123.883 0.873 . . . . 72.34 110.949 176.071 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.487 ' CD1' ' HA ' ' A' ' 66' ' ' PHE . 7.8 t-105 -124.51 84.28 2.26 Favored 'General case' 0 N--CA 1.409 -2.491 0 CA-C-O 122.813 1.292 . . . . 71.41 110.044 178.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -122.14 -151.15 8.36 Favored Glycine 0 N--CA 1.411 -2.98 0 CA-C-N 112.96 -1.927 . . . . 74.2 109.066 177.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_exo -60.61 152.67 67.03 Favored 'Trans proline' 0 C--O 1.251 1.158 0 C-N-CA 122.793 2.329 . . . . 71.22 112.79 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 21.5 mmm180 . . . . . 0 N--CA 1.422 -1.836 0 C-N-CA 125.82 1.648 . . . . 75.33 112.627 178.773 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.505 -0.541 0 N-CA-C 110.92 -0.872 . . . . 72.31 110.92 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -72.55 97.22 0.86 Allowed 'Trans proline' 0 C--O 1.246 0.923 0 C-N-CA 122.501 2.134 . . . . 64.32 113.046 -178.313 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 92.1 mt -103.23 136.91 42.13 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-N 115.363 -0.835 . . . . 75.35 109.204 178.103 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -92.06 -16.71 49.96 Favored Glycine 0 C--N 1.306 -1.083 0 N-CA-C 111.302 -0.719 . . . . 25.33 111.302 179.04 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 41.1 m -137.4 161.44 36.31 Favored 'General case' 0 N--CA 1.425 -1.678 0 CA-C-O 121.185 0.517 . . . . 54.12 109.981 179.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.4 ' SD ' HD11 ' A' ' 92' ' ' ILE . 6.4 tpt -95.86 -12.87 24.54 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.518 -1.289 . . . . 71.4 107.518 177.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -73.59 25.22 0.07 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.089 1.514 . . . . 61.5 115.089 -173.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.422 ' HB3' HG21 ' A' ' 92' ' ' ILE . . . -78.26 -17.44 56.67 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 122.857 1.313 . . . . 74.41 109.129 177.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.502 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -64.82 -31.49 72.75 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 113.408 -1.724 . . . . 75.15 112.925 179.047 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.534 ' HB2' HD12 ' A' ' 11' ' ' ILE . 51.7 m -61.86 -27.84 69.08 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.672 0.748 . . . . 72.34 110.483 177.375 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.534 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.62 -29.74 5.6 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.646 0 CA-C-N 114.427 -1.26 . . . . 71.35 111.76 -173.302 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.431 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 37.2 mmt180 -85.91 -38.13 18.35 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 113.9 1.074 . . . . 75.11 113.9 -172.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.1 mm? 64.15 -51.85 0.27 Allowed 'General case' 0 CA--C 1.552 1.027 0 N-CA-C 117.407 2.373 . . . . 73.41 117.407 177.082 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.566 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 42.3 m-80 -126.42 -80.59 0.61 Allowed 'General case' 0 N--CA 1.476 0.832 0 N-CA-C 114.588 1.329 . . . . 52.12 114.588 -173.454 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.4 m-20 67.99 84.67 0.15 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.187 0.995 . . . . 74.31 110.92 -175.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -71.68 -47.17 55.96 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 115.379 -0.828 . . . . 72.31 113.086 -177.149 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.3 m120 -61.23 -33.1 72.95 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 112.126 0.417 . . . . 71.54 112.126 -176.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.441 HD13 HD22 ' A' ' 94' ' ' LEU . 94.3 mt -64.87 -33.95 77.21 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 116.056 -0.52 . . . . 74.01 111.595 177.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.504 ' CA ' HD11 ' A' ' 97' ' ' ILE . 65.9 t-105 -63.9 -39.96 95.4 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.32 -0.4 . . . . 74.31 110.289 177.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.48 -38.95 91.26 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.593 -0.276 . . . . 73.23 110.435 178.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 76.7 t90 -58.76 -50.38 74.15 Favored 'General case' 0 C--O 1.239 0.503 0 N-CA-C 108.861 -0.792 . . . . 75.52 108.861 175.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 29.4 tp -61.16 -52.89 62.94 Favored 'General case' 0 N--CA 1.441 -0.887 0 CA-C-N 114.893 -1.049 . . . . 74.14 110.773 -176.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 67.2 t -53.16 -51.76 36.45 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 C-N-CA 123.124 0.57 . . . . 65.45 112.117 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.0 mtt180 -69.67 -32.64 71.4 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.43 -0.35 . . . . 62.32 111.533 -175.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -74.44 -47.12 35.59 Favored 'General case' 0 C--O 1.209 -1.051 0 N-CA-C 107.695 -1.224 . . . . 63.41 107.695 -176.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.677 ' HA ' ' ND2' ' A' ' 29' ' ' ASN . 0.2 OUTLIER -68.11 -24.74 65.06 Favored 'General case' 0 C--N 1.307 -1.272 0 C-N-CA 124.237 1.015 . . . . 73.43 111.211 -178.67 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.421 ' HA ' ' HB2' ' A' ' 53' ' ' SER . 48.0 t -63.53 -15.11 57.05 Favored 'General case' 0 N--CA 1.436 -1.144 0 N-CA-C 109.079 -0.711 . . . . 64.13 109.079 174.412 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt -100.39 -4.53 28.84 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-O 121.064 0.459 . . . . 72.24 110.084 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.677 ' ND2' ' HA ' ' A' ' 26' ' ' LEU . 8.4 p30 -133.93 48.36 3.17 Favored Pre-proline 0 N--CA 1.472 0.658 0 N-CA-C 113.362 0.875 . . . . 52.21 113.362 -177.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.4 Cg_exo -72.36 -22.95 21.11 Favored 'Trans proline' 0 C--N 1.356 0.963 0 C-N-CA 121.612 1.541 . . . . 52.14 111.154 -175.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -75.6 -51.32 13.13 Favored 'General case' 0 C--O 1.244 0.805 0 N-CA-C 108.857 -0.794 . . . . 60.52 108.857 -177.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.548 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 60.9 t90 -60.72 -44.14 96.97 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 115.06 -0.973 . . . . 74.24 109.668 176.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.546 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.7 tm? -58.08 -43.4 86.99 Favored 'General case' 0 N--CA 1.447 -0.614 0 CA-C-N 115.627 -0.715 . . . . 75.1 109.641 -178.383 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 50.7 m -61.99 -49.44 76.06 Favored 'General case' 0 CA--C 1.554 1.1 0 CA-C-N 116.26 -0.427 . . . . 52.33 110.964 177.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.14 -39.85 63.81 Favored 'General case' 0 C--N 1.318 -0.763 0 C-N-CA 123.727 0.811 . . . . 64.32 111.612 174.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.548 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 29.2 mmmt -74.21 -33.48 63.4 Favored 'General case' 0 C--N 1.32 -0.711 0 C-N-CA 120.979 -0.289 . . . . 73.52 111.306 177.388 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.546 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.9 mt -59.1 -34.1 71.62 Favored 'General case' 0 C--O 1.19 -2.05 0 N-CA-C 110.342 -0.244 . . . . 73.21 110.342 174.304 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.489 ' HG2' ' SD ' ' A' ' 44' ' ' MET . 90.5 mtt180 -59.33 -39.12 82.14 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.287 0.565 . . . . 61.55 110.51 179.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 22.2 t -72.26 -38.91 68.76 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 114.907 -1.042 . . . . 44.34 110.396 -176.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.544 ' CD1' HG23 ' A' ' 72' ' ' THR . 69.7 m-85 -89.29 -50.19 6.28 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 113.559 0.948 . . . . 73.02 113.559 -176.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.436 ' HB3' ' H ' ' A' ' 44' ' ' MET . 8.3 mp -79.65 128.38 74.89 Favored Pre-proline 0 C--N 1.306 -1.295 0 C-N-CA 123.591 0.756 . . . . 71.13 110.498 -179.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 42.2 Cg_endo -72.85 -22.12 20.48 Favored 'Trans proline' 0 C--N 1.321 -0.914 0 C-N-CA 122.23 1.953 . . . . 74.44 111.761 177.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.5 p -108.62 -30.59 8.14 Favored 'General case' 0 C--N 1.312 -1.045 0 N-CA-C 113.871 1.063 . . . . 73.14 113.871 -176.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.489 ' SD ' ' HG2' ' A' ' 38' ' ' ARG 0.29 1.1 ptm 41.32 92.63 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 116.205 1.928 . . . . 52.33 116.205 -175.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 19.7 p-10 -99.12 56.8 1.05 Allowed 'General case' 0 C--N 1.315 -0.895 0 CA-C-O 123.171 1.463 . . . . 72.42 108.244 177.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.406 HD22 ' HB3' ' A' ' 34' ' ' SER . 3.5 pp -92.18 -17.33 25.03 Favored 'General case' 0 C--N 1.295 -1.797 0 CA-C-N 113.577 -1.647 . . . . 64.04 112.634 -173.128 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -88.74 0.21 56.7 Favored 'General case' 0 C--N 1.309 -1.188 0 CA-C-O 122.025 0.917 . . . . 74.23 110.744 -176.294 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.3 m -81.78 69.46 8.46 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 115.615 -0.721 . . . . 65.22 109.697 179.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.3 m -93.15 82.89 4.58 Favored 'General case' 0 N--CA 1.424 -1.756 0 CA-C-O 121.896 0.855 . . . . 73.12 109.582 179.84 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -82.66 -28.28 30.76 Favored 'General case' 0 C--N 1.31 -1.147 0 CA-C-O 122.698 1.237 . . . . 52.55 110.333 176.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -134.11 167.53 22.42 Favored Pre-proline 1 N--CA 1.376 -4.158 0 N-CA-C 104.948 -2.241 . . . . 62.0 104.948 176.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -76.83 -149.45 0.03 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 121.691 1.594 . . . . 75.44 110.648 175.797 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.421 ' HB2' ' HA ' ' A' ' 27' ' ' SER . 29.3 p -76.0 38.65 0.17 Allowed 'General case' 0 C--N 1.306 -1.324 0 C-N-CA 123.666 0.786 . . . . 74.1 112.788 -177.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.94 150.98 46.86 Favored Pre-proline 0 N--CA 1.446 -0.63 0 C-N-CA 125.156 1.382 . . . . 72.44 111.591 178.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -52.87 -43.85 53.1 Favored 'Trans proline' 0 C--N 1.354 0.83 0 C-N-CA 123.529 2.819 . . . . 72.44 113.956 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -74.4 -28.92 61.3 Favored 'General case' 0 CA--C 1.506 -0.747 0 C-N-CA 120.977 -0.289 . . . . 73.43 111.37 -178.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.563 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 99.8 t -65.87 -52.54 48.2 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.846 0 N-CA-C 107.362 -1.347 . . . . 62.41 107.362 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 35.0 mm -55.48 -47.41 78.47 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 CA-C-N 114.641 -1.163 . . . . 75.43 110.148 176.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -54.16 -40.93 67.94 Favored 'General case' 0 C--O 1.215 -0.758 0 C-N-CA 123.337 0.655 . . . . 75.21 111.462 179.553 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 42.0 ttm180 -68.17 -41.44 81.52 Favored 'General case' 0 C--N 1.297 -1.705 0 C-N-CA 123.412 0.685 . . . . 74.55 111.093 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.563 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 46.0 mt-30 -69.78 -39.86 76.37 Favored 'General case' 0 C--N 1.301 -1.525 0 CA-C-N 115.349 -0.841 . . . . 71.12 111.175 -177.63 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.427 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -77.9 -30.58 50.73 Favored 'General case' 0 C--N 1.296 -1.744 0 CA-C-N 115.452 -0.795 . . . . 65.32 110.678 -178.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.457 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 24.0 t-20 -54.59 -46.01 73.71 Favored 'General case' 0 CA--C 1.511 -0.521 0 C-N-CA 124.244 1.017 . . . . 64.24 110.622 173.012 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 13.6 mmt180 -54.03 -33.83 58.34 Favored 'General case' 0 C--N 1.31 -1.124 0 CA-C-N 114.114 -1.403 . . . . 71.3 112.075 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 84.9 mt -72.45 -42.92 64.47 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.734 0.302 . . . . 62.45 111.026 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -64.83 -32.51 74.24 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.815 -0.63 . . . . 74.25 109.581 179.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -69.9 -24.8 63.45 Favored 'General case' 0 N--CA 1.443 -0.784 0 CA-C-N 115.287 -0.87 . . . . 72.13 111.624 176.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.563 ' HB2' HG21 ' A' ' 72' ' ' THR . 32.2 mm-40 -74.29 -37.37 63.69 Favored 'General case' 0 N--CA 1.428 -1.541 0 N-CA-C 108.615 -0.883 . . . . 73.42 108.615 175.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.489 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . 170.81 138.78 2.59 Favored Glycine 0 N--CA 1.415 -2.737 0 CA-C-N 114.678 -1.146 . . . . 64.23 110.909 -176.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.534 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -70.48 -26.55 63.67 Favored 'General case' 0 C--N 1.302 -1.467 0 N-CA-C 106.864 -1.532 . . . . 72.22 106.864 171.385 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.44 -37.54 65.81 Favored 'General case' 0 N--CA 1.436 -1.158 0 CA-C-N 113.986 -1.461 . . . . 72.31 108.374 174.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.563 HG21 ' HB2' ' A' ' 68' ' ' GLN . 53.1 m -58.99 -42.47 90.12 Favored 'General case' 0 N--CA 1.439 -1.0 0 CA-C-N 115.488 -0.778 . . . . 74.15 109.707 173.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.477 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -61.27 -46.0 92.15 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 116.03 -0.532 . . . . 72.33 110.639 178.011 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.534 ' HG3' ' O ' ' A' ' 70' ' ' MET . 95.2 mttt -53.76 -46.39 70.91 Favored 'General case' 0 C--O 1.24 0.575 0 C-N-CA 122.581 0.352 . . . . 71.45 110.852 175.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.7 m -65.63 -42.28 91.67 Favored 'General case' 0 N--CA 1.407 -2.593 0 C-N-CA 123.033 0.533 . . . . 62.2 111.756 178.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 94.5 t80 -58.37 -49.22 78.01 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 116.042 -0.527 . . . . 73.33 111.584 178.551 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.485 HG22 ' HG3' ' A' ' 91' ' ' GLU . 49.3 mm -61.13 -33.92 58.16 Favored 'Isoleucine or valine' 0 C--O 1.244 0.792 0 O-C-N 123.336 0.397 . . . . 70.31 111.177 -177.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.444 ' HA ' ' OE1' ' A' ' 91' ' ' GLU . 5.7 t30 -57.96 -49.02 78.21 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.857 -0.611 . . . . 65.5 110.156 175.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.43 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.6 m-20 -72.85 -40.12 65.97 Favored 'General case' 0 C--O 1.194 -1.846 0 CA-C-N 114.928 -1.033 . . . . 72.22 110.666 -178.204 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.509 HD21 HD21 ' A' ' 26' ' ' LEU . 2.5 tm? -50.95 -54.47 24.02 Favored 'General case' 0 C--N 1.306 -1.317 0 C-N-CA 125.229 1.412 . . . . 72.2 109.732 177.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.7 m -65.95 -40.67 91.55 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 116.151 -0.477 . . . . 62.52 110.281 -179.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -65.38 -49.02 70.89 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.687 -0.688 . . . . 73.15 111.986 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 33.9 mt-10 -81.11 -17.71 49.01 Favored 'General case' 0 C--N 1.306 -1.303 0 N-CA-C 112.942 0.719 . . . . 72.4 112.942 -173.047 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.3 mt -103.17 -39.39 6.88 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 112.501 0.556 . . . . 75.44 112.501 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 6.0 t70 -138.3 -151.64 0.39 Allowed 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 107.871 -1.159 . . . . 71.45 107.871 -172.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 33.2 m -105.04 166.45 11.43 Favored Pre-proline 0 C--N 1.295 -1.771 0 N-CA-C 107.35 -1.352 . . . . 70.02 107.35 175.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -70.9 86.69 0.73 Allowed 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 121.501 1.467 . . . . 71.44 111.577 177.695 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.612 HD13 ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -77.48 -13.43 59.92 Favored 'General case' 0 N--CA 1.422 -1.859 0 CA-C-N 115.905 -0.589 . . . . 61.23 112.003 178.058 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.6 t70 53.48 83.63 0.07 Allowed 'General case' 0 N--CA 1.466 0.354 0 N-CA-C 116.1 1.889 . . . . 71.33 116.1 174.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.498 ' HG2' ' CD2' ' A' ' 88' ' ' LEU . 26.2 ptm -156.12 32.25 0.34 Allowed 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 104.04 -2.578 . . . . 75.03 104.04 168.74 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.606 ' O ' HG13 ' A' ' 95' ' ' VAL . 35.2 tt0 -60.4 -50.84 72.0 Favored 'General case' 0 C--O 1.2 -1.51 0 CA-C-N 111.547 -2.569 . . . . 71.43 111.759 -172.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.547 ' O ' HG22 ' A' ' 95' ' ' VAL . 42.4 mm -60.56 -45.4 97.2 Favored Pre-proline 0 CA--C 1.559 1.29 0 C-N-CA 123.011 0.525 . . . . 72.21 111.536 -177.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_exo -47.89 -37.25 28.67 Favored 'Trans proline' 0 CA--C 1.553 1.454 0 C-N-CA 121.911 1.741 . . . . 74.45 111.812 170.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.441 HD22 HD13 ' A' ' 18' ' ' LEU . 4.4 mm? -76.26 -34.98 59.14 Favored 'General case' 0 C--O 1.217 -0.609 0 C-N-CA 122.797 0.439 . . . . 72.35 110.972 175.09 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.606 HG13 ' O ' ' A' ' 91' ' ' GLU . 5.2 m -68.53 -30.59 47.9 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.049 0 CA-C-O 122.799 1.285 . . . . 75.31 110.748 -179.118 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.431 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 30.0 t -83.5 2.86 34.81 Favored 'General case' 0 C--N 1.272 -2.771 0 CA-C-N 113.635 -1.62 . . . . 61.15 112.39 -178.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.566 ' HA ' ' O ' ' A' ' 14' ' ' ASN . 9.7 tt -62.67 -25.86 39.22 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.725 0 N-CA-C 114.143 1.164 . . . . 73.31 114.143 -170.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -101.33 -22.08 14.69 Favored 'General case' 0 C--N 1.322 -0.619 0 O-C-N 121.777 -0.577 . . . . 71.22 111.533 -179.821 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.06 75.66 1.18 Allowed Glycine 0 C--N 1.305 -1.157 0 N-CA-C 109.236 -1.546 . . . . 43.12 109.236 -173.046 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 22.8 Cg_exo -66.27 113.54 2.69 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 123.223 2.615 . . . . 60.23 113.488 -173.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 61.3 ttp180 . . . . . 0 N--CA 1.405 -2.716 0 N-CA-C 106.763 -1.569 . . . . 60.24 106.763 176.484 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.461 0 N-CA-C 110.443 -1.063 . . . . 73.01 110.443 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_exo -64.1 -46.92 7.21 Favored 'Trans proline' 0 C--O 1.24 0.617 0 C-N-CA 122.591 2.194 . . . . 73.11 112.335 -178.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 47.3 tp -70.26 98.96 1.45 Allowed 'General case' 0 N--CA 1.448 -0.542 0 CA-C-O 121.129 0.49 . . . . 74.44 111.039 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -93.95 -20.78 29.93 Favored Glycine 0 N--CA 1.437 -1.261 0 N-CA-C 111.048 -0.821 . . . . 31.32 111.048 179.507 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 23.3 m -65.67 116.0 6.43 Favored 'General case' 0 N--CA 1.439 -0.989 0 C-N-CA 122.92 0.488 . . . . 64.01 110.738 179.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.32 1.42 55.78 Favored 'General case' 0 N--CA 1.435 -1.186 0 CA-C-O 122.048 0.928 . . . . 65.42 111.165 179.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -106.34 25.68 10.78 Favored 'General case' 0 C--N 1.293 -1.848 0 CA-C-N 114.903 -1.044 . . . . 71.22 110.897 177.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.02 -17.25 57.3 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-O 121.396 0.617 . . . . 64.04 109.355 174.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.24 -40.4 64.52 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 126.049 1.74 . . . . 74.21 115.222 -177.315 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 33.5 t -58.35 -41.52 84.88 Favored 'General case' 0 C--N 1.301 -1.505 0 C-N-CA 124.457 1.103 . . . . 63.52 110.261 177.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.545 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.5 mp -87.2 -36.69 10.2 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.147 0 CA-C-N 114.711 -1.131 . . . . 71.44 111.648 -176.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.5 mmt180 -72.66 -49.48 31.41 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 114.405 1.261 . . . . 72.51 114.405 -176.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 63.1 -168.91 0.19 Allowed 'General case' 0 CA--C 1.548 0.889 0 O-C-N 123.862 0.726 . . . . 61.32 110.054 -171.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 9.6 p30 -138.85 178.59 7.05 Favored 'General case' 0 C--N 1.316 -0.858 0 O-C-N 121.631 -0.668 . . . . 73.24 111.279 -178.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 45.5 t-20 -114.2 145.02 42.25 Favored 'General case' 0 C--N 1.315 -0.931 0 N-CA-C 107.9 -1.148 . . . . 75.21 107.9 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -64.17 -29.38 70.5 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.096 0.558 . . . . 72.5 110.516 -179.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.46 -39.01 86.03 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 109.082 -0.71 . . . . 72.43 109.082 176.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.436 HD21 HD13 ' A' ' 94' ' ' LEU . 6.7 tt -72.31 -38.4 68.72 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 114.152 -1.386 . . . . 72.55 109.182 -177.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.431 ' HA ' HD11 ' A' ' 97' ' ' ILE . 66.8 t-105 -60.77 -51.14 70.6 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-N 116.312 -0.404 . . . . 73.32 109.968 175.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.49 -38.23 86.57 Favored 'General case' 0 C--O 1.213 -0.845 0 CA-C-N 115.689 -0.687 . . . . 70.4 110.558 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 41.7 t-105 -61.48 -50.89 70.94 Favored 'General case' 0 C--N 1.328 -0.344 0 O-C-N 123.302 0.376 . . . . 75.01 111.074 177.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -60.85 -50.15 74.6 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.529 -0.545 . . . . 53.42 109.529 -178.755 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -61.16 -46.32 96.86 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.767 0 CA-C-N 115.947 -0.569 . . . . 55.12 111.811 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.472 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 78.3 ttt180 -69.12 -42.48 75.99 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.7 -0.227 . . . . 73.42 111.606 -176.151 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.424 HD22 ' HE3' ' A' ' 28' ' ' LYS . 2.4 tm? -67.31 -43.73 80.96 Favored 'General case' 0 C--N 1.311 -1.067 0 N-CA-C 109.446 -0.576 . . . . 62.43 109.446 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.442 HD13 HD13 ' A' ' 33' ' ' LEU . 1.5 mt -70.02 -25.18 63.46 Favored 'General case' 0 C--N 1.317 -0.839 0 C-N-CA 122.444 0.298 . . . . 71.21 111.673 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.4 t -70.2 -12.91 61.92 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.794 -0.817 . . . . 73.12 108.794 177.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 7.0 mtmp? -101.17 -5.15 26.0 Favored 'General case' 0 N--CA 1.43 -1.464 0 N-CA-C 109.512 -0.551 . . . . 65.33 109.512 177.7 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.473 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 92.3 m-20 -136.72 52.06 5.52 Favored Pre-proline 0 C--N 1.32 -0.677 0 CA-C-N 115.411 -0.813 . . . . 74.32 111.172 -175.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.473 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 6.1 Cg_exo -71.97 -21.78 23.89 Favored 'Trans proline' 0 C--N 1.358 1.04 0 N-CA-C 108.687 -1.313 . . . . 64.43 108.687 -177.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -72.49 -36.93 68.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 CA-C-N 113.49 -1.686 . . . . 73.54 109.914 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.592 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 69.2 t90 -75.11 -45.16 42.96 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 119.571 -0.852 . . . . 75.12 109.098 173.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.475 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 60.3 tp -56.46 -48.82 76.26 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.367 -1.288 . . . . 62.23 112.346 -174.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.7 m -55.99 -36.74 68.24 Favored 'General case' 0 C--N 1.312 -1.037 0 O-C-N 123.575 0.547 . . . . 72.21 111.641 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -66.81 -38.84 87.28 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-O 121.382 0.611 . . . . 53.42 110.184 179.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.592 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.8 mmmt -76.53 -37.25 56.98 Favored 'General case' 0 C--N 1.315 -0.929 0 C-N-CA 120.685 -0.406 . . . . 71.31 111.392 177.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 88.0 mt -54.37 -49.71 69.19 Favored 'General case' 0 C--O 1.186 -2.251 0 O-C-N 123.574 0.546 . . . . 75.11 110.264 176.325 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.498 ' HA ' ' HB3' ' A' ' 44' ' ' MET . 28.4 ptt180 -65.22 -30.49 71.39 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 113.463 0.912 . . . . 74.24 113.463 -178.07 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 72.1 m -69.93 -23.47 63.22 Favored 'General case' 0 N--CA 1.385 -3.709 0 CA-C-N 115.314 -0.857 . . . . 53.54 111.793 178.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.43 ' CD1' HG23 ' A' ' 72' ' ' THR . 57.7 m-85 -100.66 -44.11 5.93 Favored 'General case' 0 C--N 1.315 -0.919 0 C-N-CA 123.825 0.85 . . . . 62.03 112.639 176.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.461 HD21 ' HG2' ' A' ' 64' ' ' ARG . 9.5 mp -76.59 120.48 81.85 Favored Pre-proline 0 C--N 1.301 -1.514 0 C-N-CA 124.438 1.095 . . . . 72.43 110.67 178.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 30.6 Cg_endo -62.98 -34.5 70.64 Favored 'Trans proline' 0 CA--C 1.535 0.575 0 C-N-CA 122.953 2.436 . . . . 74.14 113.533 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.6 p -114.34 -5.37 12.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.18 0.514 . . . . 74.51 112.062 -177.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.498 ' HB3' ' HA ' ' A' ' 38' ' ' ARG 0.286 6.4 ptt? 41.96 92.12 0.01 OUTLIER 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 115.532 1.679 . . . . 71.43 115.532 -174.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 12.9 t70 -100.92 58.22 0.9 Allowed 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 107.908 -1.145 . . . . 62.42 107.908 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 pp -96.17 -5.18 41.17 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 114.743 -1.117 . . . . 74.21 112.915 -175.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -80.7 -13.34 59.09 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-O 121.767 0.794 . . . . 75.42 111.326 -176.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -75.53 91.09 2.78 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 115.195 -0.911 . . . . 75.4 110.153 177.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 11.1 t -141.74 76.53 1.55 Allowed 'General case' 0 N--CA 1.419 -1.975 0 N-CA-C 108.352 -0.981 . . . . 65.5 108.352 -178.76 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -61.31 -28.56 69.29 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-N 113.83 -1.532 . . . . 74.03 112.475 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HB2' HG21 ' A' ' 57' ' ' VAL . 50.0 mt-10 -122.73 169.44 9.8 Favored Pre-proline 0 C--N 1.247 -3.864 0 N-CA-C 106.187 -1.783 . . . . 63.54 106.187 178.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_endo -68.04 -156.49 0.04 OUTLIER 'Trans proline' 0 CA--C 1.558 1.685 0 C-N-CA 121.321 1.347 . . . . 71.33 111.517 173.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.0 m -75.72 39.12 0.16 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 124.154 0.982 . . . . 75.04 113.197 -174.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -57.08 149.6 44.83 Favored Pre-proline 0 N--CA 1.432 -1.354 0 C-N-CA 126.186 1.794 . . . . 63.32 111.295 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_exo -46.65 -45.89 18.96 Favored 'Trans proline' 0 CA--C 1.541 0.852 0 C-N-CA 124.35 3.367 . . . . 70.15 114.243 179.601 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -74.6 -25.98 59.61 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-O 121.178 0.513 . . . . 74.13 110.966 -178.711 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.451 HG21 ' HB2' ' A' ' 51' ' ' GLU . 95.5 t -73.97 -47.73 41.43 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.393 0 N-CA-C 108.572 -0.899 . . . . 52.25 108.572 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 33.4 mm -59.02 -41.81 84.41 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-N 114.962 -1.017 . . . . 72.4 109.861 176.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 3.6 t-160 -55.62 -46.58 77.36 Favored 'General case' 0 C--O 1.209 -1.064 0 CA-C-N 115.643 -0.708 . . . . 62.4 110.025 179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -58.89 -43.34 90.95 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-O 121.365 0.603 . . . . 74.15 111.209 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 94.1 mt-30 -66.33 -46.45 76.8 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.012 -0.995 . . . . 74.53 111.603 -177.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.401 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -74.44 -30.59 61.96 Favored 'General case' 0 C--N 1.296 -1.735 0 CA-C-N 115.465 -0.788 . . . . 75.42 111.918 -177.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -63.13 -38.45 91.23 Favored 'General case' 0 N--CA 1.439 -1.013 0 C-N-CA 123.706 0.802 . . . . 63.22 109.854 178.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.461 ' HG2' HD21 ' A' ' 41' ' ' LEU . 9.5 tpp85 -59.5 -29.46 67.88 Favored 'General case' 1 N--CA 1.375 -4.181 0 C-N-CA 124.924 1.29 . . . . 73.42 111.877 178.582 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 71.9 mt -71.09 -38.07 72.42 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.795 -0.446 . . . . 73.4 109.795 176.576 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 87.8 t80 -69.08 -31.23 69.83 Favored 'General case' 0 C--N 1.314 -0.944 0 N-CA-C 108.899 -0.778 . . . . 71.54 108.899 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.88 -26.72 66.16 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.436 -0.802 . . . . 55.1 110.944 175.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.525 ' HB2' HG21 ' A' ' 72' ' ' THR . 35.8 mm-40 -70.83 -48.56 53.42 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 107.782 -1.192 . . . . 75.24 107.782 174.243 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.407 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -174.92 139.69 4.95 Favored Glycine 0 CA--C 1.474 -2.499 0 CA-C-N 114.635 -1.166 . . . . 55.14 110.739 -176.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.619 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 0.0 OUTLIER -66.08 -29.73 70.12 Favored 'General case' 0 C--N 1.314 -0.967 0 N-CA-C 106.211 -1.774 . . . . 75.55 106.211 171.666 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.22 -35.54 59.0 Favored 'General case' 0 N--CA 1.438 -1.051 0 CA-C-N 113.789 -1.55 . . . . 63.5 108.718 177.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.525 HG21 ' HB2' ' A' ' 68' ' ' GLN . 91.1 m -58.75 -41.16 85.87 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 115.742 -0.663 . . . . 74.11 110.03 175.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.575 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.2 t-105 -63.33 -49.37 74.2 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 116.441 -0.345 . . . . 65.04 110.424 176.982 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.619 ' HG3' ' O ' ' A' ' 70' ' ' MET . 86.7 mttt -54.7 -35.39 63.57 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.325 0.65 . . . . 74.33 111.545 176.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 34.1 m -72.17 -49.94 31.73 Favored 'General case' 0 N--CA 1.409 -2.507 0 N-CA-C 109.69 -0.485 . . . . 72.52 109.69 176.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 54.7 t80 -50.51 -48.51 56.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 124.125 0.97 . . . . 75.55 112.189 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.41 ' HA ' ' HB3' ' A' ' 80' ' ' LEU . 41.1 mm -57.4 -37.07 55.43 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.893 0 N-CA-C 112.644 0.609 . . . . 75.3 112.644 -178.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.1 t-20 -65.92 -34.06 77.26 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 121.288 0.566 . . . . 74.33 110.169 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.404 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 1.2 m-20 -78.21 -42.77 30.35 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.712 -0.676 . . . . 73.53 110.174 175.171 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.412 HD21 HD21 ' A' ' 26' ' ' LEU . 2.4 tm? -50.19 -54.52 20.29 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.869 1.668 . . . . 74.42 110.542 179.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 13.2 p -64.48 -33.36 75.71 Favored 'General case' 0 N--CA 1.437 -1.087 0 CA-C-N 115.379 -0.828 . . . . 71.42 111.643 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 72.8 t80 -75.93 -54.64 6.58 Favored 'General case' 0 C--N 1.305 -1.332 0 CA-C-N 115.063 -0.971 . . . . 72.53 111.778 -178.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 40.5 mt-10 -70.93 -31.35 67.93 Favored 'General case' 0 C--N 1.314 -0.954 0 N-CA-C 113.504 0.927 . . . . 72.54 113.504 -170.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.5 mt -75.5 -49.34 19.05 Favored 'General case' 0 C--N 1.306 -1.287 0 C-N-CA 119.993 -0.683 . . . . 71.33 111.857 -179.456 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -161.69 -97.3 0.02 OUTLIER 'General case' 0 C--N 1.313 -1.014 0 O-C-N 123.13 0.269 . . . . 74.21 110.514 -176.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -140.64 165.02 32.72 Favored Pre-proline 0 C--N 1.3 -1.573 0 N-CA-C 105.445 -2.057 . . . . 74.32 105.445 174.65 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_exo -43.5 107.74 0.1 OUTLIER 'Trans proline' 0 C--N 1.363 1.332 0 C-N-CA 122.967 2.444 . . . . 64.34 112.101 174.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -82.45 -8.86 59.61 Favored 'General case' 0 C--N 1.311 -1.086 0 CA-C-N 114.835 -1.075 . . . . 62.35 112.823 -176.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -175.12 -161.64 0.1 Allowed 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 103.179 -2.897 . . . . 73.42 103.179 177.285 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.506 ' O ' HD23 ' A' ' 94' ' ' LEU . 0.3 OUTLIER -86.59 141.62 28.88 Favored 'General case' 0 C--N 1.293 -1.874 0 N-CA-C 106.926 -1.509 . . . . 71.15 106.926 178.448 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.566 ' O ' HG13 ' A' ' 95' ' ' VAL . 36.2 tt0 -52.78 -52.25 57.44 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 124.977 1.311 . . . . 65.43 112.94 -175.059 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.464 ' O ' HG22 ' A' ' 95' ' ' VAL . 39.3 mm -64.44 -45.6 77.46 Favored Pre-proline 0 C--O 1.169 -3.154 0 CA-C-O 117.534 -1.222 . . . . 70.21 113.136 -172.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -49.38 -35.13 34.71 Favored 'Trans proline' 0 N--CA 1.497 1.698 0 CA-C-N 122.837 2.049 . . . . 72.51 112.097 172.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.506 HD23 ' O ' ' A' ' 90' ' ' MET . 3.4 mm? -72.2 -36.59 69.25 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.691 -0.686 . . . . 71.54 109.385 175.553 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.575 ' HA ' ' CD1' ' A' ' 73' ' ' TRP . 2.9 m -69.87 -36.06 67.69 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.259 0 CA-C-O 122.385 1.088 . . . . 74.31 109.993 177.047 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 60.6 m -70.42 5.24 1.86 Allowed 'General case' 0 C--N 1.293 -1.858 0 C-N-CA 127.694 2.398 . . . . 72.22 113.007 178.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.431 HD11 ' HA ' ' A' ' 19' ' ' TRP . 10.3 tp -66.61 -28.56 43.65 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-O 121.088 0.47 . . . . 55.34 111.163 -175.631 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 76.6 t-105 -164.47 116.82 1.3 Allowed 'General case' 0 N--CA 1.421 -1.887 0 N-CA-C 108.126 -1.064 . . . . 72.31 108.126 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 177.6 70.6 0.06 OUTLIER Glycine 0 C--N 1.277 -2.742 0 N-CA-C 108.027 -2.029 . . . . 70.2 108.027 178.505 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 14.3 Cg_exo -67.25 98.46 0.45 Allowed 'Trans proline' 0 C--N 1.358 1.033 0 C-N-CA 123.14 2.56 . . . . 70.2 112.076 -174.265 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 . . . . . 0 N--CA 1.401 -2.903 0 N-CA-C 106.801 -1.555 . . . . 72.03 106.801 -178.679 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.208 0 N-CA-C 109.899 -1.28 . . . . 71.53 109.899 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_exo -57.72 109.0 0.42 Allowed 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 122.824 2.35 . . . . 71.51 111.922 176.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 93.2 mt -99.3 -30.01 12.48 Favored 'General case' 0 C--N 1.312 -1.065 0 CA-C-N 115.703 -0.68 . . . . 53.52 110.771 -178.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 155.88 -49.12 0.47 Allowed Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 111.893 -0.483 . . . . 64.0 111.893 -179.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 44.1 m -84.74 122.22 28.79 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 108.501 -0.926 . . . . 51.45 108.501 177.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.0 tpt -71.18 -11.58 61.01 Favored 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.201 0.524 . . . . 72.43 110.162 -176.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -78.32 25.09 0.24 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 123.933 0.893 . . . . 70.34 112.205 176.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -76.56 -13.27 60.09 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 108.22 -1.03 . . . . 64.3 108.22 174.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.432 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -60.88 -38.24 84.96 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 114.376 -1.284 . . . . 63.44 112.142 178.627 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.602 ' HB2' HD12 ' A' ' 11' ' ' ILE . 68.0 m -54.92 -32.17 60.89 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 124.679 1.192 . . . . 74.33 111.727 176.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.602 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -83.88 -25.91 7.49 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.73 0 C-N-CA 124.91 1.284 . . . . 74.31 110.322 -173.499 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.3 mmt180 -110.16 7.4 23.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 115.646 -0.707 . . . . 62.24 111.964 -177.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 7.4 tt -51.35 121.43 6.27 Favored 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 124.576 1.151 . . . . 74.41 112.586 -175.381 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.405 ' O ' ' HA ' ' A' ' 97' ' ' ILE . 26.4 t-20 -152.42 149.43 28.58 Favored 'General case' 0 C--N 1.304 -1.405 0 N-CA-C 105.093 -2.188 . . . . 71.01 105.093 177.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.1 p-10 -122.17 -73.77 0.64 Allowed 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 118.815 -1.154 . . . . 65.42 113.122 -179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -68.97 -34.34 75.16 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.958 1.466 . . . . 72.12 114.958 -170.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -70.26 -40.21 74.53 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 120.259 -0.576 . . . . 73.13 110.966 -177.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 88.8 mt -74.44 -34.86 63.3 Favored 'General case' 0 C--N 1.31 -1.143 0 CA-C-N 116.242 -0.436 . . . . 71.21 110.241 176.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.438 ' HB2' HD11 ' A' ' 97' ' ' ILE . 49.0 t-105 -61.15 -50.12 74.47 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.278 -0.419 . . . . 65.42 110.769 178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -59.44 -40.11 85.73 Favored 'General case' 0 C--O 1.243 0.74 0 O-C-N 123.225 0.328 . . . . 43.55 110.902 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.439 ' HE1' HD22 ' A' ' 88' ' ' LEU . 22.2 t-105 -63.88 -51.03 66.42 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.739 -0.664 . . . . 73.32 110.948 176.004 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 45.8 tp -60.08 -49.2 78.59 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.998 -0.546 . . . . 62.03 110.076 -177.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.406 ' HA ' HG21 ' A' ' 58' ' ' ILE . 42.3 t -57.42 -46.38 85.64 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.822 0 CA-C-N 115.681 -0.69 . . . . 73.35 111.446 179.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.521 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 19.7 tpt180 -68.52 -44.26 75.02 Favored 'General case' 0 C--N 1.315 -0.935 0 CA-C-N 116.644 -0.253 . . . . 55.22 110.728 -176.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.415 HD12 HD13 ' A' ' 84' ' ' LEU . 1.9 tm? -67.93 -42.96 80.22 Favored 'General case' 0 C--N 1.305 -1.332 0 N-CA-C 109.674 -0.491 . . . . 73.5 109.674 -176.405 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.409 HD21 HD21 ' A' ' 80' ' ' LEU . 2.3 mt -71.61 -24.53 61.9 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 112.008 0.373 . . . . 74.14 112.008 177.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 32.6 t -67.09 -23.28 65.83 Favored 'General case' 0 N--CA 1.444 -0.735 0 N-CA-C 107.723 -1.214 . . . . 71.24 107.723 175.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 31.1 mtmt -90.94 -10.2 43.32 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.66 -0.7 . . . . 70.44 110.084 178.133 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -135.4 52.3 6.86 Favored Pre-proline 0 C--N 1.317 -0.822 0 C-N-CA 122.883 0.473 . . . . 74.2 111.33 -177.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -73.01 -17.88 24.6 Favored 'Trans proline' 0 C--N 1.368 1.556 0 N-CA-C 108.759 -1.285 . . . . 72.22 108.759 -178.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -71.55 -38.58 71.0 Favored 'General case' 0 N--CA 1.417 -2.099 0 CA-C-N 113.386 -1.734 . . . . 73.03 109.455 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.444 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 68.1 t90 -74.67 -47.98 28.75 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 119.657 -0.817 . . . . 71.35 109.554 176.291 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.55 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 52.8 tp -54.05 -51.48 63.92 Favored 'General case' 0 C--N 1.317 -0.848 0 CA-C-N 114.009 -1.45 . . . . 70.31 112.418 -175.091 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.531 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 14.9 p -50.34 -51.79 42.63 Favored 'General case' 0 C--N 1.308 -1.203 0 O-C-N 123.878 0.736 . . . . 75.01 112.127 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.73 -43.48 76.63 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 125.083 1.353 . . . . 74.33 112.081 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.444 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.0 mmmt -74.05 -30.03 62.19 Favored 'General case' 0 C--N 1.316 -0.871 0 O-C-N 122.325 -0.235 . . . . 73.33 110.436 178.284 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.55 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 98.0 mt -63.77 -35.88 82.03 Favored 'General case' 0 C--O 1.187 -2.205 0 N-CA-C 109.256 -0.646 . . . . 73.21 109.256 173.434 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.531 ' HG3' ' O ' ' A' ' 34' ' ' SER . 49.4 mtt180 -61.51 -33.56 74.02 Favored 'General case' 0 N--CA 1.47 0.548 0 CA-C-O 121.269 0.557 . . . . 73.35 110.562 178.779 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.429 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.3 m -74.56 -41.59 60.28 Favored 'General case' 0 N--CA 1.402 -2.855 0 C-N-CA 124.981 1.312 . . . . 72.03 112.324 -179.475 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.57 ' CD1' HG23 ' A' ' 72' ' ' THR . 67.1 m-85 -88.99 -48.31 7.52 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 113.091 0.775 . . . . 74.45 113.091 -177.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.455 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 8.4 mp -89.85 139.0 27.57 Favored Pre-proline 0 C--N 1.295 -1.777 0 C-N-CA 124.425 1.09 . . . . 50.04 112.139 -177.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 41' ' ' LEU . 3.7 Cg_endo -91.04 -13.0 2.14 Favored 'Trans proline' 0 CA--C 1.551 1.326 0 C-N-CA 122.241 1.96 . . . . 73.43 109.284 166.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 23.9 p -114.37 26.59 10.13 Favored 'General case' 0 C--N 1.32 -0.709 0 C-N-CA 125.668 1.587 . . . . 60.35 111.567 -172.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.454 ' HB3' ' HB2' ' A' ' 41' ' ' LEU 0.257 0.0 OUTLIER -59.11 96.08 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.536 0 N-CA-C 115.946 1.832 . . . . 75.21 115.946 -173.943 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.413 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 16.4 m-20 -83.72 74.06 10.2 Favored 'General case' 0 CA--C 1.506 -0.73 0 N-CA-C 107.004 -1.48 . . . . 74.41 107.004 174.63 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 34' ' ' SER . 4.6 pp -95.81 -27.35 15.26 Favored 'General case' 0 C--N 1.283 -2.297 0 CA-C-N 115.24 -0.891 . . . . 74.1 111.456 -178.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -103.66 6.13 36.85 Favored 'General case' 0 C--N 1.304 -1.387 0 CA-C-O 122.265 1.031 . . . . 73.1 109.668 -176.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 63.6 m -81.72 74.33 8.72 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-O 122.407 1.099 . . . . 41.32 109.464 177.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 26.4 t -90.52 83.33 5.84 Favored 'General case' 0 N--CA 1.403 -2.793 0 CA-C-N 114.36 -1.291 . . . . 64.11 110.142 -176.03 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.411 ' CE1' HG22 ' A' ' 57' ' ' VAL . 0.6 OUTLIER -79.76 -28.79 40.36 Favored 'General case' 0 C--N 1.301 -1.512 0 CA-C-O 123.166 1.46 . . . . 75.31 108.696 170.026 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -135.0 161.87 61.11 Favored Pre-proline 1 N--CA 1.373 -4.313 0 CA-C-N 112.03 -2.35 . . . . 63.03 105.191 177.44 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.2 Cg_exo -67.81 -143.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 122.846 2.364 . . . . 73.52 111.917 175.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.9 m -76.91 37.64 0.19 Allowed 'General case' 0 CA--C 1.572 1.799 0 C-N-CA 124.1 0.96 . . . . 71.4 110.489 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.421 ' H ' ' C ' ' A' ' 52' ' ' PRO . 7.2 m-20 -65.32 152.23 92.39 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 126.795 2.038 . . . . 74.34 113.258 -175.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_endo -54.32 -41.67 74.36 Favored 'Trans proline' 0 C--N 1.36 1.162 0 C-N-CA 123.954 3.103 . . . . 64.2 114.272 -176.786 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -74.47 -29.69 61.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.225 0.536 . . . . 73.35 110.478 -177.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.456 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 86.8 t -66.38 -51.65 55.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.866 0 N-CA-C 108.207 -1.034 . . . . 71.4 108.207 177.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.406 HG21 ' HA ' ' A' ' 23' ' ' VAL . 46.9 mm -59.65 -41.56 85.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-N 114.561 -1.199 . . . . 71.43 109.709 177.385 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.4 t-80 -56.42 -42.15 77.55 Favored 'General case' 0 C--O 1.211 -0.947 0 C-N-CA 122.838 0.455 . . . . 74.22 111.251 178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.529 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 21.2 ttt180 -61.21 -42.0 97.82 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-O 121.599 0.714 . . . . 75.41 110.953 178.935 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.456 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 84.6 mt-30 -71.39 -42.24 68.63 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.942 -1.026 . . . . 51.11 111.764 -175.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.406 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -75.51 -31.11 60.05 Favored 'General case' 0 C--N 1.293 -1.863 0 CA-C-N 115.347 -0.842 . . . . 72.34 110.547 -179.786 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.529 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 23.7 t-20 -53.33 -49.77 66.4 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.957 1.303 . . . . 52.35 110.23 173.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.431 ' CB ' HD21 ' A' ' 41' ' ' LEU . 30.0 mmt180 -54.69 -33.6 61.14 Favored 'General case' 0 C--N 1.302 -1.474 0 CA-C-N 113.553 -1.658 . . . . 54.11 113.071 -179.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 97.2 mt -67.02 -40.66 87.29 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-O 120.641 0.258 . . . . 71.25 110.575 -179.447 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -67.17 -32.95 74.39 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.812 -0.81 . . . . 74.42 108.812 177.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.09 -18.96 63.27 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 115.321 -0.854 . . . . 64.25 111.281 177.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -79.52 -55.85 4.74 Favored 'General case' 0 N--CA 1.413 -2.277 0 N-CA-C 107.137 -1.431 . . . . 64.14 107.137 172.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -166.51 140.29 6.25 Favored Glycine 0 N--CA 1.42 -2.372 0 CA-C-N 114.132 -1.395 . . . . 73.1 111.036 -176.676 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.445 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 45.8 ttm -65.13 -30.88 71.85 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 106.137 -1.801 . . . . 62.4 106.137 171.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.15 -35.52 59.16 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.641 -1.618 . . . . 61.52 109.123 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.57 HG23 ' CD1' ' A' ' 40' ' ' PHE . 54.9 m -59.96 -36.95 78.2 Favored 'General case' 0 N--CA 1.448 -0.566 0 CA-C-N 115.813 -0.631 . . . . 72.34 110.007 176.087 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.506 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 75.1 t-105 -61.94 -53.0 61.76 Favored 'General case' 0 N--CA 1.448 -0.561 0 N-CA-C 109.678 -0.49 . . . . 72.43 109.678 176.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.507 ' HA ' HG12 ' A' ' 95' ' ' VAL . 92.4 mttt -51.28 -46.58 62.5 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 123.89 0.876 . . . . 74.52 111.727 177.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 70.4 m -68.66 -44.11 74.79 Favored 'General case' 0 N--CA 1.41 -2.444 0 C-N-CA 123.035 0.534 . . . . 43.13 112.168 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -57.06 -46.02 82.79 Favored 'General case' 0 CA--C 1.508 -0.649 0 C-N-CA 122.816 0.446 . . . . 74.11 110.382 178.074 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.646 HG21 ' HB2' ' A' ' 94' ' ' LEU . 45.4 mm -63.71 -31.35 52.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.019 0 CA-C-N 115.751 -0.659 . . . . 74.12 111.565 -177.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -65.22 -40.77 94.55 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.5 -0.556 . . . . 73.42 109.5 176.006 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.453 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 82.7 m-20 -68.44 -42.28 79.06 Favored 'General case' 0 C--O 1.187 -2.221 0 CA-C-N 116.017 -0.538 . . . . 72.23 109.756 177.047 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.468 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -50.52 -53.91 26.49 Favored 'General case' 0 C--N 1.305 -1.328 0 C-N-CA 125.085 1.354 . . . . 75.22 109.767 178.156 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 61.4 m -64.24 -35.14 79.84 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.727 -0.67 . . . . 45.34 111.403 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -76.33 -54.29 6.97 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.206 0.526 . . . . 73.3 112.105 -178.252 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.453 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 31.0 mt-10 -74.78 -22.57 58.68 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.734 1.013 . . . . 73.04 113.734 -169.353 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.415 HD13 HD12 ' A' ' 25' ' ' LEU . 94.6 mt -79.71 -42.13 25.29 Favored 'General case' 0 N--CA 1.434 -1.251 0 C-N-CA 119.046 -1.061 . . . . 62.01 111.823 179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . 0.25 4.3 p30 -171.19 -90.48 0.01 OUTLIER 'General case' 0 C--O 1.241 0.641 0 N-CA-C 112.677 0.621 . . . . 74.34 112.677 174.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 69.4 t -130.51 148.04 68.37 Favored Pre-proline 0 C--N 1.301 -1.507 0 N-CA-C 106.297 -1.742 . . . . 74.32 106.297 -179.135 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_exo -39.22 109.0 0.08 OUTLIER 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 123.393 2.729 . . . . 74.45 112.207 173.27 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.439 HD22 ' HE1' ' A' ' 21' ' ' TRP . 0.7 OUTLIER -74.29 -15.58 60.96 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-N 115.026 -0.988 . . . . 71.2 112.91 -178.297 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -168.86 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 105.207 -2.146 . . . . 74.13 105.207 174.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 22.1 mmt -168.5 163.66 12.51 Favored 'General case' 0 C--N 1.307 -1.278 0 N-CA-C 102.886 -3.005 . . . . 54.34 102.886 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.585 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.9 OUTLIER -72.01 -43.66 64.68 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 118.489 0.586 . . . . 75.14 111.105 -179.548 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.521 ' O ' HG22 ' A' ' 95' ' ' VAL . 29.5 mm -50.47 -44.14 81.95 Favored Pre-proline 0 CA--C 1.572 1.796 0 C-N-CA 125.7 1.6 . . . . 70.42 114.132 -171.642 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.03 -43.38 58.75 Favored 'Trans proline' 0 C--N 1.355 0.901 0 C-N-CA 121.494 1.463 . . . . 65.41 110.793 174.56 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.646 ' HB2' HG21 ' A' ' 77' ' ' ILE . 2.8 mm? -75.15 -31.88 61.17 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 114.586 -1.188 . . . . 74.03 109.78 -179.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.585 HG13 ' O ' ' A' ' 91' ' ' GLU . 4.1 m -67.74 -31.36 52.0 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.185 0 CA-C-O 122.176 0.989 . . . . 72.31 110.49 178.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.4 t -80.79 5.8 14.84 Favored 'General case' 0 C--N 1.281 -2.386 0 CA-C-N 113.708 -1.587 . . . . 33.03 112.408 -178.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.438 HD11 ' HB2' ' A' ' 19' ' ' TRP . 15.4 tt -60.46 -27.81 40.9 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.261 0 CA-C-O 121.478 0.656 . . . . 64.52 110.448 -179.31 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.9 OUTLIER -160.64 161.87 32.54 Favored 'General case' 0 N--CA 1.428 -1.533 0 N-CA-C 106.913 -1.514 . . . . 64.01 106.913 173.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 179.7 -115.21 0.47 Allowed Glycine 0 C--N 1.288 -2.127 0 C-N-CA 120.134 -1.031 . . . . 65.32 111.542 -177.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -56.11 104.59 0.14 Allowed 'Trans proline' 0 C--O 1.243 0.735 0 C-N-CA 123.612 2.875 . . . . 72.5 111.675 177.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . 0.379 0.0 OUTLIER . . . . . 0 CA--C 1.522 -0.113 0 N-CA-C 115.631 1.715 . . . . 63.02 115.631 -177.783 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.335 0 N-CA-C 109.628 -1.389 . . . . 55.51 109.628 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 7.4 Cg_endo -90.32 3.2 4.94 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 122.646 2.231 . . . . 71.12 113.61 -177.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.6 mp -97.91 -18.89 18.42 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 112.369 0.507 . . . . 52.22 112.369 -177.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 90.82 141.75 9.59 Favored Glycine 0 N--CA 1.444 -0.801 0 N-CA-C 110.06 -1.216 . . . . 25.31 110.06 -177.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.0 m 64.88 -168.86 0.21 Allowed 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 123.45 0.7 . . . . 75.15 110.502 -178.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 9.8 tmm? -122.11 89.71 3.17 Favored 'General case' 0 CA--C 1.487 -1.479 0 N-CA-C 108.369 -0.974 . . . . 74.35 108.369 179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 12.0 t70 -168.19 23.46 0.03 OUTLIER 'General case' 0 C--N 1.293 -1.857 0 CA-C-N 114.352 -1.294 . . . . 73.4 109.495 176.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.455 ' HB3' ' HB ' ' A' ' 92' ' ' ILE . . . -77.63 -12.03 59.93 Favored 'General case' 0 N--CA 1.479 0.996 0 CA-C-O 122.765 1.269 . . . . 52.24 108.788 178.197 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.413 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -66.65 -30.57 70.86 Favored 'General case' 0 N--CA 1.415 -2.224 0 CA-C-N 112.917 -1.947 . . . . 71.35 111.892 178.814 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 74.4 m -67.38 -37.79 83.7 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-O 121.638 0.732 . . . . 63.42 111.699 177.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.431 ' H ' HD12 ' A' ' 11' ' ' ILE . 3.1 mp -84.63 -49.26 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.413 -2.285 0 CA-C-N 115.168 -0.924 . . . . 73.31 112.015 -176.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.3 mmm180 -77.91 -36.16 49.84 Favored 'General case' 0 C--N 1.317 -0.829 0 C-N-CA 119.977 -0.689 . . . . 74.14 112.302 -176.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 55.8 mt 60.09 106.91 0.02 OUTLIER 'General case' 0 C--O 1.241 0.653 0 C-N-CA 124.39 1.076 . . . . 72.33 113.856 -177.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -69.12 155.57 40.15 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.762 -0.653 . . . . 65.31 110.872 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -157.22 179.88 8.85 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.855 -0.612 . . . . 60.31 109.829 -174.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 17.7 mp0 -61.91 -34.68 76.5 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.441 0.697 . . . . 75.32 112.794 -175.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 47.6 m-80 -59.7 -46.92 87.63 Favored 'General case' 0 CA--C 1.474 -1.978 0 CA-C-O 123.0 1.381 . . . . 75.34 109.513 179.027 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.448 HD21 HD12 ' A' ' 94' ' ' LEU . 3.2 tm? -65.84 -39.51 90.88 Favored 'General case' 0 N--CA 1.407 -2.625 0 CA-C-N 111.667 -2.515 . . . . 63.53 110.361 -174.696 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.475 ' CE3' HG12 ' A' ' 97' ' ' ILE . 61.3 t-105 -68.72 -45.75 70.74 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-O 120.824 0.345 . . . . 72.43 110.366 174.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -57.61 -45.39 85.41 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.634 -0.712 . . . . 64.43 111.309 -179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.59 -47.34 70.22 Favored 'General case' 0 C--O 1.24 0.592 0 C-N-CA 123.019 0.528 . . . . 64.32 111.406 177.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 57.9 tp -60.9 -49.99 75.24 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 116.005 -0.543 . . . . 71.52 110.076 -179.584 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 95.7 t -59.81 -43.17 91.23 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.797 -0.638 . . . . 64.14 111.443 179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.551 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 40.1 mmt180 -72.01 -42.92 65.83 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 112.213 0.449 . . . . 74.35 112.213 -175.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.485 HD12 HD13 ' A' ' 84' ' ' LEU . 2.6 tm? -67.99 -38.23 82.44 Favored 'General case' 0 C--N 1.306 -1.3 0 N-CA-C 109.407 -0.59 . . . . 72.25 109.407 -177.509 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.503 HD13 HD13 ' A' ' 33' ' ' LEU . 3.3 mt -71.98 -25.45 61.86 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 112.248 0.462 . . . . 61.41 112.248 176.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 28.1 t -69.38 -20.98 63.82 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 108.054 -1.091 . . . . 72.14 108.054 176.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.551 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 37.6 mtmt -94.44 -2.56 51.65 Favored 'General case' 0 N--CA 1.44 -0.932 0 CA-C-N 115.584 -0.735 . . . . 64.34 109.956 177.906 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.437 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -138.32 52.39 4.69 Favored Pre-proline 0 C--O 1.243 0.743 0 CA-C-N 115.686 -0.688 . . . . 73.25 111.682 -179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.1 Cg_exo -68.6 -22.36 38.2 Favored 'Trans proline' 0 C--N 1.364 1.346 0 N-CA-C 108.342 -1.446 . . . . 73.32 108.342 -179.42 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -67.2 -44.62 79.14 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.01 -1.45 . . . . 72.25 110.375 178.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.419 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 64.3 t90 -74.31 -44.22 53.46 Favored 'General case' 0 C--O 1.243 0.759 0 C-N-CA 119.387 -0.925 . . . . 71.31 109.251 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.597 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 53.8 tp -57.74 -52.45 65.4 Favored 'General case' 0 N--CA 1.432 -1.341 0 CA-C-N 114.082 -1.417 . . . . 64.01 111.799 -175.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.479 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 15.0 p -51.52 -48.02 63.11 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 124.014 0.821 . . . . 72.52 111.807 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.5 -45.36 85.01 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.878 0.871 . . . . 72.02 111.691 178.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.405 ' HD2' ' HA ' ' A' ' 36' ' ' LYS . 24.7 mmmt -68.9 -38.47 79.65 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 120.71 -0.396 . . . . 71.24 111.638 177.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.631 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 99.0 mt -58.61 -30.95 67.64 Favored 'General case' 0 C--O 1.217 -0.639 0 C-N-CA 123.335 0.654 . . . . 74.51 111.118 179.059 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.479 ' HG3' ' O ' ' A' ' 34' ' ' SER . 51.5 mtm180 -61.87 -30.97 71.22 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.743 0.417 . . . . 73.12 111.841 -178.126 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.7 t -84.08 -27.07 28.51 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-O 121.645 0.736 . . . . 62.5 110.185 -177.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.459 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.6 m-85 -89.75 -54.74 3.93 Favored 'General case' 0 C--N 1.309 -1.181 0 CA-C-N 115.631 -0.713 . . . . 75.13 112.518 -179.626 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.565 HD22 ' SD ' ' A' ' 44' ' ' MET . 9.9 mp -87.49 121.22 71.23 Favored Pre-proline 0 C--N 1.311 -1.088 0 N-CA-C 112.627 0.603 . . . . 71.24 112.627 -179.959 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 70.8 Cg_endo -84.14 -15.9 6.43 Favored 'Trans proline' 0 C--N 1.317 -1.082 0 C-N-CA 122.105 1.87 . . . . 74.23 110.49 173.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 9.3 t -115.15 27.83 9.12 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.292 -0.867 . . . . 64.11 110.004 -178.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.637 ' HG2' HD23 ' A' ' 46' ' ' LEU . 5.3 tpt -58.2 111.4 1.19 Allowed 'General case' 0 N--CA 1.434 -1.25 0 N-CA-C 113.828 1.047 . . . . 73.21 113.828 -174.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -99.6 68.63 1.58 Allowed 'General case' 0 C--N 1.292 -1.928 0 N-CA-C 107.663 -1.236 . . . . 70.33 107.663 174.25 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.637 HD23 ' HG2' ' A' ' 44' ' ' MET . 3.0 pp -95.1 -20.64 19.12 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 114.888 -1.051 . . . . 75.41 111.068 -174.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -80.51 -17.9 50.16 Favored 'General case' 0 C--N 1.311 -1.099 0 CA-C-N 115.124 -0.944 . . . . 74.52 110.696 -174.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 61.9 m -93.32 74.87 4.56 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 114.771 -1.104 . . . . 54.44 112.06 -175.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 4.5 p -89.91 84.73 6.23 Favored 'General case' 0 N--CA 1.412 -2.369 0 CA-C-O 121.944 0.878 . . . . 74.23 110.009 175.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -66.52 -28.64 68.72 Favored 'General case' 0 CA--C 1.503 -0.835 0 CA-C-N 114.713 -1.13 . . . . 72.33 111.563 177.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.2 mm-40 -123.53 164.34 29.03 Favored Pre-proline 1 N--CA 1.369 -4.481 0 N-CA-C 105.215 -2.142 . . . . 74.12 105.215 177.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.492 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 29.0 Cg_endo -65.68 -155.19 0.03 OUTLIER 'Trans proline' 0 CA--C 1.551 1.345 0 C-N-CA 122.562 2.175 . . . . 72.33 112.592 176.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.7 m -75.52 37.45 0.14 Allowed 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.453 0.701 . . . . 72.24 110.739 -179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.492 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 5.0 m-20 -60.59 147.54 83.31 Favored Pre-proline 0 N--CA 1.441 -0.92 0 C-N-CA 124.822 1.249 . . . . 74.42 113.227 -176.629 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -43.52 -50.52 6.82 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 124.411 3.407 . . . . 74.54 113.688 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.9 mm-40 -74.89 -18.96 60.34 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 113.407 0.892 . . . . 71.42 113.407 -178.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.473 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 90.5 t -75.43 -42.4 42.76 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.129 0 N-CA-C 107.611 -1.255 . . . . 71.22 107.611 175.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.4 mm -66.2 -42.03 90.35 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.19 0 CA-C-N 115.09 -0.959 . . . . 72.43 108.854 175.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.3 t-160 -54.52 -45.74 73.42 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 124.878 1.271 . . . . 73.41 112.854 -176.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.452 ' HG2' ' O ' ' A' ' 57' ' ' VAL . 6.7 ptm180 -64.59 -31.55 72.82 Favored 'General case' 0 N--CA 1.416 -2.151 0 CA-C-N 118.549 0.613 . . . . 65.32 111.792 -179.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.473 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 68.0 mt-30 -72.52 -44.01 62.79 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-O 121.574 0.702 . . . . 73.34 109.435 -177.287 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -73.11 -33.09 65.37 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 114.859 -1.064 . . . . 72.02 110.429 -178.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.414 ' HA ' ' CD2' ' A' ' 66' ' ' PHE . 26.1 t-20 -56.83 -52.4 65.25 Favored 'General case' 0 C--N 1.315 -0.896 0 C-N-CA 124.095 0.958 . . . . 74.14 109.854 175.027 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.517 ' CB ' HD21 ' A' ' 41' ' ' LEU . 21.8 mmt180 -56.71 -29.55 62.55 Favored 'General case' 0 C--N 1.299 -1.597 0 CA-C-N 114.36 -1.291 . . . . 74.54 113.474 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.419 HD21 HD23 ' A' ' 37' ' ' LEU . 56.2 mt -68.79 -45.07 72.27 Favored 'General case' 0 CA--C 1.497 -1.081 0 C-N-CA 121.125 -0.23 . . . . 73.42 110.863 176.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.414 ' CD2' ' HA ' ' A' ' 63' ' ' ASN . 0.5 OUTLIER -70.3 -25.21 63.22 Favored 'General case' 0 N--CA 1.438 -1.064 0 C-N-CA 119.807 -0.757 . . . . 71.12 109.62 -179.54 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.19 -30.38 67.47 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 115.437 -0.801 . . . . 51.41 110.719 175.542 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.48 ' HB2' HG21 ' A' ' 72' ' ' THR . 42.1 mm-40 -66.35 -38.72 88.26 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 109.003 -0.74 . . . . 44.25 109.003 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -179.59 139.56 3.91 Favored Glycine 0 N--CA 1.404 -3.449 0 CA-C-N 114.575 -1.193 . . . . 53.5 111.29 -176.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.579 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -66.01 -31.47 72.39 Favored 'General case' 0 C--N 1.313 -1.018 0 N-CA-C 106.022 -1.844 . . . . 74.43 106.022 171.166 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.64 -41.84 44.29 Favored 'General case' 0 N--CA 1.425 -1.688 0 CA-C-N 114.059 -1.428 . . . . 63.51 108.975 178.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.48 HG21 ' HB2' ' A' ' 68' ' ' GLN . 89.6 m -53.35 -41.27 65.63 Favored 'General case' 0 C--N 1.346 0.421 0 C-N-CA 122.845 0.458 . . . . 65.15 110.276 175.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.9 t-105 -62.63 -50.98 69.1 Favored 'General case' 0 N--CA 1.434 -1.256 0 CA-C-N 115.693 -0.685 . . . . 73.42 110.358 177.263 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.579 ' HG3' ' O ' ' A' ' 70' ' ' MET . 87.5 mttt -55.42 -42.76 74.57 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 122.616 0.366 . . . . 65.33 111.374 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 39.9 m -66.12 -46.99 75.6 Favored 'General case' 0 N--CA 1.409 -2.5 0 C-N-CA 123.355 0.662 . . . . 75.5 110.674 179.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -57.14 -50.83 71.59 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 115.746 -0.661 . . . . 74.31 110.624 177.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.445 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 32.1 mm -59.76 -32.77 50.31 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.055 0 CA-C-N 115.439 -0.8 . . . . 74.44 111.607 -177.712 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.8 t-20 -64.71 -43.53 93.16 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 109.568 -0.53 . . . . 74.33 109.568 177.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -72.24 -37.9 69.02 Favored 'General case' 0 C--O 1.189 -2.096 0 CA-C-N 116.403 -0.362 . . . . 73.04 110.385 178.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.445 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.0 tm? -49.53 -54.59 17.16 Favored 'General case' 0 C--N 1.309 -1.195 0 C-N-CA 125.402 1.481 . . . . 75.12 110.135 -179.493 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 38.8 m -67.82 -35.21 78.21 Favored 'General case' 0 C--N 1.306 -1.308 0 CA-C-N 115.942 -0.572 . . . . 44.24 111.09 -178.016 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.1 t80 -75.81 -48.77 20.27 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.838 -0.619 . . . . 71.23 111.393 -176.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 27.2 mt-10 -71.33 -27.06 63.11 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 122.906 0.482 . . . . 75.32 111.755 -175.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.485 HD13 HD12 ' A' ' 25' ' ' LEU . 85.8 mt -92.26 -3.54 55.34 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-N 116.192 -0.458 . . . . 63.25 109.955 177.366 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.3 t70 59.24 38.72 23.29 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.021 1.328 . . . . 61.31 111.551 174.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.8 m -120.0 105.44 42.64 Favored Pre-proline 0 C--N 1.304 -1.375 0 CA-C-N 115.245 -0.889 . . . . 71.4 111.241 -178.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_exo -71.75 102.64 1.34 Allowed 'Trans proline' 0 N--CA 1.455 -0.765 0 C-N-CA 121.963 1.776 . . . . 64.42 108.959 175.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 90.2 mt -96.79 -14.94 21.6 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.437 0.532 . . . . 73.12 112.437 -173.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.7 t70 70.69 -64.84 0.36 Allowed 'General case' 0 N--CA 1.49 1.543 0 C-N-CA 124.709 1.204 . . . . 62.41 110.572 -178.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.425 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . 23.9 ptp -77.31 35.11 0.17 Allowed 'General case' 0 C--N 1.305 -1.337 0 C-N-CA 125.68 1.592 . . . . 63.02 112.411 -175.435 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.7 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 17.8 tt0 -58.9 -36.12 74.17 Favored 'General case' 0 C--O 1.186 -2.246 0 C-N-CA 125.831 1.652 . . . . 74.4 110.039 178.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.522 ' O ' HG22 ' A' ' 95' ' ' VAL . 47.1 mm -70.88 -45.29 15.72 Favored Pre-proline 0 C--O 1.176 -2.791 0 O-C-N 121.268 -0.895 . . . . 70.52 109.484 179.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.425 ' HG2' ' HB2' ' A' ' 90' ' ' MET . 21.4 Cg_exo -47.62 -38.21 28.31 Favored 'Trans proline' 0 CA--C 1.554 1.498 0 CA-C-N 121.2 1.464 . . . . 71.14 111.855 164.83 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.7 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 8.9 mp -59.6 -47.74 84.39 Favored 'General case' 0 N--CA 1.48 1.069 0 N-CA-C 108.688 -0.856 . . . . 73.2 108.688 171.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.621 HG13 ' O ' ' A' ' 91' ' ' GLU . 3.7 m -64.91 -35.63 75.77 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.897 0 CA-C-O 122.267 1.032 . . . . 72.21 111.381 -177.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 8.0 t -83.94 6.05 23.23 Favored 'General case' 0 C--N 1.276 -2.62 0 C-N-CA 125.715 1.606 . . . . 63.03 111.87 -176.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.475 HG12 ' CE3' ' A' ' 19' ' ' TRP . 3.0 tp -65.47 -18.56 24.09 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.848 0 N-CA-C 108.336 -0.987 . . . . 74.13 108.336 176.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 75.3 t90 -62.96 104.49 0.56 Allowed 'General case' 0 N--CA 1.42 -1.96 0 C-N-CA 125.541 1.536 . . . . 70.22 108.194 176.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 172.75 -168.09 41.08 Favored Glycine 0 C--N 1.286 -2.233 0 N-CA-C 110.039 -1.224 . . . . 43.1 110.039 -179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 19.5 Cg_endo -90.82 38.99 0.34 Allowed 'Trans proline' 0 C--O 1.246 0.885 0 C-N-CA 123.241 2.627 . . . . 54.31 111.544 -178.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 71.4 ttt180 . . . . . 0 N--CA 1.401 -2.882 0 CA-C-N 114.632 -1.167 . . . . 62.22 108.054 -178.109 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.495 -1.173 0 N-CA-C 110.918 -0.873 . . . . 13.42 110.918 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -78.15 165.7 25.58 Favored 'Trans proline' 0 C--O 1.258 1.478 0 C-N-CA 121.94 1.76 . . . . 73.13 112.181 -179.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.8 mt -92.22 -43.22 9.43 Favored 'General case' 0 C--N 1.287 -2.141 0 N-CA-C 106.439 -1.689 . . . . 71.22 106.439 176.31 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 67.88 -92.04 0.24 Allowed Glycine 0 CA--C 1.499 -0.946 0 CA-C-N 114.897 -1.047 . . . . 73.41 110.644 -179.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 20.3 m 71.55 -9.0 0.97 Allowed 'General case' 0 C--O 1.239 0.509 0 C-N-CA 124.858 1.263 . . . . 72.54 113.694 175.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 40.9 ttm 62.77 34.38 14.65 Favored 'General case' 0 C--O 1.238 0.474 0 CA-C-O 123.305 1.526 . . . . 64.3 107.466 -171.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -157.41 26.08 0.29 Allowed 'General case' 0 C--N 1.303 -1.437 0 CA-C-N 112.335 -2.211 . . . . 61.34 108.312 -179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.666 ' HA ' HG12 ' A' ' 11' ' ' ILE . . . -61.81 -13.34 23.04 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.286 -0.87 . . . . 70.34 112.955 -178.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.63 -37.62 84.63 Favored 'General case' 0 C--N 1.312 -1.057 0 C-N-CA 123.652 0.781 . . . . 75.22 109.745 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 24.1 m -75.78 -17.66 59.79 Favored 'General case' 0 N--CA 1.419 -1.994 0 CA-C-N 114.051 -1.432 . . . . 70.22 110.541 -174.425 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.666 HG12 ' HA ' ' A' ' 8' ' ' ALA . 6.6 mm -87.6 -44.31 15.92 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.435 0 CA-C-N 115.412 -0.813 . . . . 71.24 110.247 -174.608 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -104.13 -45.33 4.75 Favored 'General case' 0 N--CA 1.435 -1.183 0 N-CA-C 114.431 1.271 . . . . 74.45 114.431 -174.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 54.91 83.64 0.08 Allowed 'General case' 0 C--N 1.344 0.368 0 N-CA-C 108.896 -0.779 . . . . 73.33 108.896 -166.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.474 ' OD1' ' HB3' ' A' ' 18' ' ' LEU . 5.5 t-20 -120.31 -168.51 1.64 Allowed 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 116.122 -0.49 . . . . 72.34 110.109 -170.353 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.628 ' O ' HD12 ' A' ' 18' ' ' LEU . 5.6 t-20 -148.98 -173.05 4.26 Favored 'General case' 0 CA--C 1.551 1.015 0 N-CA-C 109.19 -0.671 . . . . 74.35 109.19 -176.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -48.14 -27.48 2.39 Favored 'General case' 0 N--CA 1.509 2.508 0 C-N-CA 128.192 2.597 . . . . 72.15 114.099 -171.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 15.2 t-20 -57.98 -28.97 64.86 Favored 'General case' 0 C--N 1.307 -1.252 0 C-N-CA 123.09 0.556 . . . . 73.41 110.975 -179.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.643 ' HB2' ' SD ' ' A' ' 90' ' ' MET . 0.0 OUTLIER -62.17 -33.33 74.32 Favored 'General case' 0 N--CA 1.444 -0.729 0 CA-C-N 115.533 -0.758 . . . . 71.32 110.653 179.807 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.492 ' N ' HD13 ' A' ' 18' ' ' LEU . 75.9 t-105 -68.43 -32.43 72.46 Favored 'General case' 0 N--CA 1.429 -1.502 0 CA-C-N 115.672 -0.695 . . . . 72.31 110.117 -179.503 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.95 -31.18 70.73 Favored 'General case' 0 C--O 1.242 0.666 0 CA-C-O 121.093 0.473 . . . . 45.34 109.971 178.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.581 ' CZ2' ' HG ' ' A' ' 25' ' ' LEU . 73.4 t90 -63.09 -50.07 71.97 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 108.635 -0.876 . . . . 73.51 108.635 173.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -55.06 -53.23 58.52 Favored 'General case' 0 CA--C 1.516 -0.361 0 O-C-N 124.509 1.13 . . . . 73.43 110.415 -176.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 79.8 t -53.82 -53.64 25.39 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 O-C-N 123.8 0.688 . . . . 72.25 112.052 -177.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.503 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 26.6 mmt180 -74.57 -32.01 62.25 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 113.233 0.827 . . . . 64.1 113.233 -176.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.581 ' HG ' ' CZ2' ' A' ' 21' ' ' TRP . 1.8 tm? -70.59 -42.64 70.75 Favored 'General case' 0 C--N 1.304 -1.403 0 N-CA-C 108.699 -0.852 . . . . 63.13 108.699 -178.521 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.513 HD13 HD23 ' A' ' 33' ' ' LEU . 1.2 mt -70.76 -24.63 62.64 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-N 115.924 -0.58 . . . . 22.13 111.185 177.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 25.0 p -69.71 -11.95 61.25 Favored 'General case' 0 CA--C 1.547 0.834 0 CA-C-O 121.907 0.86 . . . . 64.24 108.854 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.503 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 36.9 mtmt -99.56 -9.87 22.74 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 109.307 -0.627 . . . . 62.41 109.307 177.472 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.441 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.3 m-80 -133.62 53.39 10.2 Favored Pre-proline 0 C--O 1.24 0.578 0 CA-C-N 115.664 -0.698 . . . . 72.53 111.934 -175.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.441 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -70.07 -22.19 31.01 Favored 'Trans proline' 0 C--N 1.363 1.335 0 N-CA-C 108.472 -1.395 . . . . 72.22 108.472 179.278 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -67.11 -41.86 85.49 Favored 'General case' 0 N--CA 1.422 -1.835 0 CA-C-N 113.325 -1.762 . . . . 72.25 109.929 178.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.493 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 73.5 t90 -73.83 -43.04 59.95 Favored 'General case' 0 N--CA 1.45 -0.432 0 C-N-CA 119.646 -0.822 . . . . 73.44 109.47 179.969 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.513 HD23 HD13 ' A' ' 26' ' ' LEU . 2.0 tm? -60.36 -43.26 96.71 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.105 -0.952 . . . . 74.1 110.344 -174.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.9 m -63.98 -35.16 79.77 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 120.799 0.333 . . . . 71.21 111.625 178.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -65.24 -35.26 80.49 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-O 121.261 0.553 . . . . 32.24 110.172 178.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.5 mmtt -76.74 -40.61 47.95 Favored 'General case' 0 N--CA 1.425 -1.697 0 C-N-CA 120.117 -0.633 . . . . 74.53 112.609 173.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.497 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 78.0 mt -51.56 -41.7 61.32 Favored 'General case' 0 C--O 1.211 -0.957 0 C-N-CA 123.189 0.596 . . . . 51.43 111.938 179.485 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.475 ' HA ' ' HG2' ' A' ' 44' ' ' MET . 0.1 OUTLIER -59.54 -28.06 66.76 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 114.383 1.253 . . . . 74.43 114.383 -177.673 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 30.4 t -77.06 -40.45 46.22 Favored 'General case' 0 C--N 1.282 -2.337 0 CA-C-N 115.745 -0.661 . . . . 64.41 110.133 178.618 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . . . . . . . . . 74.7 m-85 -81.84 -47.25 13.04 Favored 'General case' 0 C--N 1.311 -1.069 0 C-N-CA 123.655 0.782 . . . . 74.54 112.637 -176.167 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 7.8 mp -80.9 124.89 81.17 Favored Pre-proline 0 C--N 1.303 -1.446 0 C-N-CA 123.379 0.672 . . . . 73.35 109.867 179.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -72.01 -36.47 5.88 Favored 'Trans proline' 0 CA--C 1.539 0.736 0 C-N-CA 123.045 2.497 . . . . 75.31 114.014 -177.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 26.5 p -106.12 -5.59 19.26 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 121.775 0.798 . . . . 71.23 110.316 -177.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.475 ' HG2' ' HA ' ' A' ' 38' ' ' ARG . 2.0 mpp? 40.68 92.18 0.01 OUTLIER 'General case' 0 N--CA 1.408 -2.572 0 C-N-CA 127.69 2.396 . . . . 64.34 115.735 -175.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -101.62 70.03 1.25 Allowed 'General case' 0 C--N 1.296 -1.737 0 CA-C-O 122.733 1.254 . . . . 63.54 108.459 168.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.6 pp -95.79 -5.13 42.59 Favored 'General case' 0 N--CA 1.437 -1.076 0 CA-C-N 113.146 -1.843 . . . . 63.21 110.607 -176.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -75.84 47.35 0.42 Allowed 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 125.388 1.475 . . . . 71.24 110.436 -179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.4 m -86.08 -3.47 58.95 Favored 'General case' 0 C--N 1.306 -1.307 0 CA-C-N 115.629 -0.714 . . . . 74.35 112.715 -176.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 50.7 m -82.95 65.39 8.05 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.769 0.795 . . . . 63.31 112.733 -178.221 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -80.41 -28.22 37.88 Favored 'General case' 0 CA--C 1.495 -1.142 0 CA-C-O 122.921 1.343 . . . . 75.42 109.931 172.601 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.447 ' HB3' ' HD2' ' A' ' 52' ' ' PRO . 54.1 mt-10 -116.22 173.39 3.06 Favored Pre-proline 1 N--CA 1.375 -4.185 0 N-CA-C 104.919 -2.252 . . . . 73.44 104.919 175.91 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.447 ' HD2' ' HB3' ' A' ' 51' ' ' GLU . 50.8 Cg_endo -66.85 -156.52 0.03 OUTLIER 'Trans proline' 0 CA--C 1.558 1.686 0 C-N-CA 121.296 1.331 . . . . 64.14 112.074 175.115 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.6 m -76.1 38.4 0.17 Allowed 'General case' 0 CA--C 1.557 1.244 0 C-N-CA 124.194 0.998 . . . . 62.11 112.417 -175.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.412 ' HB2' HG23 ' A' ' 57' ' ' VAL . 86.2 m-20 -60.08 148.39 77.96 Favored Pre-proline 0 N--CA 1.438 -1.054 0 C-N-CA 125.156 1.382 . . . . 74.52 112.308 -179.062 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -58.61 -32.93 97.74 Favored 'Trans proline' 0 CA--C 1.533 0.47 0 C-N-CA 123.129 2.553 . . . . 65.11 112.781 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.2 mp0 -68.95 -40.39 78.96 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 108.591 -0.892 . . . . 61.03 108.591 179.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.412 HG23 ' HB2' ' A' ' 54' ' ' ASN . 78.1 t -63.59 -48.57 86.25 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.917 0 CA-C-N 114.191 -1.368 . . . . 54.51 109.234 178.531 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.535 ' HA ' HE21 ' A' ' 61' ' ' GLN . 46.4 mm -59.81 -46.58 93.52 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.89 0 CA-C-N 115.223 -0.899 . . . . 61.51 110.443 177.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 -57.15 -38.8 74.08 Favored 'General case' 0 C--O 1.202 -1.406 0 CA-C-O 119.404 -0.331 . . . . 60.13 111.59 -178.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.407 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 46.5 ttt180 -61.39 -40.56 94.79 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 121.851 0.834 . . . . 74.34 111.281 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.535 HE21 ' HA ' ' A' ' 58' ' ' ILE . 50.1 mt-30 -67.23 -47.15 71.67 Favored 'General case' 0 C--N 1.293 -1.89 0 CA-C-N 114.434 -1.257 . . . . 74.31 110.317 -177.676 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -70.94 -31.04 67.52 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.553 -1.203 . . . . 73.44 111.151 179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.407 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 2.8 t-20 -54.78 -51.13 66.72 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 124.616 1.166 . . . . 71.42 110.015 176.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -55.14 -31.33 61.22 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 114.66 -1.154 . . . . 70.35 113.077 177.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 63.8 mt -72.64 -43.73 62.84 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 112.273 0.472 . . . . 64.14 112.273 -179.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -69.96 -25.61 63.72 Favored 'General case' 0 C--N 1.314 -0.953 0 N-CA-C 108.717 -0.846 . . . . 74.1 108.717 178.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -70.02 -31.27 68.83 Favored 'General case' 0 N--CA 1.445 -0.714 0 CA-C-N 115.338 -0.846 . . . . 73.04 110.832 174.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.44 ' HB2' HG21 ' A' ' 72' ' ' THR . 48.5 mm-40 -68.21 -41.6 81.08 Favored 'General case' 0 N--CA 1.43 -1.451 0 N-CA-C 109.049 -0.723 . . . . 72.42 109.049 176.078 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.79 142.34 4.79 Favored Glycine 0 N--CA 1.421 -2.328 0 CA-C-N 114.986 -1.006 . . . . 64.24 112.365 -177.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 26.2 ptm -69.17 -26.57 64.92 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 106.498 -1.667 . . . . 64.12 106.498 170.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.415 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . . . -75.67 -46.9 28.73 Favored 'General case' 0 N--CA 1.428 -1.572 0 CA-C-N 113.684 -1.598 . . . . 74.34 108.004 175.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.44 HG21 ' HB2' ' A' ' 68' ' ' GLN . 84.9 m -53.55 -41.72 66.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 O-C-N 123.836 0.71 . . . . 75.31 110.339 177.153 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.574 ' O ' HG12 ' A' ' 77' ' ' ILE . 75.9 t-105 -60.17 -49.43 77.67 Favored 'General case' 0 N--CA 1.438 -1.063 0 CA-C-N 115.424 -0.807 . . . . 74.23 111.466 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.415 ' HE3' ' HA ' ' A' ' 71' ' ' ALA . 9.4 ptpt -69.59 -35.02 74.94 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-O 121.134 0.492 . . . . 53.2 111.479 -174.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 51.0 m -67.58 -42.45 82.49 Favored 'General case' 0 N--CA 1.405 -2.712 0 CA-C-N 115.632 -0.713 . . . . 35.11 110.361 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 51.7 t80 -57.4 -49.62 75.62 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 123.601 0.761 . . . . 73.14 111.522 176.468 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.599 HG21 ' HB2' ' A' ' 94' ' ' LEU . 47.2 mm -59.0 -33.87 51.34 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.904 0 CA-C-N 115.466 -0.788 . . . . 74.25 111.852 -175.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 28.6 t-20 -64.1 -39.02 93.15 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.965 0.412 . . . . 70.23 110.266 178.193 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.447 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 2.4 m-20 -74.51 -36.01 63.2 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-O 120.942 0.401 . . . . 65.43 110.474 176.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.496 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.0 tm? -54.4 -54.54 39.2 Favored 'General case' 0 C--N 1.314 -0.96 0 C-N-CA 124.715 1.206 . . . . 71.54 110.225 176.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 29.9 p -66.9 -32.67 74.07 Favored 'General case' 0 N--CA 1.434 -1.269 0 CA-C-N 115.81 -0.632 . . . . 74.23 111.394 -178.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -71.27 -54.75 9.79 Favored 'General case' 0 C--N 1.309 -1.175 0 CA-C-N 115.04 -0.982 . . . . 74.12 111.926 -176.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.447 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 19.8 mt-10 -73.31 -22.28 60.37 Favored 'General case' 0 CA--C 1.508 -0.666 0 N-CA-C 112.52 0.563 . . . . 71.41 112.52 -171.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 82.9 mt -86.97 -2.26 58.48 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 120.492 -0.483 . . . . 63.24 111.548 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.6 t70 72.9 -32.02 0.24 Allowed 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 114.546 1.313 . . . . 70.52 114.546 174.754 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.46 ' O ' HD23 ' A' ' 88' ' ' LEU . 61.4 t -48.68 124.43 12.24 Favored Pre-proline 0 C--N 1.322 -0.593 0 C-N-CA 124.367 1.067 . . . . 65.4 111.891 -178.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 84.8 Cg_endo -80.27 44.01 1.64 Allowed 'Trans proline' 0 CA--C 1.541 0.864 0 C-N-CA 123.462 2.774 . . . . 75.4 111.696 178.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.539 ' H ' HD23 ' A' ' 88' ' ' LEU . 2.0 pt? -62.88 -48.47 78.83 Favored 'General case' 0 N--CA 1.45 -0.425 0 CA-C-N 116.506 -0.315 . . . . 54.13 111.326 -177.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.471 ' O ' ' HB1' ' A' ' 8' ' ' ALA . 48.2 m-20 56.3 31.27 18.25 Favored 'General case' 0 N--CA 1.478 0.933 0 CA-C-O 122.139 0.971 . . . . 65.32 111.856 -176.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.643 ' SD ' ' HB2' ' A' ' 18' ' ' LEU . 50.4 mtt -99.76 13.99 31.78 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 108.116 -1.068 . . . . 64.13 108.116 178.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.669 ' O ' HG13 ' A' ' 95' ' ' VAL . 3.3 tt0 -47.14 -60.92 2.15 Favored 'General case' 0 C--O 1.198 -1.652 0 C-N-CA 125.184 1.394 . . . . 51.5 113.35 -174.149 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 34.4 mm -64.14 -44.03 75.9 Favored Pre-proline 0 C--O 1.201 -1.48 0 CA-C-N 119.111 0.869 . . . . 61.11 111.717 -178.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -48.37 -35.49 27.98 Favored 'Trans proline' 0 CA--C 1.552 1.422 0 C-N-CA 121.476 1.451 . . . . 70.55 111.763 170.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.599 ' HB2' HG21 ' A' ' 77' ' ' ILE . 3.3 mm? -67.98 -51.97 41.23 Favored 'General case' 0 C--O 1.202 -1.406 0 N-CA-C 109.078 -0.712 . . . . 71.54 109.078 169.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.669 HG13 ' O ' ' A' ' 91' ' ' GLU . 2.7 m -60.44 -37.57 75.03 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.486 0 CA-C-O 122.062 0.934 . . . . 73.12 113.204 -171.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.1 t -93.52 6.17 49.11 Favored 'General case' 0 C--N 1.26 -3.312 0 CA-C-N 114.146 -1.388 . . . . 71.43 111.774 -174.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.433 HG22 ' O ' ' A' ' 94' ' ' LEU . 8.3 tt -55.24 -39.73 52.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 112.833 0.679 . . . . 64.24 112.833 -176.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 43.7 m95 -112.21 163.86 13.86 Favored 'General case' 0 N--CA 1.411 -2.377 0 N-CA-C 107.608 -1.256 . . . . 73.51 107.608 179.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -152.51 143.17 10.02 Favored Glycine 0 C--N 1.272 -2.995 0 CA-C-N 115.584 -0.734 . . . . 73.21 111.279 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -74.31 44.3 1.02 Allowed 'Trans proline' 0 N--CA 1.484 0.944 0 C-N-CA 123.724 2.949 . . . . 73.54 112.495 179.688 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 . . . . . 0 N--CA 1.402 -2.835 0 N-CA-C 106.971 -1.492 . . . . 73.22 106.971 -179.673 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.698 0 N-CA-C 111.759 -0.537 . . . . 60.24 111.759 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.7 Cg_exo -57.89 129.11 31.73 Favored 'Trans proline' 0 N--CA 1.479 0.633 0 C-N-CA 123.579 2.852 . . . . 52.33 113.873 -177.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 83.5 mt -125.62 173.59 8.87 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-N 115.935 -0.575 . . . . 65.24 109.89 177.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 78.09 -70.82 2.51 Favored Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 110.931 -0.868 . . . . 73.32 110.931 -176.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 43.3 m -108.86 122.07 46.42 Favored 'General case' 0 N--CA 1.423 -1.796 0 N-CA-C 107.644 -1.243 . . . . 61.21 107.644 176.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.521 ' O ' ' HG3' ' A' ' 9' ' ' GLU . 2.2 mpt? -118.37 12.38 13.33 Favored 'General case' 0 C--O 1.206 -1.223 0 N-CA-C 111.961 0.356 . . . . 65.01 111.961 -176.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.33 25.33 1.21 Allowed 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 113.328 0.862 . . . . 71.43 113.328 -175.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.505 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.21 -15.7 58.56 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-O 121.821 0.82 . . . . 60.24 108.987 172.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.541 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -56.68 -41.36 77.16 Favored 'General case' 0 C--N 1.312 -1.051 0 C-N-CA 124.643 1.177 . . . . 74.21 114.001 -179.251 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.572 ' HB2' HD12 ' A' ' 11' ' ' ILE . 74.7 m -55.06 -36.64 65.81 Favored 'General case' 0 C--N 1.304 -1.393 0 C-N-CA 125.058 1.343 . . . . 64.15 110.36 175.22 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.572 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -81.73 -29.71 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.969 0 C-N-CA 125.164 1.386 . . . . 64.45 109.672 -175.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 36.5 mmt180 -76.6 -64.88 1.02 Allowed 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 115.87 -0.604 . . . . 73.53 112.486 -177.243 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -175.42 -75.98 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 110.048 -0.353 . . . . 73.33 110.048 -175.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 34.6 t30 65.31 109.12 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.035 0 C-N-CA 124.377 1.071 . . . . 73.11 111.644 -178.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.471 ' H ' HD23 ' A' ' 18' ' ' LEU . 28.0 t-20 -172.78 163.4 5.07 Favored 'General case' 0 N--CA 1.476 0.864 0 O-C-N 122.358 -0.214 . . . . 74.23 110.463 -176.537 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -54.04 -27.88 35.03 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.519 1.528 . . . . 73.02 111.472 177.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -57.2 -28.13 62.59 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 112.599 0.592 . . . . 61.12 112.599 177.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.632 HD12 HD22 ' A' ' 94' ' ' LEU . 3.6 mm? -71.1 -34.59 71.26 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.219 0.533 . . . . 71.02 109.741 176.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.454 ' HB2' HD11 ' A' ' 97' ' ' ILE . 74.2 t-105 -65.98 -42.34 89.98 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.401 -0.818 . . . . 75.13 110.236 -178.026 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.72 -42.65 97.71 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.061 -0.518 . . . . 72.43 110.35 178.468 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 39.0 t-105 -59.41 -50.44 73.93 Favored 'General case' 0 C--O 1.234 0.281 0 CA-C-N 116.103 -0.499 . . . . 74.21 110.531 176.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.446 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -57.3 -53.31 59.61 Favored 'General case' 0 C--N 1.327 -0.394 0 O-C-N 123.94 0.775 . . . . 75.43 109.551 -179.278 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 47.5 t -60.36 -46.96 94.29 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.01 0 N-CA-C 112.849 0.685 . . . . 62.2 112.849 -177.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 28.7 mtm180 -72.3 -36.79 69.03 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 112.301 0.482 . . . . 72.1 112.301 -174.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.67 -40.8 63.41 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 108.943 -0.762 . . . . 62.13 108.943 -179.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.569 HD13 HD23 ' A' ' 33' ' ' LEU . 3.6 mt -71.36 -24.14 62.04 Favored 'General case' 0 CA--C 1.493 -1.216 0 N-CA-C 112.656 0.613 . . . . 73.2 112.656 178.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 22.0 t -62.81 -20.96 65.54 Favored 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 108.275 -1.009 . . . . 61.21 108.275 174.275 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 5.0 mtmp? -97.46 -0.05 46.8 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-O 121.061 0.458 . . . . 62.11 110.218 177.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.415 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.2 m-80 -139.36 54.66 6.22 Favored Pre-proline 0 C--O 1.245 0.825 0 C-N-CA 122.886 0.474 . . . . 73.51 111.352 -177.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.415 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 12.5 Cg_exo -71.22 -21.66 26.67 Favored 'Trans proline' 0 C--N 1.36 1.176 0 C-N-CA 121.247 1.298 . . . . 74.3 108.808 -179.127 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -71.71 -36.61 70.59 Favored 'General case' 0 N--CA 1.427 -1.588 0 CA-C-N 113.625 -1.625 . . . . 72.21 110.437 -179.788 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.468 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 82.0 t90 -75.0 -48.09 25.85 Favored 'General case' 0 N--CA 1.439 -1.002 0 C-N-CA 119.518 -0.873 . . . . 72.32 110.016 177.172 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.569 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -56.76 -45.65 81.94 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 114.822 -1.081 . . . . 70.54 111.172 -172.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.516 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 10.6 p -57.81 -44.93 86.71 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.126 -0.488 . . . . 74.11 112.21 178.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.87 -44.35 78.03 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 124.106 0.963 . . . . 51.42 111.598 177.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.468 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 70.7 mmtt -71.38 -29.67 65.22 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 120.933 -0.307 . . . . 74.23 111.548 176.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.562 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 81.6 mt -62.7 -36.07 81.74 Favored 'General case' 0 C--O 1.214 -0.769 0 N-CA-C 110.263 -0.273 . . . . 73.43 110.263 174.474 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.516 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -63.39 -35.22 79.69 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 121.63 0.729 . . . . 51.05 109.769 -179.477 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.45 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 47.8 m -71.91 -47.47 52.33 Favored 'General case' 0 N--CA 1.392 -3.374 0 C-N-CA 124.883 1.273 . . . . 71.13 111.902 179.551 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.529 ' CD1' HG23 ' A' ' 72' ' ' THR . 52.8 m-85 -84.61 -46.48 11.48 Favored 'General case' 0 C--N 1.309 -1.168 0 N-CA-C 114.059 1.133 . . . . 73.14 114.059 -174.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 1.9 mm? -95.85 112.83 60.61 Favored Pre-proline 0 N--CA 1.424 -1.739 0 C-N-CA 122.317 0.247 . . . . 74.51 110.423 -175.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_exo -66.83 -37.9 18.97 Favored 'Trans proline' 0 C--O 1.217 -0.542 0 C-N-CA 122.303 2.002 . . . . 72.44 111.193 178.411 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.8 t -103.95 30.15 5.36 Favored 'General case' 0 C--N 1.307 -1.264 0 CA-C-N 115.613 -0.722 . . . . 73.3 110.787 -177.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.555 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -43.61 131.78 5.06 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 115.294 1.59 . . . . 71.25 115.294 178.343 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 42.3 m-20 -124.81 59.77 1.2 Allowed 'General case' 0 C--N 1.276 -2.598 0 CA-C-N 114.499 -1.228 . . . . 73.22 109.198 177.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.2 pp -84.55 -16.53 41.93 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.336 -1.302 . . . . 65.14 110.079 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -71.35 -18.14 62.39 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 114.927 -1.033 . . . . 73.22 110.124 177.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 60.9 m -80.69 84.4 6.25 Favored 'General case' 0 C--N 1.285 -2.223 0 CA-C-N 114.511 -1.222 . . . . 52.21 108.87 176.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 22.2 m -117.19 78.41 1.22 Allowed 'General case' 0 N--CA 1.424 -1.769 0 CA-C-O 121.915 0.864 . . . . 74.04 109.792 -177.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -59.4 -63.89 1.14 Allowed 'General case' 0 C--N 1.302 -1.459 0 CA-C-N 113.543 -1.662 . . . . 62.4 111.334 178.304 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.41 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 10.4 mm-40 -99.78 162.02 22.49 Favored Pre-proline 1 C--N 1.237 -4.313 0 CA-C-N 113.823 -1.535 . . . . 74.52 109.372 -179.492 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.493 ' HG2' ' OD1' ' A' ' 54' ' ' ASN . 17.8 Cg_endo -62.66 -150.66 0.02 OUTLIER 'Trans proline' 0 CA--C 1.561 1.84 0 C-N-CA 124.085 3.19 . . . . 73.34 113.154 175.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.5 m -75.34 37.79 0.13 Allowed 'General case' 0 CA--C 1.572 1.795 0 C-N-CA 123.655 0.782 . . . . 64.21 112.365 -175.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.493 ' OD1' ' HG2' ' A' ' 52' ' ' PRO . 6.0 m-20 -65.54 150.25 96.25 Favored Pre-proline 0 C--N 1.32 -0.683 0 C-N-CA 125.926 1.69 . . . . 73.45 112.687 -178.162 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.7 Cg_endo -53.3 -47.48 27.19 Favored 'Trans proline' 0 C--N 1.354 0.848 0 C-N-CA 123.717 2.944 . . . . 71.1 113.382 -178.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.428 ' HA ' ' HB3' ' A' ' 59' ' ' HIS . 70.8 mm-40 -71.76 -25.73 62.15 Favored 'General case' 0 N--CA 1.431 -1.386 0 N-CA-C 112.971 0.73 . . . . 72.44 112.971 -179.785 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.528 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 95.7 t -66.21 -42.97 92.01 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.196 0 N-CA-C 108.485 -0.932 . . . . 53.34 108.485 176.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.411 ' O ' HD23 ' A' ' 62' ' ' LEU . 49.4 mm -67.14 -46.01 85.31 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.02 0 CA-C-N 115.051 -0.977 . . . . 64.0 109.215 175.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.428 ' HB3' ' HA ' ' A' ' 56' ' ' GLU . 20.2 t-160 -54.22 -40.1 67.34 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 124.114 0.966 . . . . 72.44 110.981 179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 15.6 tpp180 -54.98 -55.69 27.99 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-O 121.768 0.794 . . . . 73.13 110.712 175.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.528 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 60.4 mt-30 -62.26 -34.69 77.02 Favored 'General case' 0 C--N 1.308 -1.221 0 CA-C-N 114.256 -1.338 . . . . 74.45 110.932 -176.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.508 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -77.04 -35.6 56.76 Favored 'General case' 0 C--N 1.289 -2.026 0 CA-C-N 114.903 -1.044 . . . . 73.15 111.926 178.292 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.431 HD22 ' C ' ' A' ' 63' ' ' ASN . 0.2 OUTLIER -57.46 -35.88 70.72 Favored 'General case' 0 N--CA 1.463 0.201 0 C-N-CA 124.227 1.011 . . . . 50.2 108.695 177.321 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.55 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 12.5 mmt180 -55.37 -42.72 74.33 Favored 'General case' 0 C--N 1.291 -1.949 0 CA-C-N 114.486 -1.233 . . . . 70.35 111.534 175.764 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.508 HD12 HD13 ' A' ' 62' ' ' LEU . 78.6 mt -72.22 -33.7 67.77 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-O 121.026 0.441 . . . . 72.23 110.085 -179.59 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.543 ' HA ' ' HE1' ' A' ' 98' ' ' TRP . 90.5 t80 -58.34 -31.17 67.33 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 114.839 -1.073 . . . . 71.41 109.482 174.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -77.59 -34.19 53.58 Favored 'General case' 0 N--CA 1.44 -0.935 0 CA-C-N 115.445 -0.798 . . . . 40.25 111.54 177.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -67.39 -56.7 8.63 Favored 'General case' 0 N--CA 1.433 -1.279 0 N-CA-C 112.116 0.413 . . . . 74.12 112.116 -178.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.67 143.46 5.26 Favored Glycine 0 CA--C 1.474 -2.519 0 C-N-CA 120.005 -1.093 . . . . 44.52 113.299 -172.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.53 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.6 ptt? -70.61 -28.48 64.88 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 107.106 -1.442 . . . . 72.01 107.106 169.794 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.73 -35.78 65.1 Favored 'General case' 0 N--CA 1.441 -0.891 0 CA-C-N 114.41 -1.268 . . . . 74.23 107.949 176.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.529 HG23 ' CD1' ' A' ' 40' ' ' PHE . 98.9 m -65.8 -38.9 90.21 Favored 'General case' 0 N--CA 1.433 -1.324 0 CA-C-N 114.616 -1.175 . . . . 75.32 109.747 175.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.624 ' HD1' HG23 ' A' ' 95' ' ' VAL . 36.9 t-105 -64.37 -42.11 96.36 Favored 'General case' 0 CA--C 1.548 0.885 0 N-CA-C 108.921 -0.77 . . . . 75.41 108.921 177.923 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.835 ' HA ' HG21 ' A' ' 95' ' ' VAL . 93.5 mttt -55.76 -51.78 66.21 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.583 0.353 . . . . 65.52 110.87 175.364 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 24.4 m -61.89 -39.75 93.06 Favored 'General case' 0 N--CA 1.408 -2.539 0 C-N-CA 123.761 0.824 . . . . 51.22 110.719 179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -62.8 -52.96 61.15 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 114.826 -1.079 . . . . 74.24 111.618 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 73' ' ' TRP . 27.0 mm -69.13 -32.07 52.59 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 C-N-CA 119.843 -0.743 . . . . 63.41 110.352 -175.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -57.04 -52.15 66.4 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 114.893 -1.049 . . . . 72.32 108.807 175.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.458 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 4.7 m-20 -67.42 -38.44 84.6 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 115.312 -0.858 . . . . 70.12 111.648 178.405 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.469 HD21 HD21 ' A' ' 26' ' ' LEU . 2.6 tm? -51.16 -55.62 16.94 Favored 'General case' 0 C--N 1.311 -1.096 0 C-N-CA 124.711 1.204 . . . . 75.45 110.502 179.773 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.565 ' SG ' ' HB3' ' A' ' 91' ' ' GLU . 56.1 m -68.54 -32.93 73.21 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 115.872 -0.603 . . . . 64.41 111.204 -179.258 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 67.6 t80 -70.98 -46.27 62.61 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 115.557 -0.747 . . . . 75.22 112.048 -175.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.458 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 15.1 mt-10 -83.8 -19.62 34.71 Favored 'General case' 0 C--N 1.314 -0.936 0 N-CA-C 113.175 0.806 . . . . 74.43 113.175 -173.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 72.7 mt -79.93 33.32 0.27 Allowed 'General case' 0 C--O 1.243 0.728 0 N-CA-C 113.145 0.794 . . . . 75.22 113.145 -177.128 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 76.32 -27.12 0.18 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 125.906 1.682 . . . . 51.32 114.27 171.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.8 p -136.93 105.8 8.85 Favored Pre-proline 0 C--N 1.296 -1.75 0 CA-C-O 120.953 0.406 . . . . 72.52 111.503 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 8.1 Cg_exo -72.8 83.7 1.34 Allowed 'Trans proline' 0 N--CA 1.452 -0.923 0 C-N-CA 122.014 1.809 . . . . 70.32 109.675 174.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -77.17 -6.96 54.93 Favored 'General case' 0 C--N 1.302 -1.489 0 N-CA-C 114.627 1.343 . . . . 45.21 114.627 -175.853 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 19.9 t70 54.46 81.19 0.11 Allowed 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 114.983 1.475 . . . . 74.14 114.983 177.357 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.457 ' O ' HD23 ' A' ' 94' ' ' LEU . 24.1 ptm -153.11 22.37 0.56 Allowed 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 105.546 -2.02 . . . . 62.23 105.546 172.828 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.565 ' HB3' ' SG ' ' A' ' 81' ' ' CYS . 9.2 pt-20 -70.54 -36.32 73.63 Favored 'General case' 0 N--CA 1.43 -1.467 0 CA-C-N 112.77 -2.014 . . . . 55.53 111.512 -173.439 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.77 ' HA ' HG12 ' A' ' 95' ' ' VAL . 47.2 mm -69.39 -49.13 23.98 Favored Pre-proline 0 C--N 1.277 -2.567 0 CA-C-N 115.977 -0.556 . . . . 73.04 110.793 -178.141 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 96.9 Cg_exo -50.72 -44.47 40.61 Favored 'Trans proline' 0 C--N 1.373 1.832 0 C-N-CA 122.091 1.861 . . . . 65.41 111.54 169.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.632 HD22 HD12 ' A' ' 18' ' ' LEU . 4.2 mm? -62.76 -39.19 93.4 Favored 'General case' 0 C--O 1.217 -0.619 0 N-CA-C 112.642 0.608 . . . . 55.01 112.642 175.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.835 HG21 ' HA ' ' A' ' 74' ' ' LYS . 5.7 p -75.5 -32.64 25.52 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.122 0 CA-C-O 122.131 0.967 . . . . 45.21 113.105 -177.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.535 ' HB2' ' CB ' ' A' ' 9' ' ' GLU . 21.9 t -58.67 -20.21 46.19 Favored 'General case' 0 C--N 1.26 -3.307 0 CA-C-N 114.075 -1.42 . . . . 63.44 111.521 177.488 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.454 HD11 ' HB2' ' A' ' 19' ' ' TRP . 3.6 tt -67.58 -16.25 20.83 Favored 'Isoleucine or valine' 0 N--CA 1.435 -1.205 0 CA-C-N 116.183 -0.462 . . . . 62.54 111.664 -175.91 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.543 ' HE1' ' HA ' ' A' ' 66' ' ' PHE . 61.4 t90 -60.98 105.5 0.48 Allowed 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.311 -0.626 . . . . 73.51 109.311 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 126.56 89.57 0.72 Allowed Glycine 0 N--CA 1.416 -2.694 0 N-CA-C 110.654 -0.978 . . . . 71.52 110.654 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -76.72 85.45 1.73 Allowed 'Trans proline' 0 N--CA 1.437 -1.85 0 C-N-CA 122.366 2.044 . . . . 71.02 110.151 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 3.9 ppt_? . . . . . 0 N--CA 1.424 -1.77 0 CA-C-N 114.857 -1.065 . . . . 73.21 110.349 179.947 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.507 -0.467 0 N-CA-C 110.199 -1.16 . . . . 54.23 110.199 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -67.18 151.47 81.21 Favored 'Trans proline' 0 C--O 1.246 0.885 0 C-N-CA 122.911 2.408 . . . . 73.51 111.7 177.192 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -85.82 101.44 12.82 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-O 121.05 0.452 . . . . 71.14 111.093 -176.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 79.86 -85.01 1.29 Allowed Glycine 0 N--CA 1.436 -1.302 0 C-N-CA 121.04 -0.6 . . . . 75.43 112.364 178.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 17.2 m -75.74 94.9 3.34 Favored 'General case' 0 N--CA 1.433 -1.3 0 CA-C-O 121.69 0.757 . . . . 53.31 110.39 -178.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 22.6 ptp -119.91 -6.96 10.02 Favored 'General case' 0 C--N 1.304 -1.371 0 CA-C-N 114.587 -1.188 . . . . 55.41 109.135 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -73.65 71.99 1.43 Allowed 'General case' 0 C--N 1.303 -1.436 0 C-N-CA 126.208 1.803 . . . . 73.12 112.749 -171.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.24 -34.41 49.18 Favored 'General case' 0 C--N 1.302 -1.47 0 CA-C-N 114.422 -1.263 . . . . 65.35 110.188 176.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.517 ' CD ' ' HB3' ' A' ' 96' ' ' SER . 0.0 OUTLIER -57.53 -31.46 66.1 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 124.079 0.951 . . . . 74.4 111.288 -178.036 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 23.6 m -60.29 -30.14 69.29 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 125.043 1.337 . . . . 73.35 111.089 -178.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 1.1 mp -87.36 -20.43 7.55 Favored 'Isoleucine or valine' 0 N--CA 1.414 -2.269 0 CA-C-N 114.512 -1.222 . . . . 72.3 109.824 -176.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.582 ' O ' ' HG ' ' A' ' 13' ' ' LEU . 30.6 mmm180 -107.38 -66.69 1.01 Allowed 'General case' 0 N--CA 1.433 -1.284 0 N-CA-C 112.706 0.632 . . . . 74.52 112.706 -177.005 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.582 ' HG ' ' O ' ' A' ' 12' ' ' ARG . 11.4 mt 170.63 173.84 0.07 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 126.089 1.756 . . . . 63.41 110.562 -177.661 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 33.7 p30 -160.19 170.29 21.47 Favored 'General case' 0 C--O 1.252 1.231 0 N-CA-C 107.208 -1.404 . . . . 75.02 107.208 172.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.465 ' H ' HD23 ' A' ' 18' ' ' LEU . 28.3 t-20 -160.45 167.86 26.37 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 118.096 0.407 . . . . 73.42 110.839 -176.268 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -51.59 -28.07 12.99 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 126.073 1.749 . . . . 72.45 112.717 178.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -57.03 -29.33 63.28 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 116.192 -0.458 . . . . 73.04 111.588 -178.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.465 HD23 ' H ' ' A' ' 15' ' ' ASN . 4.0 mm? -65.33 -43.15 91.87 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-O 121.185 0.517 . . . . 62.23 110.362 177.032 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 68.6 t-105 -69.22 -46.44 67.38 Favored 'General case' 0 N--CA 1.431 -1.376 0 CA-C-N 115.305 -0.861 . . . . 75.2 110.706 -175.468 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.79 97.97 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.075 -0.511 . . . . 44.12 111.443 -179.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 21.1 t-105 -56.48 -49.31 75.03 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 116.025 -0.534 . . . . 71.43 110.537 176.208 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.409 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.4 tm? -60.8 -53.29 59.17 Favored 'General case' 0 N--CA 1.45 -0.469 0 O-C-N 123.834 0.709 . . . . 62.4 110.211 -178.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.14 -50.3 78.68 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.871 0 N-CA-C 112.612 0.597 . . . . 75.44 112.612 -176.521 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.522 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 5.1 tpm_? -72.65 -33.73 66.8 Favored 'General case' 0 C--N 1.306 -1.311 0 C-N-CA 120.973 -0.291 . . . . 73.14 110.54 -175.044 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.443 HD22 ' HE2' ' A' ' 28' ' ' LYS . 1.9 tm? -69.81 -44.88 69.12 Favored 'General case' 0 C--N 1.318 -0.774 0 N-CA-C 108.548 -0.908 . . . . 64.33 108.548 -179.186 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.673 HD13 HD23 ' A' ' 33' ' ' LEU . 3.6 mt -71.44 -24.48 62.03 Favored 'General case' 0 C--N 1.294 -1.841 0 CA-C-N 115.604 -0.725 . . . . 55.55 112.118 179.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 20.2 p -67.81 -15.67 63.74 Favored 'General case' 0 CA--C 1.549 0.905 0 N-CA-C 108.766 -0.827 . . . . 75.35 108.766 177.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 34.6 mtmt -97.39 -4.1 39.02 Favored 'General case' 0 N--CA 1.444 -0.759 0 CA-C-O 121.729 0.776 . . . . 74.24 109.39 179.154 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.442 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 52.1 m-80 -138.78 54.92 7.12 Favored Pre-proline 0 C--O 1.243 0.73 0 CA-C-N 115.128 -0.942 . . . . 65.23 110.638 -176.077 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.442 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 9.2 Cg_exo -72.29 -21.22 23.49 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 121.437 1.425 . . . . 54.41 108.698 -178.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 39.0 mt-10 -71.68 -39.76 70.04 Favored 'General case' 0 N--CA 1.421 -1.882 0 CA-C-N 114.224 -1.353 . . . . 52.53 109.944 179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.61 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 72.2 t90 -74.2 -42.7 59.38 Favored 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.242 -0.983 . . . . 74.01 109.823 178.137 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.673 HD23 HD13 ' A' ' 26' ' ' LEU . 2.2 tm? -62.93 -44.57 95.7 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.074 -0.966 . . . . 75.01 110.654 -174.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.57 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 15.8 p -57.89 -47.68 82.07 Favored 'General case' 0 CA--C 1.545 0.772 0 CA-C-O 120.652 0.263 . . . . 73.3 111.524 178.192 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -53.94 -41.63 67.98 Favored 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 124.315 1.046 . . . . 64.52 111.468 175.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.61 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 32.8 mmmt -72.09 -32.82 67.37 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 120.642 -0.423 . . . . 73.12 111.058 177.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.468 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.3 mt -61.88 -32.9 73.3 Favored 'General case' 0 C--O 1.191 -1.976 0 N-CA-C 109.894 -0.41 . . . . 64.32 109.894 174.366 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.57 ' HG3' ' O ' ' A' ' 34' ' ' SER . 39.8 mtt180 -64.67 -28.64 69.74 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 121.08 0.467 . . . . 74.33 110.885 -179.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 31.6 t -84.72 -41.38 16.28 Favored 'General case' 0 N--CA 1.434 -1.245 0 CA-C-N 115.463 -0.79 . . . . 71.3 110.563 -179.303 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.526 ' CD1' HG23 ' A' ' 72' ' ' THR . 66.7 m-85 -82.22 -46.24 13.99 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 112.781 0.66 . . . . 75.04 112.781 -177.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.418 ' HB2' ' O ' ' A' ' 37' ' ' LEU . 7.0 mp -88.6 120.49 70.26 Favored Pre-proline 0 C--N 1.305 -1.345 0 C-N-CA 124.02 0.928 . . . . 75.14 110.107 -179.206 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -75.14 -24.39 12.64 Favored 'Trans proline' 0 C--N 1.308 -1.559 0 C-N-CA 121.914 1.743 . . . . 64.35 111.113 177.308 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.4 p -114.97 28.51 8.67 Favored 'General case' 0 C--N 1.317 -0.805 0 C-N-CA 123.809 0.844 . . . . 71.42 110.945 -177.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.523 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -41.4 98.81 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.394 0 N-CA-C 114.693 1.368 . . . . 63.33 114.693 -174.95 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.9 t70 -103.33 72.87 1.18 Allowed 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 122.899 1.333 . . . . 65.03 107.44 176.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.408 ' H ' ' HG ' ' A' ' 46' ' ' LEU . 4.1 pp -96.14 -12.5 24.64 Favored 'General case' 0 C--N 1.294 -1.809 0 CA-C-N 113.375 -1.738 . . . . 62.05 113.538 -173.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -83.4 -11.15 57.91 Favored 'General case' 0 C--N 1.308 -1.235 0 CA-C-O 121.468 0.651 . . . . 74.24 111.131 -174.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.6 t -72.78 106.75 4.87 Favored 'General case' 0 C--N 1.3 -1.555 0 CA-C-N 115.023 -0.989 . . . . 71.24 109.216 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 7.8 p -139.23 87.13 2.17 Favored 'General case' 0 N--CA 1.429 -1.514 0 CA-C-O 121.913 0.863 . . . . 70.3 112.001 -177.217 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -73.32 -25.85 60.81 Favored 'General case' 0 CA--C 1.502 -0.876 0 CA-C-N 114.645 -1.161 . . . . 70.22 112.116 178.226 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -129.63 161.86 56.64 Favored Pre-proline 0 N--CA 1.381 -3.889 0 CA-C-N 113.629 -1.623 . . . . 61.52 107.446 -179.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.44 ' HB2' ' H ' ' A' ' 53' ' ' SER . 36.3 Cg_endo -68.37 -148.85 0.02 OUTLIER 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 122.928 2.419 . . . . 70.23 111.617 173.39 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.44 ' H ' ' HB2' ' A' ' 52' ' ' PRO . 6.1 m -75.27 37.86 0.13 Allowed 'General case' 0 CA--C 1.56 1.333 0 C-N-CA 124.419 1.088 . . . . 60.21 112.705 -175.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.555 ' HB2' HG23 ' A' ' 57' ' ' VAL . 7.3 m-20 -58.05 147.04 66.72 Favored Pre-proline 0 N--CA 1.436 -1.166 0 C-N-CA 125.025 1.33 . . . . 73.02 111.27 179.201 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 32.7 Cg_exo -53.35 -34.9 72.82 Favored 'Trans proline' 0 CA--C 1.534 0.516 0 C-N-CA 123.892 3.062 . . . . 52.33 112.377 178.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.1 mp0 -73.23 -39.95 65.08 Favored 'General case' 0 CA--C 1.51 -0.571 0 CA-C-N 115.79 -0.641 . . . . 75.32 109.341 -178.02 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.555 HG23 ' HB2' ' A' ' 54' ' ' ASN . 96.3 t -67.46 -44.69 86.62 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.836 0 CA-C-N 114.618 -1.174 . . . . 75.11 109.248 -178.598 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.412 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.3 mm -63.44 -43.45 98.44 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 115.457 -0.792 . . . . 70.22 109.669 176.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.409 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 12.8 t-160 -58.13 -37.28 74.32 Favored 'General case' 0 C--O 1.211 -0.939 0 CA-C-N 116.229 -0.442 . . . . 75.31 111.128 178.585 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 36.4 ttt180 -60.94 -44.84 96.68 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-O 121.315 0.578 . . . . 74.33 111.109 178.355 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.423 HE21 HG12 ' A' ' 57' ' ' VAL . 70.3 mt-30 -64.52 -47.08 80.2 Favored 'General case' 0 C--N 1.304 -1.404 0 CA-C-N 115.144 -0.935 . . . . 52.45 110.115 -178.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.412 HD23 ' O ' ' A' ' 58' ' ' ILE . 4.3 mm? -68.83 -30.77 69.39 Favored 'General case' 0 C--N 1.294 -1.814 0 CA-C-N 114.326 -1.306 . . . . 54.11 111.656 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.409 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 4.7 t30 -61.26 -37.39 82.96 Favored 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 123.853 0.861 . . . . 74.21 109.62 179.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -59.37 -31.36 69.14 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 114.868 -1.06 . . . . 44.22 112.041 178.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 77.3 mt -72.18 -43.73 64.11 Favored 'General case' 0 CA--C 1.501 -0.916 0 N-CA-C 109.635 -0.506 . . . . 63.22 109.635 179.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 89.1 t80 -61.04 -39.54 90.2 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.409 -0.96 . . . . 62.41 108.409 176.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.62 -21.42 66.12 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 114.918 -1.037 . . . . 74.42 111.957 177.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.478 ' HB2' HG21 ' A' ' 72' ' ' THR . 9.1 mm-40 -81.45 -50.24 9.67 Favored 'General case' 0 N--CA 1.415 -2.175 0 N-CA-C 108.605 -0.887 . . . . 70.12 108.605 173.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.421 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -179.02 143.23 5.69 Favored Glycine 0 CA--C 1.477 -2.29 0 CA-C-N 115.508 -0.769 . . . . 72.33 112.563 -175.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -26.77 64.01 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 106.772 -1.566 . . . . 74.41 106.772 170.256 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.39 -36.96 68.8 Favored 'General case' 0 N--CA 1.448 -0.546 0 CA-C-N 114.121 -1.4 . . . . 72.34 108.201 174.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.526 HG23 ' CD1' ' A' ' 40' ' ' PHE . 53.0 m -62.39 -33.94 75.74 Favored 'General case' 0 N--CA 1.443 -0.816 0 CA-C-N 114.916 -1.038 . . . . 60.33 110.733 177.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . . . . . . . . . 55.9 t-105 -66.48 -38.58 87.62 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.323 -0.621 . . . . 74.4 109.323 178.152 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.967 ' HA ' HG21 ' A' ' 95' ' ' VAL . 8.8 mtmt -68.31 -32.23 72.21 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 113.205 0.817 . . . . 65.34 113.205 176.64 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 50.3 m -68.33 -38.15 81.26 Favored 'General case' 0 N--CA 1.402 -2.837 0 CA-C-O 121.953 0.882 . . . . 74.21 109.063 171.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 84.6 t80 -65.52 -53.84 36.66 Favored 'General case' 0 N--CA 1.436 -1.151 0 CA-C-N 114.365 -1.289 . . . . 53.24 112.966 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 44.6 mm -64.04 -32.14 56.08 Favored 'Isoleucine or valine' 0 C--O 1.248 0.993 0 CA-C-N 118.611 0.642 . . . . 74.23 111.245 -174.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.15 -42.39 99.21 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.4 -0.818 . . . . 70.25 109.331 177.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.478 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 83.1 m-20 -74.94 -41.19 60.12 Favored 'General case' 0 C--O 1.193 -1.878 0 CA-C-N 115.959 -0.564 . . . . 72.41 111.175 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.448 HD21 HD21 ' A' ' 26' ' ' LEU . 2.4 tm? -50.12 -53.98 23.71 Favored 'General case' 0 C--N 1.306 -1.305 0 C-N-CA 125.454 1.502 . . . . 64.14 110.505 -179.204 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.407 ' SG ' ' HG ' ' A' ' 88' ' ' LEU . 50.8 t -66.76 -34.43 77.82 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-N 115.207 -0.906 . . . . 52.22 110.702 -179.378 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -75.75 -50.19 15.98 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.333 -0.849 . . . . 74.03 112.381 -175.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.478 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 36.1 mt-10 -75.32 -28.36 59.62 Favored 'General case' 0 C--N 1.31 -1.147 0 N-CA-C 112.196 0.443 . . . . 71.01 112.196 -173.039 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 98.8 mt -85.16 -13.64 49.48 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 109.261 -0.644 . . . . 70.23 109.261 176.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.7 t70 54.01 57.84 5.59 Favored 'General case' 0 N--CA 1.467 0.402 0 C-N-CA 125.261 1.424 . . . . 74.11 110.743 -179.541 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 6.0 m -134.52 108.09 11.05 Favored Pre-proline 0 C--N 1.301 -1.529 0 CA-C-N 114.012 -1.449 . . . . 61.43 109.392 179.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_exo -63.43 111.0 1.35 Allowed 'Trans proline' 0 N--CA 1.458 -0.604 0 C-N-CA 122.279 1.986 . . . . 70.21 109.66 177.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.407 ' HG ' ' SG ' ' A' ' 81' ' ' CYS . 41.2 mt -82.91 -39.8 21.02 Favored 'General case' 0 C--N 1.301 -1.517 0 C-N-CA 119.852 -0.739 . . . . 74.14 109.272 -177.643 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 62.19 12.25 4.98 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.228 1.011 . . . . 63.21 110.688 -176.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.41 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 18.8 ttt -157.25 34.26 0.28 Allowed 'General case' 0 N--CA 1.421 -1.908 0 N-CA-C 106.949 -1.5 . . . . 74.34 106.949 -176.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -70.97 -34.5 71.48 Favored 'General case' 0 C--O 1.205 -1.258 0 CA-C-N 114.458 -1.246 . . . . 74.01 109.632 -179.041 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.54 ' HA ' HG12 ' A' ' 95' ' ' VAL . 49.0 mm -63.35 -50.5 73.93 Favored Pre-proline 0 C--N 1.288 -2.074 0 CA-C-N 115.319 -0.855 . . . . 54.14 111.989 -177.304 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.501 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 50.4 Cg_exo -58.7 -24.38 70.7 Favored 'Trans proline' 0 C--N 1.363 1.307 0 C-N-CA 121.782 1.654 . . . . 65.34 111.756 172.303 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.401 ' O ' HG22 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -74.4 -31.95 62.52 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.898 -1.149 . . . . 71.11 107.898 177.409 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.967 HG21 ' HA ' ' A' ' 74' ' ' LYS . 9.0 p -88.2 -46.72 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.949 0 N-CA-C 113.949 1.092 . . . . 62.04 113.949 -178.361 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.517 ' HB3' ' CD ' ' A' ' 9' ' ' GLU . 4.0 t -78.73 3.44 16.56 Favored 'General case' 0 C--N 1.27 -2.871 0 CA-C-N 115.627 -0.715 . . . . 65.42 110.846 -175.439 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.434 HG23 ' CD1' ' A' ' 98' ' ' TRP . 17.2 tt -56.81 -40.01 68.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.347 0.659 . . . . 70.54 109.952 176.765 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.434 ' CD1' HG23 ' A' ' 97' ' ' ILE . 46.6 m95 -127.49 14.11 7.08 Favored 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 108.924 -0.769 . . . . 75.32 108.924 178.208 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -92.71 -134.69 6.87 Favored Glycine 0 N--CA 1.437 -1.263 0 CA-C-N 115.695 -0.684 . . . . 62.25 112.341 -176.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 14.6 Cg_exo -71.71 153.2 59.41 Favored 'Trans proline' 0 C--N 1.328 -0.509 0 C-N-CA 122.87 2.38 . . . . 75.53 111.835 177.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 . . . . . 0 N--CA 1.426 -1.633 0 N-CA-C 108.063 -1.088 . . . . 74.21 108.063 178.018 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.463 0.444 0 N-CA-C 110.593 -1.003 . . . . 65.02 110.593 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 96.3 Cg_endo -86.0 1.5 7.9 Favored 'Trans proline' 0 CA--C 1.535 0.557 0 C-N-CA 122.383 2.055 . . . . 73.43 113.458 -178.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 7.6 mp 65.34 93.05 0.07 Allowed 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.155 0.982 . . . . 74.41 111.509 -178.476 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -88.57 -46.1 4.72 Favored Glycine 0 N--CA 1.436 -1.301 0 N-CA-C 110.902 -0.879 . . . . 74.22 110.902 -179.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 14.4 m -85.14 91.14 8.04 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.881 -0.785 . . . . 61.42 108.881 179.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 53.1 tpp -89.68 -13.48 36.87 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-O 121.785 0.803 . . . . 75.13 110.639 -174.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -109.08 24.99 12.34 Favored 'General case' 0 C--N 1.305 -1.345 0 CA-C-N 115.729 -0.669 . . . . 62.11 109.674 177.079 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.522 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.64 -9.54 59.42 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-N 114.966 -1.015 . . . . 44.04 109.768 174.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.469 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -60.22 -44.34 95.25 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.4 1.08 . . . . 72.31 112.173 -179.512 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.468 ' HB2' HD12 ' A' ' 11' ' ' ILE . 75.2 m -54.48 -31.73 56.4 Favored 'General case' 0 C--N 1.288 -2.108 0 C-N-CA 125.354 1.462 . . . . 71.13 111.302 174.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.522 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -85.13 -38.2 12.94 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 C-N-CA 125.026 1.331 . . . . 75.04 110.367 -174.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmt180 -80.74 -38.41 28.76 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 112.996 0.739 . . . . 73.22 112.996 -176.515 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 51.5 mt 61.51 -175.27 0.13 Allowed 'General case' 0 C--O 1.242 0.679 0 C-N-CA 124.38 1.072 . . . . 64.04 113.221 -177.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.507 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 9.7 p30 -125.02 -177.79 3.97 Favored 'General case' 0 C--N 1.317 -0.821 0 O-C-N 121.84 -0.537 . . . . 55.53 111.562 -177.43 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.531 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 30.7 t30 -154.39 153.11 31.05 Favored 'General case' 0 C--N 1.322 -0.622 0 N-CA-C 108.382 -0.97 . . . . 74.14 108.382 -174.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -69.79 -34.53 73.87 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 118.146 0.43 . . . . 72.21 112.002 -179.291 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -62.05 -35.95 80.14 Favored 'General case' 0 N--CA 1.489 1.516 0 CA-C-O 122.122 0.963 . . . . 75.43 109.041 177.087 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.531 ' HB3' ' O ' ' A' ' 15' ' ' ASN . 7.3 tt -65.84 -39.06 90.45 Favored 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 113.34 -1.755 . . . . 74.43 110.062 -179.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.44 ' HB2' HD11 ' A' ' 97' ' ' ILE . 20.8 t-105 -71.42 -46.71 59.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.78 0.324 . . . . 63.53 110.245 174.964 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -56.01 -40.86 74.03 Favored 'General case' 0 C--O 1.246 0.885 0 CA-C-N 115.857 -0.611 . . . . 73.22 110.884 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 31.9 t-105 -53.04 -50.44 64.3 Favored 'General case' 0 C--O 1.243 0.717 0 O-C-N 124.134 0.896 . . . . 73.05 110.847 175.563 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 6.4 mt -66.49 -45.15 80.61 Favored 'General case' 0 CA--C 1.483 -1.603 0 N-CA-C 112.741 0.645 . . . . 63.42 112.741 179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 73.8 t -51.71 -53.73 15.74 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 O-C-N 123.738 0.649 . . . . 63.34 111.467 -176.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.452 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 98.2 mtt180 -73.13 -33.7 65.67 Favored 'General case' 0 C--N 1.303 -1.45 0 N-CA-C 112.13 0.418 . . . . 62.02 112.13 -176.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.408 HD12 HD13 ' A' ' 84' ' ' LEU . 0.9 OUTLIER -73.67 -46.5 46.13 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.323 0.582 . . . . 73.32 109.598 -177.229 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.557 HD13 HD23 ' A' ' 33' ' ' LEU . 0.7 OUTLIER -66.24 -25.36 66.86 Favored 'General case' 0 C--N 1.307 -1.253 0 C-N-CA 123.679 0.792 . . . . 70.1 110.553 179.533 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.439 ' OG ' ' HB3' ' A' ' 53' ' ' SER . 57.7 m -72.58 -10.17 59.47 Favored 'General case' 0 N--CA 1.444 -0.758 0 CA-C-O 121.256 0.55 . . . . 52.33 110.838 176.879 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.452 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 70.9 mttt -98.44 -11.43 22.36 Favored 'General case' 0 CA--C 1.493 -1.248 0 N-CA-C 108.31 -0.996 . . . . 73.25 108.31 177.243 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.46 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 47.5 m-80 -132.44 51.35 7.03 Favored Pre-proline 0 N--CA 1.436 -1.169 0 CA-C-N 114.499 -1.228 . . . . 52.4 110.822 -175.088 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.46 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 2.8 Cg_exo -72.75 -19.37 24.09 Favored 'Trans proline' 0 C--N 1.361 1.191 0 N-CA-C 108.65 -1.327 . . . . 52.02 108.65 -178.697 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.0 mm-40 -74.89 -37.23 62.18 Favored 'General case' 0 N--CA 1.412 -2.363 0 CA-C-N 114.189 -1.369 . . . . 72.11 109.641 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 56.9 t90 -73.21 -42.97 62.03 Favored 'General case' 0 N--CA 1.444 -0.734 0 C-N-CA 119.467 -0.893 . . . . 73.2 109.002 176.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.661 HD13 HD13 ' A' ' 37' ' ' LEU . 2.6 tm? -59.32 -47.16 86.45 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-N 114.616 -1.175 . . . . 74.24 110.226 -176.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 22.1 p -62.27 -38.44 89.35 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 120.686 0.279 . . . . 61.42 111.478 178.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -61.08 -41.49 96.75 Favored 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 123.045 0.538 . . . . 72.44 111.272 179.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HE3' ' HB3' ' A' ' 79' ' ' ASP . 42.9 mmtt -74.52 -52.41 11.99 Favored 'General case' 0 N--CA 1.434 -1.226 0 N-CA-C 112.6 0.592 . . . . 73.32 112.6 177.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.661 HD13 HD13 ' A' ' 33' ' ' LEU . 10.7 mp -53.41 -31.22 44.1 Favored 'General case' 0 C--O 1.207 -1.138 0 N-CA-C 113.999 1.111 . . . . 73.11 113.999 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.645 ' HB2' ' SD ' ' A' ' 44' ' ' MET . 31.5 ptt180 -66.69 -30.84 71.18 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.394 0.887 . . . . 74.05 113.394 179.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.4 t -72.88 -31.99 65.07 Favored 'General case' 0 C--N 1.294 -1.807 0 CA-C-O 121.495 0.664 . . . . 70.41 109.704 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.524 ' CD1' HG23 ' A' ' 72' ' ' THR . 65.2 m-85 -83.11 -58.61 2.78 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 115.706 -0.679 . . . . 73.22 111.497 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 mp -72.52 121.69 85.52 Favored Pre-proline 0 C--N 1.319 -0.742 0 C-N-CA 123.977 0.911 . . . . 75.32 110.439 -178.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_endo -68.56 -33.73 21.57 Favored 'Trans proline' 0 C--N 1.324 -0.727 0 C-N-CA 122.562 2.174 . . . . 75.42 112.617 -178.273 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 32.5 p -94.07 -5.48 47.29 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.206 -0.452 . . . . 65.25 110.609 -178.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.645 ' SD ' ' HB2' ' A' ' 38' ' ' ARG . 8.9 mtt 36.48 91.51 0.01 OUTLIER 'General case' 0 N--CA 1.441 -0.909 0 C-N-CA 127.643 2.377 . . . . 75.42 112.309 -175.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -101.92 72.87 1.37 Allowed 'General case' 0 C--N 1.287 -2.116 0 CA-C-O 122.485 1.136 . . . . 74.31 108.852 178.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.501 HD11 ' HB3' ' A' ' 38' ' ' ARG . 10.7 mt -92.55 -40.32 10.86 Favored 'General case' 0 CA--C 1.487 -1.464 0 CA-C-N 112.945 -1.934 . . . . 73.42 107.633 -175.542 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -76.14 3.35 10.77 Favored 'General case' 0 C--N 1.297 -1.685 0 CA-C-N 112.948 -1.933 . . . . 75.1 110.994 -176.005 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 53.6 t -67.04 -15.29 63.63 Favored 'General case' 0 C--N 1.31 -1.146 0 C-N-CA 125.039 1.336 . . . . 64.33 111.429 178.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.8 m -75.85 69.28 2.49 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.657 0.741 . . . . 52.34 111.895 -179.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -86.47 -9.05 57.03 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 122.128 0.965 . . . . 73.51 111.609 176.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.655 ' OE2' HG22 ' A' ' 57' ' ' VAL . 2.6 pt-20 -111.09 160.23 29.76 Favored Pre-proline 0 C--N 1.28 -2.42 0 CA-C-N 114.323 -1.308 . . . . 72.42 109.075 175.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -62.37 -170.74 0.09 OUTLIER 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.874 2.382 . . . . 74.31 113.696 -177.713 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.439 ' HB3' ' OG ' ' A' ' 27' ' ' SER . 13.2 m -76.46 36.91 0.16 Allowed 'General case' 0 C--N 1.297 -1.693 0 CA-C-N 115.169 -0.923 . . . . 74.23 112.005 -175.06 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.544 ' HB2' HG23 ' A' ' 57' ' ' VAL . 5.1 m-20 -68.39 147.55 98.18 Favored Pre-proline 0 N--CA 1.434 -1.275 0 O-C-N 122.253 -0.28 . . . . 75.54 110.955 -179.364 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_endo -56.51 -40.1 86.84 Favored 'Trans proline' 0 C--N 1.348 0.522 0 C-N-CA 123.206 2.604 . . . . 64.01 113.275 -176.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -74.92 -24.08 58.45 Favored 'General case' 0 C--N 1.313 -0.982 0 CA-C-O 121.114 0.483 . . . . 65.55 110.731 -178.658 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.655 HG22 ' OE2' ' A' ' 51' ' ' GLU . 89.8 t -69.96 -47.68 67.63 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.501 0 N-CA-C 107.871 -1.159 . . . . 63.41 107.871 175.894 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.1 mm -61.03 -45.36 98.72 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 CA-C-N 114.23 -1.35 . . . . 71.13 109.725 177.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -55.2 -39.73 69.95 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 123.823 0.849 . . . . 72.22 111.633 -179.033 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 78.1 ttt180 -61.35 -41.52 97.19 Favored 'General case' 0 C--N 1.318 -0.798 0 C-N-CA 123.728 0.811 . . . . 64.14 111.365 178.632 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.417 HE21 HG12 ' A' ' 57' ' ' VAL . 63.4 mt-30 -71.81 -43.87 64.89 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 115.145 -0.934 . . . . 63.51 110.374 -176.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.421 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.0 mm? -72.41 -29.91 64.15 Favored 'General case' 0 C--N 1.296 -1.74 0 CA-C-N 114.827 -1.079 . . . . 72.0 111.47 -177.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -53.27 -42.17 66.26 Favored 'General case' 0 C--N 1.332 -0.186 0 C-N-CA 124.444 1.098 . . . . 75.45 110.335 175.045 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 15.2 mmt85 -55.04 -32.87 62.21 Favored 'General case' 0 C--N 1.31 -1.114 0 CA-C-N 114.653 -1.158 . . . . 75.4 112.707 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 96.3 mt -72.35 -39.24 68.24 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 120.604 0.24 . . . . 65.2 110.81 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -64.38 -37.67 88.34 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 108.636 -0.876 . . . . 73.42 108.636 174.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.01 -28.25 69.67 Favored 'General case' 0 N--CA 1.446 -0.663 0 CA-C-N 114.668 -1.151 . . . . 65.14 111.439 177.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.402 ' HB2' HG21 ' A' ' 72' ' ' THR . 9.7 mm-40 -74.56 -57.49 3.9 Favored 'General case' 0 N--CA 1.409 -2.491 0 N-CA-C 107.772 -1.196 . . . . 72.32 107.772 174.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . 0.437 ' O ' ' HB ' ' A' ' 72' ' ' THR . . . -170.5 142.42 7.14 Favored Glycine 0 CA--C 1.466 -3.005 0 CA-C-N 114.917 -1.038 . . . . 24.52 112.369 -175.302 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.61 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 22.6 tpp -67.14 -33.11 74.73 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 106.378 -1.712 . . . . 41.34 106.378 168.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -66.95 -37.31 84.05 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 114.594 -1.184 . . . . 51.24 108.483 176.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.524 HG23 ' CD1' ' A' ' 40' ' ' PHE . 99.2 m -61.9 -42.63 99.3 Favored 'General case' 0 N--CA 1.433 -1.287 0 CA-C-N 114.677 -1.147 . . . . 70.54 110.442 175.868 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.654 ' HD1' HG23 ' A' ' 95' ' ' VAL . 70.0 t-105 -67.32 -41.23 85.64 Favored 'General case' 0 CA--C 1.55 0.964 0 N-CA-C 110.345 -0.243 . . . . 74.2 110.345 179.067 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.714 ' HA ' HG21 ' A' ' 95' ' ' VAL . 73.5 mttt -56.99 -39.52 74.81 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-O 121.391 0.615 . . . . 74.22 111.278 175.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 41.7 m -70.95 -44.15 66.67 Favored 'General case' 0 N--CA 1.4 -2.936 0 CA-C-N 115.663 -0.698 . . . . 42.43 110.015 177.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.31 -46.12 89.45 Favored 'General case' 0 CA--C 1.497 -1.078 0 C-N-CA 123.868 0.867 . . . . 45.02 112.475 -178.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.566 HG22 ' HB2' ' A' ' 91' ' ' GLU . 43.7 mm -66.34 -31.17 52.4 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.155 0 C-N-CA 119.223 -0.991 . . . . 72.03 111.611 -176.472 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -64.76 -40.78 95.85 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 109.514 -0.55 . . . . 75.01 109.514 174.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.5 ' HB3' ' HE3' ' A' ' 36' ' ' LYS . 6.4 m-20 -65.19 -42.16 93.85 Favored 'General case' 0 C--O 1.213 -0.825 0 CA-C-N 116.459 -0.337 . . . . 73.15 110.322 175.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.465 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.1 tm? -51.97 -55.02 23.0 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 124.839 1.256 . . . . 71.24 109.585 178.921 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 26.0 p -67.89 -40.46 83.49 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.279 0.474 . . . . 61.21 112.279 -178.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -63.56 -54.33 37.78 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 123.389 0.676 . . . . 71.44 110.504 -176.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -72.84 -37.12 67.55 Favored 'General case' 0 C--N 1.311 -1.101 0 N-CA-C 113.915 1.08 . . . . 74.32 113.915 -174.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.408 HD13 HD12 ' A' ' 25' ' ' LEU . 89.3 mt -85.2 -31.92 22.94 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.976 -0.69 . . . . 72.32 111.985 -177.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 32.0 t70 -146.36 -100.55 0.09 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 119.268 -0.973 . . . . 71.22 111.924 -178.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.414 ' O ' ' HG ' ' A' ' 88' ' ' LEU . 76.3 t -141.16 151.44 61.84 Favored Pre-proline 0 C--N 1.307 -1.279 0 N-CA-C 106.853 -1.536 . . . . 74.33 106.853 -179.449 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_exo -51.31 108.05 0.21 Allowed 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 121.846 1.697 . . . . 62.3 108.93 168.016 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 86' ' ' VAL . 86.7 mt -90.95 -22.89 20.63 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 113.973 1.101 . . . . 73.44 113.973 -168.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 67.98 17.2 9.58 Favored 'General case' 0 N--CA 1.493 1.715 0 CA-C-O 123.665 1.698 . . . . 72.23 108.82 -172.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.455 ' O ' HD23 ' A' ' 94' ' ' LEU . 63.8 mtt -120.13 12.92 11.98 Favored 'General case' 0 C--N 1.305 -1.328 0 CA-C-N 113.434 -1.712 . . . . 74.23 107.479 175.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.566 ' HB2' HG22 ' A' ' 77' ' ' ILE . 0.1 OUTLIER -71.41 -36.14 71.25 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.313 -0.858 . . . . 74.32 111.002 -179.279 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.742 ' HA ' HG12 ' A' ' 95' ' ' VAL . 35.7 mm -61.18 -46.46 95.81 Favored Pre-proline 0 C--N 1.287 -2.137 0 CA-C-N 115.648 -0.706 . . . . 71.51 112.275 -178.345 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.446 ' HD2' ' C ' ' A' ' 90' ' ' MET . 76.3 Cg_exo -51.49 -38.57 64.37 Favored 'Trans proline' 0 C--N 1.359 1.113 0 C-N-CA 122.232 1.955 . . . . 63.35 112.134 170.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.508 ' HA ' HD21 ' A' ' 18' ' ' LEU . 4.5 mm? -72.04 -33.28 67.88 Favored 'General case' 0 C--O 1.221 -0.435 0 CA-C-N 115.809 -0.632 . . . . 65.45 111.564 179.317 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.742 HG12 ' HA ' ' A' ' 92' ' ' ILE . 3.3 p -78.25 -29.55 15.34 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.012 0 CA-C-O 122.395 1.093 . . . . 75.12 112.147 177.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.6 t -73.24 4.28 4.73 Favored 'General case' 0 C--N 1.259 -3.336 0 CA-C-N 113.899 -1.5 . . . . 74.33 111.665 177.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.507 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 14.5 tt -64.33 -28.85 45.78 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 75.15 111.197 -178.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -92.7 94.88 9.24 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 105.054 -2.202 . . . . 74.52 105.054 171.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -37.17 107.8 0.06 OUTLIER Glycine 0 N--CA 1.461 0.3 0 O-C-N 125.176 1.548 . . . . 71.04 116.399 -171.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -99.99 36.43 0.08 OUTLIER 'Trans proline' 0 N--CA 1.444 -1.382 0 C-N-CA 123.592 2.861 . . . . 53.23 110.033 175.254 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.8 ttp180 . . . . . 0 N--CA 1.419 -1.994 0 CA-C-N 114.513 -1.221 . . . . 74.24 108.609 -177.898 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.34 0 N-CA-C 110.544 -1.023 . . . . 54.21 110.544 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_endo -64.32 -37.65 39.0 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.338 2.692 . . . . 72.4 114.417 -176.14 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.5 pp -87.92 139.14 30.82 Favored 'General case' 0 C--O 1.245 0.856 0 N-CA-C 113.389 0.885 . . . . 74.44 113.389 -175.855 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -136.32 -79.06 0.09 OUTLIER Glycine 0 N--CA 1.434 -1.443 0 CA-C-N 115.977 -0.556 . . . . 62.41 112.02 -178.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.535 ' O ' HG13 ' A' ' 92' ' ' ILE . 49.2 m 61.57 84.47 0.13 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-O 122.128 0.966 . . . . 41.4 110.441 -177.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -79.56 4.13 16.76 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 114.073 1.138 . . . . 70.54 114.073 -170.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -110.14 23.79 13.85 Favored 'General case' 0 C--N 1.309 -1.193 0 C-N-CA 119.297 -0.961 . . . . 75.43 111.131 177.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -77.99 -14.56 59.48 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.8 0.81 . . . . 64.33 109.776 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.441 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.5 OUTLIER -65.13 -33.01 74.99 Favored 'General case' 0 C--N 1.303 -1.455 0 CA-C-N 115.033 -0.985 . . . . 65.42 113.175 -178.588 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 14.9 t -61.78 -37.31 83.88 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-O 121.949 0.881 . . . . 73.14 109.897 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.461 ' H ' HD12 ' A' ' 11' ' ' ILE . 2.9 mp -87.5 -43.77 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.162 0 CA-C-N 114.625 -1.171 . . . . 70.01 112.415 -177.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 12' ' ' ARG . 11.5 mmt180 -81.94 -30.78 31.59 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 113.028 0.751 . . . . 72.51 113.028 -175.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.3 mm? 64.82 133.39 0.02 OUTLIER 'General case' 0 C--O 1.247 0.952 0 C-N-CA 125.976 1.711 . . . . 75.4 115.374 -178.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -72.89 156.3 39.02 Favored 'General case' 0 C--O 1.247 0.952 0 CA-C-N 115.495 -0.775 . . . . 73.2 108.938 175.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.433 ' H ' HD12 ' A' ' 18' ' ' LEU . 44.8 t-20 -157.76 143.39 17.17 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.092 -1.077 . . . . 74.44 108.092 -174.087 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -52.84 -28.51 23.19 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.304 1.041 . . . . 52.42 111.442 176.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.3 t30 -56.63 -39.6 73.92 Favored 'General case' 0 CA--C 1.502 -0.889 0 C-N-CA 124.124 0.969 . . . . 62.54 110.158 179.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.433 HD12 ' H ' ' A' ' 15' ' ' ASN . 34.1 mt -70.67 -36.71 73.46 Favored 'General case' 0 C--N 1.298 -1.639 0 CA-C-N 114.779 -1.101 . . . . 65.35 110.551 -175.264 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.7 t-105 -69.44 -42.22 75.23 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.408 -0.59 . . . . 75.15 109.408 177.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.04 -48.19 82.93 Favored 'General case' 0 N--CA 1.462 0.131 0 CA-C-N 116.503 -0.317 . . . . 71.05 110.222 177.746 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.454 ' HE1' HD22 ' A' ' 88' ' ' LEU . 2.3 t-105 -54.5 -50.28 68.18 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.782 -0.645 . . . . 74.14 110.77 175.246 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.533 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -59.79 -53.05 62.5 Favored 'General case' 0 N--CA 1.447 -0.608 0 O-C-N 123.74 0.65 . . . . 62.35 109.286 -177.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 42.4 t -56.48 -50.57 72.21 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 116.233 -0.439 . . . . 75.02 112.131 -179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.574 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 97.3 mtt180 -69.63 -41.56 75.48 Favored 'General case' 0 C--N 1.311 -1.095 0 N-CA-C 112.285 0.476 . . . . 73.42 112.285 -174.067 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -66.57 -42.91 86.34 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 109.262 -0.644 . . . . 75.14 109.262 -178.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.561 HD21 HD21 ' A' ' 80' ' ' LEU . 0.4 OUTLIER -70.34 -25.1 63.13 Favored 'General case' 0 C--N 1.304 -1.385 0 CA-C-N 115.961 -0.563 . . . . 62.21 110.437 -179.255 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 70.9 m -71.56 -18.9 62.22 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 109.287 -0.634 . . . . 61.13 109.287 176.272 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 40.3 mtmt -91.84 1.37 57.22 Favored 'General case' 0 N--CA 1.438 -1.058 0 CA-C-O 121.814 0.816 . . . . 44.11 109.188 178.278 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 52.0 m-80 -141.03 55.64 5.65 Favored Pre-proline 0 N--CA 1.441 -0.902 0 CA-C-N 114.81 -1.086 . . . . 73.24 110.267 -178.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_exo -67.98 -26.01 37.86 Favored 'Trans proline' 0 C--N 1.363 1.34 0 C-N-CA 121.389 1.393 . . . . 63.45 108.986 -176.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -66.85 -42.07 86.31 Favored 'General case' 0 N--CA 1.428 -1.57 0 CA-C-N 113.55 -1.659 . . . . 72.32 110.131 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.597 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 80.1 t90 -74.57 -45.47 45.13 Favored 'General case' 0 N--CA 1.441 -0.916 0 C-N-CA 119.809 -0.757 . . . . 74.12 109.664 -179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.613 ' O ' HD13 ' A' ' 37' ' ' LEU . 2.9 tm? -57.4 -52.52 65.02 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 114.392 -1.276 . . . . 65.41 110.537 -174.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.487 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 12.9 p -54.28 -42.59 70.21 Favored 'General case' 0 CA--C 1.555 1.16 0 N-CA-C 112.371 0.508 . . . . 65.21 112.371 179.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -57.9 -44.65 86.91 Favored 'General case' 0 C--N 1.32 -0.716 0 C-N-CA 124.254 1.021 . . . . 73.22 112.447 177.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.597 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.2 mmmt -72.13 -31.26 65.83 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-O 120.891 0.377 . . . . 72.12 110.394 178.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.613 HD13 ' O ' ' A' ' 33' ' ' LEU . 5.2 mp -61.49 -31.08 71.05 Favored 'General case' 0 C--N 1.3 -1.557 0 C-N-CA 122.679 0.392 . . . . 70.1 111.701 173.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 34' ' ' SER . 28.6 mtm180 -66.23 -35.4 80.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.986 0.898 . . . . 64.2 109.537 178.695 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.44 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 50.2 m -75.47 -36.07 60.74 Favored 'General case' 0 N--CA 1.399 -3.0 0 C-N-CA 125.734 1.614 . . . . 73.35 112.648 -178.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.592 ' CD1' HG23 ' A' ' 72' ' ' THR . 66.1 m-85 -94.51 -47.43 6.55 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 113.192 0.812 . . . . 73.43 113.192 -178.555 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.616 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.0 OUTLIER -101.0 115.92 64.66 Favored Pre-proline 0 N--CA 1.436 -1.157 0 O-C-N 122.315 -0.241 . . . . 53.23 110.699 -176.146 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -76.14 -25.61 9.97 Favored 'Trans proline' 0 CA--C 1.54 0.792 0 C-N-CA 121.823 1.682 . . . . 71.21 111.248 177.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.5 m -99.12 23.89 8.53 Favored 'General case' 0 CA--C 1.562 1.433 0 CA-C-O 122.511 1.148 . . . . 73.33 110.875 -174.227 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.498 ' HB2' ' HB2' ' A' ' 41' ' ' LEU . 4.0 tpt -74.95 104.19 5.45 Favored 'General case' 0 C--N 1.286 -2.173 0 N-CA-C 113.846 1.054 . . . . 62.21 113.846 -176.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 36.2 t70 -94.01 77.02 4.12 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 106.369 -1.715 . . . . 63.31 106.369 170.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.484 HD23 ' HG2' ' A' ' 44' ' ' MET . 3.9 pp -89.22 -17.49 28.96 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 114.165 -1.38 . . . . 53.41 112.305 -174.358 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -72.39 -18.43 61.73 Favored 'General case' 0 C--N 1.313 -1.01 0 CA-C-O 121.532 0.682 . . . . 74.53 111.73 -175.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.7 m -100.74 95.03 6.38 Favored 'General case' 0 C--N 1.276 -2.595 0 CA-C-N 115.649 -0.705 . . . . 75.1 110.625 -176.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 25.8 m -91.76 95.39 9.84 Favored 'General case' 0 C--N 1.301 -1.533 0 CA-C-O 121.547 0.689 . . . . 75.31 109.669 178.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.21 -48.44 81.48 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 114.864 -1.062 . . . . 70.14 110.939 176.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.423 ' HB2' HG21 ' A' ' 57' ' ' VAL . 45.4 mt-10 -116.97 164.62 18.02 Favored Pre-proline 0 C--N 1.245 -3.936 0 CA-C-N 113.281 -1.781 . . . . 72.22 106.877 176.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -74.8 -150.87 0.04 OUTLIER 'Trans proline' 0 CA--C 1.553 1.453 0 C-N-CA 122.221 1.948 . . . . 75.23 110.812 174.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.8 m -75.47 38.08 0.14 Allowed 'General case' 0 CA--C 1.561 1.383 0 C-N-CA 124.189 0.996 . . . . 72.44 112.334 -176.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 1.8 m120 -62.17 146.81 91.91 Favored Pre-proline 0 C--N 1.321 -0.635 0 C-N-CA 123.637 0.775 . . . . 72.32 111.019 178.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -62.21 -27.92 78.89 Favored 'Trans proline' 0 N--CA 1.463 -0.286 0 C-N-CA 122.724 2.283 . . . . 64.5 111.933 -179.192 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.8 mp0 -68.74 -40.28 79.94 Favored 'General case' 0 CA--C 1.507 -0.675 0 N-CA-C 108.533 -0.914 . . . . 75.24 108.533 178.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.493 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 58.4 t -66.47 -50.36 67.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.796 0 CA-C-N 114.717 -1.129 . . . . 73.3 109.042 -179.508 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.44 ' O ' HD23 ' A' ' 62' ' ' LEU . 47.3 mm -55.15 -39.61 51.57 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.862 0 CA-C-N 114.792 -1.094 . . . . 70.02 109.776 177.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.578 ' CE1' ' HG3' ' A' ' 100' ' ' PRO . 57.0 t-80 -61.89 -28.98 69.9 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.604 -0.725 . . . . 63.32 111.461 -179.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.414 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 25.3 mmt180 -74.22 -40.75 62.24 Favored 'General case' 0 N--CA 1.486 1.337 0 CA-C-O 122.317 1.056 . . . . 74.43 108.251 -179.808 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.565 ' HB3' HD21 ' A' ' 37' ' ' LEU . 41.1 mt-30 -70.25 -43.88 69.61 Favored 'General case' 0 C--N 1.295 -1.799 0 CA-C-N 113.555 -1.657 . . . . 65.42 110.534 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.494 HD13 HD12 ' A' ' 65' ' ' LEU . 3.9 mm? -73.42 -30.5 63.27 Favored 'General case' 0 C--N 1.295 -1.802 0 CA-C-N 114.875 -1.057 . . . . 73.15 111.232 179.181 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.497 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 0.2 OUTLIER -56.42 -43.37 79.34 Favored 'General case' 0 C--N 1.345 0.382 0 C-N-CA 124.467 1.107 . . . . 54.15 108.858 175.449 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.616 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 34.0 mmt180 -58.48 -37.01 74.63 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 114.758 -1.11 . . . . 74.33 112.343 -179.568 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.494 HD12 HD13 ' A' ' 62' ' ' LEU . 88.5 mt -71.82 -44.68 63.48 Favored 'General case' 0 C--N 1.308 -1.228 0 CA-C-N 116.552 -0.295 . . . . 62.51 111.571 -177.171 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -67.38 -27.77 67.38 Favored 'General case' 0 C--O 1.245 0.851 0 N-CA-C 108.851 -0.796 . . . . 72.31 108.851 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -68.59 -39.24 81.0 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-N 115.245 -0.889 . . . . 73.25 110.709 175.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.604 HE21 HD12 ' A' ' 41' ' ' LEU . 48.9 mm-40 -60.4 -47.94 83.89 Favored 'General case' 0 N--CA 1.436 -1.169 0 N-CA-C 109.054 -0.721 . . . . 73.12 109.054 176.109 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -175.81 141.02 5.43 Favored Glycine 0 N--CA 1.403 -3.539 0 CA-C-N 114.772 -1.104 . . . . 72.23 111.143 -178.269 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.624 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 21.7 ptp -69.67 -26.61 64.47 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 106.025 -1.843 . . . . 72.14 106.025 169.662 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -71.29 -43.5 67.01 Favored 'General case' 0 N--CA 1.438 -1.073 0 CA-C-N 114.37 -1.286 . . . . 74.12 108.262 173.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.592 HG23 ' CD1' ' A' ' 40' ' ' PHE . 81.2 m -55.39 -40.82 71.85 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 123.399 0.68 . . . . 64.01 110.129 174.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.426 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 73.5 t-105 -61.26 -49.29 77.68 Favored 'General case' 0 N--CA 1.44 -0.956 0 CA-C-N 115.765 -0.652 . . . . 72.22 110.247 176.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.624 ' HG3' ' O ' ' A' ' 70' ' ' MET . 91.5 mttt -55.82 -42.48 75.75 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.959 0.409 . . . . 64.53 110.754 176.525 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 42.3 m -65.88 -44.93 83.88 Favored 'General case' 0 N--CA 1.406 -2.636 0 C-N-CA 123.334 0.654 . . . . 75.11 110.773 179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 87.1 t80 -58.33 -49.52 76.9 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.718 -0.673 . . . . 73.23 111.006 179.127 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.493 ' O ' ' HB3' ' A' ' 80' ' ' LEU . 49.5 mm -64.47 -38.31 82.26 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.666 0 O-C-N 123.349 0.406 . . . . 74.44 110.738 -178.681 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -69.67 -32.93 71.85 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-O 121.198 0.523 . . . . 74.34 110.781 179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.52 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 67.9 m-20 -74.01 -39.61 63.48 Favored 'General case' 0 C--O 1.193 -1.875 0 C-N-CA 119.867 -0.733 . . . . 70.25 110.163 171.983 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.561 HD21 HD21 ' A' ' 26' ' ' LEU . 2.8 tm? -50.76 -53.96 27.38 Favored 'General case' 0 C--N 1.308 -1.2 0 C-N-CA 124.924 1.29 . . . . 61.3 111.073 -179.769 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 25.3 p -63.29 -33.7 76.08 Favored 'General case' 0 C--N 1.313 -1.019 0 CA-C-N 115.623 -0.717 . . . . 75.43 111.662 -178.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 91.3 t80 -73.47 -54.35 8.46 Favored 'General case' 0 C--N 1.314 -0.972 0 C-N-CA 123.554 0.742 . . . . 71.13 111.129 179.064 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.52 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 42.3 mt-10 -68.61 -36.73 79.05 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-N 115.396 -0.82 . . . . 62.35 112.814 -172.047 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 76.1 mt -90.6 -10.24 44.06 Favored 'General case' 0 C--N 1.313 -0.978 0 C-N-CA 119.936 -0.706 . . . . 43.32 110.032 177.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 30.5 t70 55.95 69.48 0.73 Allowed 'General case' 0 C--N 1.329 -0.295 0 C-N-CA 124.194 0.998 . . . . 63.01 110.219 -176.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -132.88 129.08 21.01 Favored Pre-proline 0 C--N 1.305 -1.368 0 CA-C-N 115.082 -0.963 . . . . 61.35 110.666 -177.524 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 49.4 Cg_endo -75.89 109.55 2.91 Favored 'Trans proline' 0 N--CA 1.445 -1.331 0 C-N-CA 122.115 1.877 . . . . 63.11 110.076 176.412 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.454 HD22 ' HE1' ' A' ' 21' ' ' TRP . 65.9 mt -86.05 -31.1 22.14 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 120.175 -0.61 . . . . 55.3 109.634 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 27.7 t70 71.31 -49.68 0.68 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.854 1.261 . . . . 63.33 111.559 177.651 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.511 ' HB2' ' HG2' ' A' ' 93' ' ' PRO . 20.6 ptp -116.43 68.56 0.73 Allowed 'General case' 0 C--N 1.29 -1.998 0 CA-C-O 122.098 0.951 . . . . 61.02 108.55 175.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.539 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 36.2 tt0 -70.36 -46.04 64.9 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.354 -1.293 . . . . 63.44 112.13 -172.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.588 ' O ' HG22 ' A' ' 95' ' ' VAL . 44.4 mm -64.43 -42.8 68.88 Favored Pre-proline 0 C--O 1.175 -2.852 0 C-N-CA 123.358 0.663 . . . . 72.2 111.034 -178.04 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.511 ' HG2' ' HB2' ' A' ' 90' ' ' MET . 3.1 Cg_exo -48.37 -33.33 22.35 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 C-N-CA 121.937 1.758 . . . . 61.22 112.89 167.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.539 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 4.5 mm? -68.32 -44.06 76.23 Favored 'General case' 0 C--O 1.214 -0.805 0 N-CA-C 108.952 -0.759 . . . . 64.55 108.952 172.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.588 HG22 ' O ' ' A' ' 92' ' ' ILE . 2.8 m -63.77 -34.47 68.23 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.278 0 CA-C-O 123.051 1.405 . . . . 72.24 110.712 179.944 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 59.3 m -89.21 7.23 36.45 Favored 'General case' 0 C--N 1.274 -2.713 0 C-N-CA 127.667 2.387 . . . . 53.25 113.453 -178.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.5 tp -60.91 -24.95 34.31 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.101 0 C-N-CA 123.078 0.551 . . . . 62.31 111.598 -176.081 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 23.9 m0 52.83 85.45 0.05 OUTLIER 'General case' 0 N--CA 1.432 -1.339 0 C-N-CA 124.961 1.304 . . . . 75.13 112.278 -174.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -85.29 -174.05 49.98 Favored Glycine 0 N--CA 1.432 -1.579 0 CA-C-N 115.361 -0.836 . . . . 72.01 111.277 -179.205 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.578 ' HG3' ' CE1' ' A' ' 59' ' ' HIS . 92.9 Cg_endo -79.65 159.11 25.16 Favored 'Trans proline' 0 C--N 1.319 -0.974 0 C-N-CA 122.311 2.008 . . . . 75.4 111.8 179.043 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 . . . . . 0 N--CA 1.412 -2.34 0 N-CA-C 108.758 -0.83 . . . . 71.52 108.758 178.674 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.516 0 N-CA-C 110.85 -0.9 . . . . 72.2 110.85 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 49.9 Cg_endo -71.79 112.5 3.4 Favored 'Trans proline' 0 CA--C 1.538 0.718 0 C-N-CA 122.962 2.441 . . . . 71.15 113.01 -178.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.1 mt -117.27 -4.66 11.36 Favored 'General case' 0 C--N 1.314 -0.936 0 CA-C-N 115.727 -0.67 . . . . 65.32 109.843 178.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 94.63 85.08 1.65 Allowed Glycine 0 N--CA 1.428 -1.842 0 N-CA-C 108.676 -1.769 . . . . 75.01 108.676 -175.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . 0.262 44.4 p 66.7 123.1 0.02 OUTLIER 'General case' 0 C--O 1.249 1.044 0 C-N-CA 126.558 1.943 . . . . 62.24 113.335 -174.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 28.5 ttt -79.49 80.95 5.81 Favored 'General case' 0 N--CA 1.432 -1.362 0 CA-C-O 122.913 1.34 . . . . 72.23 109.531 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.524 ' O ' HD13 ' A' ' 11' ' ' ILE . 28.7 t70 -161.85 25.12 0.12 Allowed 'General case' 0 C--N 1.289 -2.031 0 CA-C-N 112.119 -2.31 . . . . 72.23 108.175 -177.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -72.94 -31.94 64.92 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 122.9 1.333 . . . . 60.23 107.468 179.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.8 pm0 -55.93 -38.88 70.89 Favored 'General case' 0 N--CA 1.422 -1.858 0 CA-C-N 112.768 -2.014 . . . . 71.44 112.216 175.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -66.92 -26.74 67.0 Favored 'General case' 0 C--N 1.299 -1.589 0 CA-C-O 121.779 0.799 . . . . 63.03 111.19 -178.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.524 HD13 ' O ' ' A' ' 7' ' ' ASP . 1.0 OUTLIER -83.51 -24.91 7.85 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.836 0 CA-C-N 115.143 -0.935 . . . . 75.02 110.453 -175.296 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.488 ' HB2' ' OG ' ' A' ' 96' ' ' SER . 38.2 mmt180 -84.68 -65.03 1.06 Allowed 'General case' 0 N--CA 1.441 -0.886 0 CA-C-N 116.373 -0.376 . . . . 73.22 110.19 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.423 ' HA ' ' O ' ' A' ' 96' ' ' SER . 41.5 mt 50.83 166.08 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 117.196 2.295 . . . . 63.23 117.196 -179.332 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.6 t30 51.46 87.61 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 125.907 1.683 . . . . 51.14 113.231 177.536 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.538 ' HB3' HD23 ' A' ' 18' ' ' LEU . 46.7 m-80 -125.32 89.86 3.12 Favored 'General case' 0 C--N 1.299 -1.63 0 CA-C-N 115.893 -0.594 . . . . 44.13 110.942 -178.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -71.82 -39.24 69.94 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.251 -0.431 . . . . 64.33 111.63 -177.719 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -63.02 -34.07 76.78 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.274 0.559 . . . . 73.14 110.127 179.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.627 HD12 HD22 ' A' ' 94' ' ' LEU . 4.6 mm? -67.12 -37.99 84.81 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.167 -0.924 . . . . 72.34 110.914 177.452 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 41.4 t-105 -66.24 -46.76 76.04 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.348 -0.387 . . . . 74.31 110.307 179.353 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.77 -32.54 74.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.005 -0.543 . . . . 64.24 111.133 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -67.74 -50.17 58.66 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 109.347 -0.612 . . . . 62.23 109.347 175.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -56.1 -52.77 63.1 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.727 0.811 . . . . 63.45 110.077 -177.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 54.3 t -57.51 -48.62 82.6 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.811 0 C-N-CA 122.898 0.479 . . . . 75.44 111.575 -179.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 47.7 ttt180 -72.3 -31.68 65.92 Favored 'General case' 0 C--N 1.298 -1.641 0 CA-C-N 116.271 -0.422 . . . . 71.34 111.483 -175.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -72.98 -43.97 61.62 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 107.964 -1.124 . . . . 51.52 107.964 178.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.471 HD13 HD23 ' A' ' 33' ' ' LEU . 4.8 mt -73.43 -24.23 60.22 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 113.304 0.853 . . . . 74.11 113.304 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . 0.54 ' HA ' ' HB3' ' A' ' 53' ' ' SER . 53.2 p -59.15 -22.04 60.31 Favored 'General case' 0 CA--C 1.546 0.812 0 CA-C-O 121.515 0.674 . . . . 72.41 109.792 175.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 29.6 mtmt -92.43 -15.2 27.48 Favored 'General case' 0 N--CA 1.434 -1.263 0 CA-C-N 115.483 -0.781 . . . . 72.24 109.522 -178.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 90.4 m-20 -133.96 51.5 6.6 Favored Pre-proline 0 C--O 1.242 0.701 0 CA-C-N 114.902 -1.044 . . . . 61.23 111.849 -170.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -70.38 -22.31 29.42 Favored 'Trans proline' 0 C--N 1.366 1.49 0 N-CA-C 108.939 -1.216 . . . . 75.22 108.939 -177.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -66.71 -39.62 88.1 Favored 'General case' 0 N--CA 1.424 -1.755 0 CA-C-N 113.352 -1.749 . . . . 64.34 110.09 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.527 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 70.6 t90 -74.34 -45.49 46.9 Favored 'General case' 0 N--CA 1.445 -0.678 0 C-N-CA 119.605 -0.838 . . . . 52.23 109.378 178.272 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.596 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 3.1 tm? -59.05 -49.52 77.57 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-N 114.61 -1.177 . . . . 61.11 110.947 -174.269 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.52 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 21.1 p -58.94 -45.27 90.85 Favored 'General case' 0 C--N 1.313 -1.007 0 N-CA-C 112.029 0.381 . . . . 63.2 112.029 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.8 -40.95 70.02 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.109 0.964 . . . . 62.0 111.416 176.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.521 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 26.3 mmmt -72.56 -35.8 68.08 Favored 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 120.99 -0.284 . . . . 70.41 110.668 178.794 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.596 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.4 mt -59.41 -31.13 68.98 Favored 'General case' 0 C--O 1.211 -0.945 0 CA-C-N 115.969 -0.56 . . . . 73.4 110.855 177.084 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 34' ' ' SER . 59.7 mtp180 -61.5 -34.82 76.14 Favored 'General case' 0 C--N 1.314 -0.946 0 CA-C-N 116.04 -0.527 . . . . 72.33 112.234 -176.707 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 36.3 t -87.58 -38.97 15.5 Favored 'General case' 0 N--CA 1.43 -1.432 0 CA-C-N 116.273 -0.421 . . . . 64.13 110.476 -179.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.446 ' CE2' ' HD1' ' A' ' 76' ' ' PHE . 76.4 m-85 -73.85 -47.89 35.1 Favored 'General case' 0 C--O 1.217 -0.64 0 N-CA-C 113.066 0.765 . . . . 73.31 113.066 -178.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.533 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.5 mm? -102.43 112.54 65.65 Favored Pre-proline 0 N--CA 1.432 -1.34 0 CA-C-O 120.758 0.313 . . . . 73.25 110.957 -177.061 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -81.15 3.06 8.11 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 122.511 2.141 . . . . 74.03 111.373 178.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 27.6 p -111.53 -2.0 15.64 Favored 'General case' 0 C--N 1.31 -1.14 0 CA-C-N 115.061 -0.972 . . . . 75.43 111.193 -177.295 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.505 ' HB2' ' HB2' ' A' ' 41' ' ' LEU . 36.9 tpp -65.22 110.07 2.44 Favored 'General case' 0 N--CA 1.413 -2.315 0 N-CA-C 115.489 1.663 . . . . 74.32 115.489 -174.465 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -108.79 82.92 1.68 Allowed 'General case' 0 N--CA 1.428 -1.532 0 N-CA-C 105.243 -2.132 . . . . 73.41 105.243 165.307 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.492 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 4.6 pp -81.75 5.01 19.88 Favored 'General case' 0 C--N 1.289 -2.058 0 CA-C-N 114.58 -1.191 . . . . 73.2 111.486 -173.158 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -80.34 -9.35 59.74 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 114.999 -1.0 . . . . 63.45 111.452 179.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 9.3 p -89.35 77.59 7.36 Favored 'General case' 0 C--N 1.302 -1.481 0 CA-C-O 121.966 0.889 . . . . 71.22 111.931 179.154 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 16.5 m -95.02 83.07 3.87 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.315 -0.857 . . . . 72.53 109.217 178.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -75.12 -22.96 57.84 Favored 'General case' 0 CA--C 1.503 -0.853 0 CA-C-O 122.74 1.257 . . . . 72.43 111.846 178.441 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -137.03 161.6 60.48 Favored Pre-proline 1 N--CA 1.374 -4.273 0 N-CA-C 105.678 -1.971 . . . . 63.32 105.678 178.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.408 ' C ' ' H ' ' A' ' 54' ' ' ASN . 24.1 Cg_exo -69.57 -143.47 0.02 OUTLIER 'Trans proline' 0 CA--C 1.538 0.694 0 C-N-CA 122.975 2.45 . . . . 73.25 110.923 175.102 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.54 ' HB3' ' HA ' ' A' ' 27' ' ' SER . 13.0 m -80.59 38.33 0.43 Allowed 'General case' 0 C--N 1.293 -1.853 0 CA-C-O 122.18 0.99 . . . . 43.12 110.66 -179.062 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.408 ' H ' ' C ' ' A' ' 52' ' ' PRO . 6.7 m-20 -62.35 151.41 82.41 Favored Pre-proline 0 C--N 1.317 -0.823 0 C-N-CA 126.298 1.839 . . . . 75.13 112.802 -178.169 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 13.5 Cg_endo -54.07 -43.45 58.17 Favored 'Trans proline' 0 C--N 1.358 1.039 0 C-N-CA 124.011 3.141 . . . . 52.41 114.158 -175.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -73.86 -31.52 63.21 Favored 'General case' 0 CA--C 1.503 -0.847 0 CA-C-O 120.65 0.262 . . . . 55.42 110.372 -177.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -63.7 -52.1 61.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 N-CA-C 108.356 -0.979 . . . . 73.13 108.356 176.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.466 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.0 mm -56.97 -41.44 77.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 CA-C-N 114.708 -1.133 . . . . 75.4 109.259 176.727 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.456 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 48.7 t-80 -58.92 -36.46 74.76 Favored 'General case' 0 C--O 1.21 -0.99 0 CA-C-N 115.74 -0.664 . . . . 74.22 112.092 -179.287 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 16.4 mmt180 -64.21 -44.42 92.01 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 108.118 -1.067 . . . . 54.12 108.118 -178.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 88.0 mt-30 -67.39 -47.47 70.22 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 113.208 -1.814 . . . . 73.44 110.885 -172.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.466 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -74.17 -32.04 62.94 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 114.321 -1.309 . . . . 74.33 111.453 -177.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.456 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 67.1 t30 -63.16 -44.62 94.95 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-O 121.95 0.881 . . . . 54.14 109.847 179.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.533 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 19.0 mmt180 -57.56 -29.82 64.72 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 114.193 -1.367 . . . . 63.43 112.943 178.6 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 94.5 mt -67.46 -39.18 85.3 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-O 120.658 0.266 . . . . 53.42 110.981 -179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.534 ' CG ' ' HD2' ' A' ' 100' ' ' PRO . 37.9 t80 -70.96 -29.8 65.91 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 108.566 -0.901 . . . . 74.43 108.566 178.442 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -19.94 65.1 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 115.738 -0.664 . . . . 70.54 110.529 176.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . . . . . . . . . 7.1 mm-40 -79.84 -49.09 12.47 Favored 'General case' 0 N--CA 1.417 -2.077 0 N-CA-C 108.517 -0.92 . . . . 63.14 108.517 173.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.44 141.61 6.52 Favored Glycine 0 CA--C 1.479 -2.179 0 CA-C-N 115.001 -0.999 . . . . 71.02 111.526 -175.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.521 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 59.5 ttp -67.74 -29.5 68.74 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 106.15 -1.796 . . . . 71.1 106.15 171.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -80.92 -32.95 34.48 Favored 'General case' 0 N--CA 1.439 -1.018 0 CA-C-N 113.707 -1.588 . . . . 63.31 109.026 177.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.412 HG23 ' CD1' ' A' ' 40' ' ' PHE . 98.7 m -60.4 -38.56 84.35 Favored 'General case' 0 N--CA 1.447 -0.601 0 N-CA-C 109.254 -0.647 . . . . 61.31 109.254 175.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.613 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 76.2 t-105 -61.57 -54.2 46.24 Favored 'General case' 0 CA--C 1.541 0.603 0 O-C-N 123.609 0.568 . . . . 72.12 109.739 175.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.521 ' HG3' ' O ' ' A' ' 70' ' ' MET . 85.9 mttt -53.97 -45.25 71.31 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 123.146 0.578 . . . . 71.05 111.935 178.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -65.34 -45.74 83.0 Favored 'General case' 0 N--CA 1.408 -2.558 0 C-N-CA 123.095 0.558 . . . . 74.44 111.104 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.446 ' HD1' ' CE2' ' A' ' 40' ' ' PHE . 81.0 t80 -57.49 -45.36 84.99 Favored 'General case' 0 N--CA 1.445 -0.706 0 CA-C-N 115.555 -0.748 . . . . 74.33 110.739 179.18 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.568 HG21 ' HB2' ' A' ' 94' ' ' LEU . 49.2 mm -63.5 -33.11 59.46 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 CA-C-N 116.103 -0.499 . . . . 72.12 111.347 -178.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -66.16 -42.61 88.75 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 119.627 -0.829 . . . . 73.51 109.368 175.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.417 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 2.2 m-20 -64.12 -38.23 90.3 Favored 'General case' 0 C--O 1.213 -0.818 0 CA-C-O 120.731 0.3 . . . . 64.42 110.427 175.998 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 77' ' ' ILE . 2.6 tm? -53.66 -55.56 24.96 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 124.66 1.184 . . . . 72.31 109.863 177.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.482 ' SG ' ' HA ' ' A' ' 87' ' ' PRO . 26.8 p -68.53 -40.24 80.84 Favored 'General case' 0 N--CA 1.42 -1.948 0 CA-C-N 116.15 -0.477 . . . . 72.21 111.674 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -65.86 -48.04 72.89 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.856 -0.611 . . . . 73.54 112.558 -174.668 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 6.1 mt-10 -80.69 -26.89 37.24 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.126 -0.63 . . . . 73.33 112.06 -174.194 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 86.3 mt -85.97 -37.39 19.05 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 120.442 -0.503 . . . . 64.42 111.098 -179.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -148.82 -100.3 0.08 Allowed 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 121.042 -0.263 . . . . 71.13 110.969 178.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -141.19 164.21 37.07 Favored Pre-proline 0 C--N 1.314 -0.962 0 N-CA-C 108.108 -1.071 . . . . 64.22 108.108 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.482 ' HA ' ' SG ' ' A' ' 81' ' ' CYS . 50.1 Cg_exo -57.8 114.89 2.16 Favored 'Trans proline' 0 C--N 1.358 1.048 0 C-N-CA 121.898 1.732 . . . . 72.5 108.18 170.96 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 84.9 mt -86.62 -19.09 29.84 Favored 'General case' 0 C--N 1.298 -1.659 0 N-CA-C 113.304 0.853 . . . . 53.24 113.304 -169.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 32.4 t70 78.7 -0.1 2.47 Favored 'General case' 0 N--CA 1.506 2.339 0 CA-C-O 123.542 1.639 . . . . 73.42 108.401 -173.149 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.452 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 27.8 ttt -105.75 6.26 31.65 Favored 'General case' 0 N--CA 1.425 -1.723 0 CA-C-N 113.157 -1.838 . . . . 75.44 108.071 -179.372 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.664 ' O ' HG13 ' A' ' 95' ' ' VAL . 0.7 OUTLIER -66.73 -46.53 75.18 Favored 'General case' 0 C--O 1.199 -1.601 0 CA-C-N 116.128 -0.487 . . . . 64.3 111.884 -178.808 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.456 ' O ' HG22 ' A' ' 95' ' ' VAL . 39.9 mm -59.09 -44.57 98.88 Favored Pre-proline 0 C--O 1.185 -2.332 0 CA-C-O 118.646 -0.693 . . . . 72.2 110.081 179.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.452 ' HD2' ' C ' ' A' ' 90' ' ' MET . 52.5 Cg_exo -47.63 -42.41 29.64 Favored 'Trans proline' 0 CA--C 1.557 1.662 0 C-N-CA 121.994 1.796 . . . . 72.32 112.342 169.539 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.627 HD22 HD12 ' A' ' 18' ' ' LEU . 4.4 mm? -67.01 -39.84 87.15 Favored 'General case' 0 N--CA 1.483 1.214 0 CA-C-O 120.976 0.417 . . . . 72.33 110.616 172.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.664 HG13 ' O ' ' A' ' 91' ' ' GLU . 2.9 m -68.19 -29.24 43.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.987 0 CA-C-O 122.824 1.297 . . . . 73.43 110.895 -178.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.488 ' OG ' ' HB2' ' A' ' 12' ' ' ARG . 24.5 t -82.92 5.13 22.93 Favored 'General case' 0 C--N 1.276 -2.629 0 C-N-CA 127.274 2.23 . . . . 62.3 111.68 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.429 ' HB ' ' O ' ' A' ' 94' ' ' LEU . 17.3 tt -50.21 -48.16 24.54 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.256 0 N-CA-C 113.439 0.903 . . . . 73.15 113.439 -173.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 4.1 p90 175.52 173.88 0.28 Allowed 'General case' 0 CA--C 1.499 -0.981 0 C-N-CA 126.339 1.856 . . . . 74.44 107.031 174.181 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -130.29 103.62 0.58 Allowed Glycine 0 N--CA 1.418 -2.543 0 C-N-CA 120.029 -1.081 . . . . 61.44 111.991 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.534 ' HD2' ' CG ' ' A' ' 66' ' ' PHE . 26.0 Cg_exo -69.65 50.86 0.82 Allowed 'Trans proline' 0 CA--C 1.554 1.481 0 C-N-CA 123.739 2.959 . . . . 74.44 111.72 174.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 . . . . . 0 N--CA 1.412 -2.335 0 N-CA-C 107.583 -1.265 . . . . 71.21 107.583 -179.683 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.647 0 N-CA-C 109.692 -1.363 . . . . 75.04 109.692 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 23.2 Cg_exo -66.58 129.61 21.62 Favored 'Trans proline' 0 C--O 1.244 0.79 0 C-N-CA 122.118 1.879 . . . . 71.43 109.833 176.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 26.9 tp -142.0 166.04 25.79 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 108.392 -0.966 . . . . 74.44 108.392 -177.133 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -91.74 34.77 4.22 Favored Glycine 0 N--CA 1.445 -0.727 0 C-N-CA 120.72 -0.752 . . . . 72.13 111.641 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.5 m -149.82 165.15 33.37 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 108.335 -0.987 . . . . 55.45 108.335 -179.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 2.1 mpt? -112.32 38.0 2.85 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.493 -0.929 . . . . 72.41 108.493 179.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.418 ' O ' HD13 ' A' ' 11' ' ' ILE . 3.2 m-20 -105.12 25.71 10.23 Favored 'General case' 0 C--N 1.31 -1.127 0 N-CA-C 113.266 0.839 . . . . 64.33 113.266 -174.572 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.431 ' HB3' ' HB ' ' A' ' 92' ' ' ILE . . . -77.2 -9.18 58.62 Favored 'General case' 0 N--CA 1.484 1.267 0 CA-C-O 122.482 1.134 . . . . 51.01 109.778 175.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.482 ' HB3' ' OG ' ' A' ' 96' ' ' SER . 0.0 OUTLIER -69.19 -30.42 68.6 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-N 114.005 -1.452 . . . . 73.12 112.267 179.178 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.607 ' HB2' HD12 ' A' ' 11' ' ' ILE . 70.6 m -66.78 -32.45 73.75 Favored 'General case' 0 C--N 1.292 -1.909 0 CA-C-O 122.271 1.034 . . . . 63.53 109.443 177.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.607 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.0 OUTLIER -84.38 -51.45 13.89 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.364 0 CA-C-N 113.888 -1.506 . . . . 61.15 110.918 -173.538 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.9 mmt180 -112.72 -6.92 13.84 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 115.003 1.483 . . . . 71.43 115.003 -173.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 53.29 -92.62 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.492 0 C-N-CA 124.062 0.945 . . . . 75.44 113.18 -176.348 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.453 ' OD1' ' HA ' ' A' ' 100' ' ' PRO . 7.8 p30 -170.37 170.55 7.03 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 124.513 1.125 . . . . 64.15 108.053 -179.34 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.421 ' H ' HD12 ' A' ' 18' ' ' LEU . 46.8 t30 -152.67 152.58 31.91 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 108.88 -0.785 . . . . 73.12 108.88 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -63.08 -38.79 92.58 Favored 'General case' 0 C--N 1.318 -0.804 0 C-N-CA 123.752 0.821 . . . . 75.4 111.076 -177.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.4 m120 -61.3 -29.28 69.77 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-N 116.29 -0.414 . . . . 51.31 111.811 -178.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.539 HD21 ' SD ' ' A' ' 90' ' ' MET . 83.4 mt -65.81 -44.93 84.17 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 109.491 -0.559 . . . . 71.44 109.491 178.574 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.445 ' HB2' HD11 ' A' ' 97' ' ' ILE . 61.3 t-105 -69.48 -36.88 76.95 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.48 -0.782 . . . . 74.54 109.842 179.681 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -65.35 -44.09 88.8 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 116.215 -0.448 . . . . 53.53 111.249 178.525 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.545 ' CH2' ' HG ' ' A' ' 25' ' ' LEU . 70.1 t90 -60.76 -48.13 83.18 Favored 'General case' 0 C--O 1.238 0.467 0 N-CA-C 108.684 -0.858 . . . . 71.13 108.684 176.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.441 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.2 tm? -54.4 -53.22 56.96 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-N 114.93 -1.032 . . . . 70.44 109.294 -179.711 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 52.0 t -60.13 -44.66 95.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 112.407 0.521 . . . . 75.44 112.407 -179.14 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.485 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 42.2 ttm180 -69.95 -45.28 67.78 Favored 'General case' 0 C--O 1.218 -0.576 0 C-N-CA 120.596 -0.441 . . . . 75.24 111.029 -176.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.545 ' HG ' ' CH2' ' A' ' 21' ' ' TRP . 2.7 tm? -67.82 -40.32 83.8 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 109.917 -0.401 . . . . 75.23 109.917 -175.645 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.661 HD13 HD23 ' A' ' 33' ' ' LEU . 6.8 mt -71.0 -25.59 62.75 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 120.957 0.408 . . . . 72.03 111.804 177.117 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 24.0 t -68.93 -17.35 63.94 Favored 'General case' 0 N--CA 1.438 -1.032 0 N-CA-C 108.606 -0.887 . . . . 73.23 108.606 176.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.485 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 30.1 mtmt -101.66 -2.63 29.91 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.733 -0.667 . . . . 74.01 110.02 177.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -135.53 57.62 20.66 Favored Pre-proline 0 C--O 1.243 0.756 0 CA-C-N 116.139 -0.482 . . . . 71.43 111.185 -178.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -67.98 -28.47 35.37 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 121.307 1.338 . . . . 74.44 108.774 -179.425 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -62.88 -44.27 96.55 Favored 'General case' 0 N--CA 1.428 -1.532 0 CA-C-N 113.16 -1.836 . . . . 75.42 110.624 -178.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.519 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 78.2 t90 -74.85 -45.84 40.4 Favored 'General case' 0 N--CA 1.442 -0.842 0 C-N-CA 119.92 -0.712 . . . . 75.02 110.055 -179.086 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.661 HD23 HD13 ' A' ' 26' ' ' LEU . 2.6 tm? -60.32 -47.14 87.3 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.536 -1.211 . . . . 72.04 111.104 -173.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.608 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 50.1 m -57.43 -48.77 78.24 Favored 'General case' 0 CA--C 1.548 0.901 0 O-C-N 123.191 0.307 . . . . 73.21 111.222 178.511 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.02 -39.56 69.24 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 124.19 0.996 . . . . 71.22 111.854 175.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.519 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 30.7 mmmt -73.0 -33.25 65.68 Favored 'General case' 0 C--N 1.317 -0.819 0 C-N-CA 120.784 -0.366 . . . . 70.33 111.091 177.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 90.2 mt -62.01 -32.46 72.94 Favored 'General case' 0 C--O 1.183 -2.401 0 N-CA-C 109.986 -0.375 . . . . 74.42 109.986 174.149 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.608 ' HG3' ' O ' ' A' ' 34' ' ' SER . 67.6 mtt180 -63.21 -30.47 71.61 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.13 0.491 . . . . 74.33 111.482 -178.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 32.3 t -87.47 -35.72 18.07 Favored 'General case' 0 N--CA 1.431 -1.399 0 CA-C-N 115.48 -0.782 . . . . 73.55 110.536 -177.545 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.73 ' CD1' HG23 ' A' ' 72' ' ' THR . 56.9 m-85 -86.64 -49.14 7.73 Favored 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 113.009 0.744 . . . . 73.32 113.009 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.402 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 8.6 mp -88.99 114.08 58.7 Favored Pre-proline 0 C--N 1.3 -1.561 0 C-N-CA 123.834 0.854 . . . . 62.42 109.228 179.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -70.97 -32.38 13.66 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.678 1.585 . . . . 74.43 110.333 177.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.4 m -105.59 29.13 6.81 Favored 'General case' 0 N--CA 1.419 -1.996 0 CA-C-N 115.22 -0.9 . . . . 63.54 109.472 -177.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.503 ' HG3' ' HA ' ' A' ' 38' ' ' ARG . 0.0 OUTLIER -44.89 101.49 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.965 1.306 . . . . 60.11 114.311 -174.497 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 30.6 t70 -91.45 72.8 6.05 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-O 122.333 1.063 . . . . 75.12 108.775 177.437 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.409 HD22 ' HB3' ' A' ' 34' ' ' SER . 3.4 pp -96.52 -16.12 21.28 Favored 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 114.327 -1.306 . . . . 74.41 112.192 -178.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -87.12 -1.88 58.21 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-O 121.797 0.808 . . . . 75.53 111.796 -173.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 84.8 m -103.02 73.59 1.25 Allowed 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 120.461 -0.495 . . . . 44.52 110.656 178.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 34.1 m -101.32 83.97 2.55 Favored 'General case' 0 N--CA 1.427 -1.622 0 CA-C-O 121.595 0.712 . . . . 55.35 109.666 177.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -66.67 -30.41 70.66 Favored 'General case' 0 CA--C 1.503 -0.846 0 CA-C-N 114.715 -1.129 . . . . 73.04 112.172 178.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -120.74 169.5 8.7 Favored Pre-proline 1 N--CA 1.377 -4.078 0 N-CA-C 106.337 -1.727 . . . . 62.32 106.337 178.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo -81.12 -151.24 0.04 OUTLIER 'Trans proline' 0 N--CA 1.439 -1.724 0 C-N-CA 121.804 1.669 . . . . 71.11 110.869 178.438 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 51.5 m -76.47 38.74 0.19 Allowed 'General case' 0 C--N 1.3 -1.582 0 C-N-CA 124.29 1.036 . . . . 74.55 112.607 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -65.88 151.62 94.76 Favored Pre-proline 0 N--CA 1.447 -0.599 0 C-N-CA 123.472 0.709 . . . . 72.24 112.152 -179.802 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -51.9 -42.01 60.19 Favored 'Trans proline' 0 C--N 1.357 0.982 0 C-N-CA 123.866 3.044 . . . . 73.35 114.369 -176.795 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -74.35 -27.9 60.89 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-O 120.792 0.33 . . . . 74.1 110.9 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.401 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 95.0 t -69.84 -47.19 71.27 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.968 0 N-CA-C 107.937 -1.134 . . . . 62.45 107.937 177.351 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.447 ' O ' HD23 ' A' ' 62' ' ' LEU . 45.9 mm -58.91 -47.66 88.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 114.557 -1.202 . . . . 74.1 109.507 175.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 13.1 t-80 -54.89 -37.54 66.43 Favored 'General case' 0 C--O 1.207 -1.163 0 CA-C-N 115.548 -0.751 . . . . 74.22 111.594 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 22.5 ttt85 -60.61 -48.1 83.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.607 0.718 . . . . 52.11 110.887 177.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -66.21 -45.05 82.09 Favored 'General case' 0 C--N 1.304 -1.402 0 CA-C-N 114.675 -1.148 . . . . 74.34 110.712 -176.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.8 mm? -74.18 -31.17 62.57 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 114.385 -1.28 . . . . 72.13 111.454 -176.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 52.6 t30 -60.51 -42.42 96.36 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.716 0.769 . . . . 70.33 109.693 177.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 23.1 mmt180 -60.03 -31.02 69.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.605 -1.18 . . . . 72.14 112.69 179.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 95.7 mt -69.23 -44.54 71.8 Favored 'General case' 0 C--N 1.313 -1.014 0 N-CA-C 110.011 -0.366 . . . . 73.32 110.011 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -64.35 -34.96 79.35 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.745 -0.661 . . . . 64.42 109.307 176.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -66.12 -29.73 70.09 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.436 -0.802 . . . . 62.11 111.651 177.688 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.565 ' HB2' HG21 ' A' ' 72' ' ' THR . 35.2 mm-40 -68.86 -45.71 70.35 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-O 121.437 0.637 . . . . 62.05 109.366 177.76 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -174.42 142.1 6.23 Favored Glycine 0 N--CA 1.408 -3.185 0 CA-C-N 115.051 -0.977 . . . . 73.23 111.643 -175.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.449 ' O ' ' HZ3' ' A' ' 98' ' ' TRP . 0.0 OUTLIER -67.5 -30.18 69.8 Favored 'General case' 0 C--N 1.306 -1.31 0 N-CA-C 105.843 -1.91 . . . . 62.34 105.843 170.396 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.93 -35.33 64.59 Favored 'General case' 0 N--CA 1.432 -1.328 0 CA-C-N 113.866 -1.515 . . . . 73.34 108.824 177.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.73 HG23 ' CD1' ' A' ' 40' ' ' PHE . 54.1 m -59.18 -45.52 90.82 Favored 'General case' 0 N--CA 1.433 -1.301 0 CA-C-N 115.434 -0.803 . . . . 65.41 110.654 175.577 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.56 ' HD1' HG23 ' A' ' 95' ' ' VAL . 66.2 t-105 -66.47 -38.61 87.69 Favored 'General case' 0 CA--C 1.558 1.268 0 C-N-CA 121.095 -0.242 . . . . 73.21 110.457 -179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.639 ' HA ' HG21 ' A' ' 95' ' ' VAL . 89.1 mttt -56.7 -48.76 76.97 Favored 'General case' 0 N--CA 1.493 1.68 0 CA-C-O 121.264 0.554 . . . . 73.52 110.603 174.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 47.2 m -62.79 -42.27 99.63 Favored 'General case' 0 N--CA 1.4 -2.969 0 CA-C-N 114.771 -1.104 . . . . 74.11 110.455 -179.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.81 -47.98 82.64 Favored 'General case' 0 N--CA 1.434 -1.272 0 CA-C-N 115.012 -0.994 . . . . 73.23 111.69 -178.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.414 HG22 ' HG3' ' A' ' 91' ' ' GLU . 49.7 mm -65.55 -34.75 72.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.875 0 C-N-CA 119.551 -0.86 . . . . 64.23 110.903 -176.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -63.95 -37.7 88.37 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.022 -0.535 . . . . 73.33 110.272 177.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 84.2 m-20 -74.37 -42.62 59.04 Favored 'General case' 0 C--O 1.192 -1.96 0 CA-C-N 116.517 -0.31 . . . . 71.52 110.731 177.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -50.13 -53.99 23.75 Favored 'General case' 0 C--N 1.306 -1.321 0 C-N-CA 125.518 1.527 . . . . 64.42 109.947 -179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 45.0 t -66.59 -32.12 73.26 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 115.693 -0.685 . . . . 43.22 110.958 -179.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 68.0 t80 -76.19 -55.13 5.86 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 115.892 -0.595 . . . . 74.15 111.631 -177.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 21.4 mt-10 -75.33 -25.26 57.66 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 113.132 0.79 . . . . 63.42 113.132 -170.078 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.528 HD13 HD12 ' A' ' 25' ' ' LEU . 94.4 mt -88.0 12.14 14.13 Favored 'General case' 0 C--N 1.309 -1.193 0 N-CA-C 112.857 0.688 . . . . 71.13 112.857 -176.721 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 23.8 t70 72.58 -54.75 0.69 Allowed 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.675 1.19 . . . . 65.13 113.428 174.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.62 116.34 39.6 Favored Pre-proline 0 C--N 1.308 -1.197 0 C-N-CA 123.129 0.572 . . . . 63.44 111.302 -179.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 44.9 Cg_endo -82.96 80.76 2.57 Favored 'Trans proline' 0 N--CA 1.43 -2.242 0 C-N-CA 121.674 1.583 . . . . 74.01 110.786 178.11 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.529 ' CD1' ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -67.57 -25.65 65.9 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.653 -0.703 . . . . 63.35 111.864 178.639 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.492 ' O ' HD22 ' A' ' 88' ' ' LEU . 9.4 t70 63.06 -164.14 0.26 Allowed 'General case' 0 CA--C 1.551 0.993 0 O-C-N 124.303 1.002 . . . . 74.14 109.13 175.013 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.539 ' SD ' HD21 ' A' ' 18' ' ' LEU . 41.3 ttm 60.4 34.01 20.65 Favored 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 123.085 1.422 . . . . 74.1 108.363 -178.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.414 ' HG3' HG22 ' A' ' 77' ' ' ILE . 35.2 tt0 -53.75 -44.99 70.44 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 127.46 2.304 . . . . 64.41 112.703 -174.409 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.736 ' HA ' HG12 ' A' ' 95' ' ' VAL . 41.5 mm -71.33 -50.33 11.12 Favored Pre-proline 0 C--O 1.197 -1.658 0 CA-C-O 118.701 -0.666 . . . . 71.02 111.774 -177.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.501 ' HB2' ' HG2' ' A' ' 90' ' ' MET . 47.3 Cg_exo -51.8 -34.21 53.8 Favored 'Trans proline' 0 CA--C 1.554 1.525 0 C-N-CA 121.524 1.482 . . . . 65.44 112.147 169.267 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.437 ' O ' ' HB ' ' A' ' 97' ' ' ILE . 3.6 mm? -65.14 -42.66 93.6 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-O 120.743 0.306 . . . . 72.51 110.897 173.797 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.736 HG12 ' HA ' ' A' ' 92' ' ' ILE . 2.5 p -70.51 -36.5 66.34 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.778 0 CA-C-O 122.39 1.09 . . . . 72.44 111.54 176.017 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.482 ' OG ' ' HB3' ' A' ' 9' ' ' GLU . 69.7 m -71.21 5.91 1.94 Allowed 'General case' 0 C--N 1.251 -3.709 0 CA-C-N 114.26 -1.336 . . . . 71.22 113.61 176.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.445 HD11 ' HB2' ' A' ' 19' ' ' TRP . 4.0 tp -67.83 -18.95 24.36 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 C-N-CA 123.95 0.9 . . . . 74.45 109.288 178.45 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.449 ' HZ3' ' O ' ' A' ' 70' ' ' MET . 0.1 OUTLIER -56.35 -18.04 9.67 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 124.617 1.167 . . . . 70.41 113.833 -176.627 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -136.38 80.36 0.3 Allowed Glycine 0 N--CA 1.427 -1.912 0 N-CA-C 109.782 -1.327 . . . . 61.33 109.782 175.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.453 ' HA ' ' OD1' ' A' ' 14' ' ' ASN . 94.7 Cg_endo -85.47 40.83 0.83 Allowed 'Trans proline' 0 C--N 1.349 0.567 0 C-N-CA 123.225 2.617 . . . . 74.53 110.442 -177.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.8 ptt180 . . . . . 0 C--N 1.288 -2.103 0 CA-C-N 114.323 -1.308 . . . . 64.3 108.403 -176.778 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.494 -1.262 0 N-CA-C 110.697 -0.961 . . . . 62.04 110.697 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -68.85 112.1 2.81 Favored 'Trans proline' 0 C--O 1.238 0.498 0 C-N-CA 122.874 2.382 . . . . 63.52 111.74 179.777 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -92.22 -26.22 18.28 Favored 'General case' 0 C--N 1.311 -1.081 0 N-CA-C 109.547 -0.538 . . . . 71.12 109.547 178.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 120.52 100.91 1.81 Allowed Glycine 0 N--CA 1.431 -1.668 0 N-CA-C 111.077 -0.809 . . . . 71.41 111.077 -179.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 66.5 m 69.11 178.51 0.25 Allowed 'General case' 0 C--O 1.247 0.942 0 C-N-CA 124.358 1.063 . . . . 65.21 112.344 -179.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . . . . . . . . . 31.5 tpp -84.48 -16.86 40.98 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-O 121.531 0.682 . . . . 60.33 109.26 -179.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -87.84 23.7 1.96 Allowed 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.773 -0.649 . . . . 63.15 111.433 -176.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.4 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -79.24 -21.24 46.46 Favored 'General case' 0 C--N 1.308 -1.219 0 CA-C-O 122.066 0.936 . . . . 73.01 109.21 174.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.511 ' HB3' HG22 ' A' ' 92' ' ' ILE . 0.8 OUTLIER -60.85 -30.53 70.18 Favored 'General case' 0 C--O 1.202 -1.407 0 CA-C-N 114.232 -1.349 . . . . 74.21 112.955 -179.26 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.617 ' HB2' HD12 ' A' ' 11' ' ' ILE . 65.9 m -58.22 -38.68 77.28 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-O 122.186 0.993 . . . . 71.51 110.141 177.217 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.617 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.2 mp -79.74 -37.21 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.422 -1.855 0 CA-C-N 113.413 -1.721 . . . . 64.15 109.94 -175.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 19.5 mmt180 -89.84 -4.56 57.52 Favored 'General case' 0 C--O 1.243 0.733 0 CA-C-N 115.979 -0.555 . . . . 55.12 111.201 -177.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 62.4 mt 65.88 140.41 0.03 OUTLIER 'General case' 0 C--O 1.241 0.614 0 C-N-CA 126.532 1.933 . . . . 63.12 115.207 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -83.64 81.76 8.61 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 104.597 -2.371 . . . . 75.01 104.597 171.275 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.443 ' H ' HD23 ' A' ' 18' ' ' LEU . 25.5 t-20 -103.95 154.7 19.35 Favored 'General case' 0 C--N 1.302 -1.5 0 CA-C-N 115.568 -0.742 . . . . 62.32 111.998 -171.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 34.3 mt-10 -52.85 -29.04 25.75 Favored 'General case' 0 N--CA 1.467 0.394 0 C-N-CA 125.917 1.687 . . . . 62.44 111.607 179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -57.7 -42.51 83.87 Favored 'General case' 0 N--CA 1.471 0.606 0 C-N-CA 123.738 0.815 . . . . 74.25 110.365 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.623 HD12 HD22 ' A' ' 94' ' ' LEU . 3.0 mm? -67.01 -40.09 87.21 Favored 'General case' 0 CA--C 1.505 -0.765 0 CA-C-N 115.882 -0.599 . . . . 64.41 109.835 -179.128 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 69.5 t-105 -66.86 -47.51 71.67 Favored 'General case' 0 N--CA 1.436 -1.135 0 CA-C-N 115.287 -0.87 . . . . 75.3 109.731 -178.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -64.14 -37.18 86.53 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.25 -0.432 . . . . 75.41 111.543 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 33.2 t-105 -64.1 -50.45 68.24 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 110.27 -0.271 . . . . 74.2 110.27 175.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.471 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 40.7 tp -60.31 -53.01 62.7 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.721 -0.672 . . . . 62.41 110.166 -178.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 55.0 t -58.93 -42.17 85.19 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.754 0 C-N-CA 123.299 0.64 . . . . 54.21 112.592 -178.527 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 52.5 ttt180 -70.98 -45.36 64.17 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 120.019 -0.672 . . . . 74.41 110.73 -176.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -66.25 -39.65 89.65 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.181 -0.674 . . . . 71.32 109.181 -177.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.589 HD13 HD23 ' A' ' 33' ' ' LEU . 7.9 mt -72.14 -25.48 61.73 Favored 'General case' 0 C--N 1.307 -1.283 0 N-CA-C 112.817 0.673 . . . . 72.3 112.817 177.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 47.5 t -68.13 -21.67 64.91 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.245 -1.02 . . . . 51.54 108.245 175.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 29.5 mtmt -92.26 -5.72 51.83 Favored 'General case' 0 N--CA 1.437 -1.11 0 CA-C-O 121.531 0.681 . . . . 54.42 109.948 178.361 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.434 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.4 m-80 -135.65 53.81 9.14 Favored Pre-proline 0 C--O 1.242 0.693 0 CA-C-N 115.403 -0.817 . . . . 53.02 112.06 -177.202 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.434 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 16.7 Cg_exo -68.96 -22.28 36.05 Favored 'Trans proline' 0 C--N 1.36 1.165 0 N-CA-C 108.881 -1.238 . . . . 64.23 108.881 -179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.9 mt-10 -67.55 -44.87 77.23 Favored 'General case' 0 N--CA 1.427 -1.613 0 CA-C-N 113.717 -1.583 . . . . 72.33 110.006 -179.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.451 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 66.3 t90 -74.9 -44.9 46.24 Favored 'General case' 0 C--O 1.244 0.804 0 C-N-CA 119.708 -0.797 . . . . 71.41 110.062 178.642 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.589 HD23 HD13 ' A' ' 26' ' ' LEU . 2.7 tm? -58.01 -48.02 81.3 Favored 'General case' 0 N--CA 1.441 -0.885 0 CA-C-N 114.464 -1.244 . . . . 64.22 111.452 -173.175 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.697 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 19.6 p -54.5 -53.44 54.39 Favored 'General case' 0 C--O 1.21 -1.009 0 O-C-N 123.673 0.608 . . . . 75.24 111.791 179.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -52.61 -40.9 63.18 Favored 'General case' 0 C--N 1.317 -0.815 0 C-N-CA 124.528 1.131 . . . . 63.41 112.687 176.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.451 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 31.3 mmmt -74.07 -30.51 62.41 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 120.288 -0.565 . . . . 75.12 111.543 178.132 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.623 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 95.4 mt -62.32 -37.95 87.56 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 108.836 -0.801 . . . . 73.3 108.836 172.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.697 ' HG3' ' O ' ' A' ' 34' ' ' SER . 74.7 mtp180 -62.54 -31.34 72.1 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.41 0.624 . . . . 62.24 111.199 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.444 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 39.4 m -73.07 -33.92 65.94 Favored 'General case' 0 N--CA 1.401 -2.897 0 C-N-CA 125.014 1.326 . . . . 64.12 111.814 179.719 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.618 ' CD1' HG23 ' A' ' 72' ' ' THR . 60.7 m-85 -95.93 -51.38 4.48 Favored 'General case' 0 C--N 1.306 -1.306 0 CA-C-N 115.661 -0.7 . . . . 71.2 112.589 -176.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.549 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 0.7 OUTLIER -96.71 111.26 56.78 Favored Pre-proline 0 N--CA 1.429 -1.522 0 N-CA-C 108.581 -0.896 . . . . 71.22 108.581 -179.884 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.61 -11.93 16.9 Favored 'Trans proline' 0 CA--C 1.541 0.826 0 C-N-CA 122.582 2.188 . . . . 72.53 112.615 -177.219 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 2.5 p -114.34 29.52 7.96 Favored 'General case' 0 C--N 1.301 -1.524 0 C-N-CA 123.619 0.768 . . . . 73.14 112.161 -176.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.674 ' SD ' ' HB3' ' A' ' 46' ' ' LEU . 0.1 OUTLIER -47.51 111.51 0.43 Allowed 'General case' 0 CA--C 1.503 -0.844 0 N-CA-C 115.222 1.564 . . . . 74.34 115.222 -175.624 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -115.48 65.83 0.69 Allowed 'General case' 0 C--N 1.287 -2.126 0 N-CA-C 104.758 -2.312 . . . . 71.43 104.758 170.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.674 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 3.9 pp -91.96 -17.28 25.38 Favored 'General case' 0 C--N 1.311 -1.087 0 CA-C-N 113.628 -1.624 . . . . 71.12 111.341 -171.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -70.0 -9.08 54.01 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-N 115.352 -0.84 . . . . 71.35 112.112 -174.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.0 m -80.15 89.13 5.42 Favored 'General case' 0 C--N 1.295 -1.794 0 CA-C-N 115.484 -0.78 . . . . 62.53 112.17 -177.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 17.6 m -111.82 82.87 1.69 Allowed 'General case' 0 N--CA 1.425 -1.724 0 N-CA-C 108.6 -0.889 . . . . 74.4 108.6 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -61.86 -46.2 90.45 Favored 'General case' 0 CA--C 1.498 -1.029 0 CA-C-O 122.449 1.118 . . . . 65.13 111.708 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.493 ' HB2' ' CG2' ' A' ' 57' ' ' VAL . 53.9 mm-40 -101.26 168.92 8.43 Favored Pre-proline 0 C--N 1.244 -3.996 0 N-CA-C 105.469 -2.049 . . . . 63.14 105.469 175.135 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.421 ' C ' ' H ' ' A' ' 54' ' ' ASN . 23.4 Cg_exo -67.51 -144.33 0.02 OUTLIER 'Trans proline' 0 CA--C 1.551 1.354 0 C-N-CA 122.616 2.211 . . . . 71.54 112.826 177.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -76.12 36.87 0.15 Allowed 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 124.079 0.952 . . . . 61.43 111.409 -177.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.482 ' O ' HG12 ' A' ' 58' ' ' ILE . 5.2 m-20 -67.45 149.06 98.56 Favored Pre-proline 0 N--CA 1.432 -1.33 0 C-N-CA 126.162 1.785 . . . . 74.03 112.419 -175.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.538 ' HG2' ' OE2' ' A' ' 56' ' ' GLU . 16.1 Cg_endo -61.99 -28.24 80.43 Favored 'Trans proline' 0 CA--C 1.534 0.496 0 C-N-CA 123.016 2.477 . . . . 61.11 111.598 176.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.538 ' OE2' ' HG2' ' A' ' 55' ' ' PRO . 3.4 mp0 -67.53 -37.9 83.43 Favored 'General case' 0 CA--C 1.507 -0.679 0 N-CA-C 108.526 -0.916 . . . . 73.35 108.526 177.05 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.493 ' CG2' ' HB2' ' A' ' 51' ' ' GLU . 84.9 t -74.29 -36.64 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.286 0 CA-C-N 114.4 -1.273 . . . . 74.22 109.574 -178.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 54' ' ' ASN . 48.6 mm -64.72 -44.78 96.52 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.053 0 CA-C-N 115.527 -0.76 . . . . 63.02 109.147 174.64 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.453 ' O ' ' HB2' ' A' ' 63' ' ' ASN . 59.8 t-80 -56.79 -40.84 76.64 Favored 'General case' 0 C--O 1.201 -1.474 0 C-N-CA 123.254 0.621 . . . . 71.12 110.437 179.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.474 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 3.2 tpt180 -53.66 -48.19 69.66 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 125.16 1.384 . . . . 72.32 110.954 177.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.524 ' HB3' HD11 ' A' ' 37' ' ' LEU . 62.8 mt-30 -70.72 -50.97 30.6 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-N 114.869 -1.06 . . . . 65.3 110.756 -178.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.426 HD12 ' CH2' ' A' ' 73' ' ' TRP . 4.2 mm? -66.78 -30.42 70.62 Favored 'General case' 0 C--N 1.304 -1.383 0 CA-C-N 114.562 -1.199 . . . . 71.11 112.695 -175.164 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.453 ' HB2' ' O ' ' A' ' 59' ' ' HIS . 56.9 t30 -52.95 -40.39 63.62 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 125.132 1.373 . . . . 72.12 110.717 180.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.549 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 29.3 mmt180 -60.43 -30.76 69.83 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 114.197 -1.365 . . . . 72.13 112.976 -178.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 91.4 mt -71.03 -38.14 72.58 Favored 'General case' 0 C--N 1.312 -1.053 0 O-C-N 122.144 -0.347 . . . . 42.43 110.886 -176.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -71.71 -27.83 63.28 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 109.283 -0.636 . . . . 73.34 109.283 177.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.71 -31.94 72.23 Favored 'General case' 0 C--O 1.242 0.692 0 CA-C-N 115.189 -0.914 . . . . 72.34 109.665 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.405 ' CB ' HG21 ' A' ' 72' ' ' THR . 8.7 mm-40 -70.84 -54.44 11.56 Favored 'General case' 0 N--CA 1.422 -1.838 0 N-CA-C 109.273 -0.64 . . . . 71.21 109.273 173.276 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -177.96 146.56 7.6 Favored Glycine 0 N--CA 1.417 -2.614 0 C-N-CA 120.447 -0.882 . . . . 70.24 113.111 -175.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -69.73 -26.76 64.48 Favored 'General case' 0 C--N 1.313 -0.99 0 N-CA-C 106.056 -1.831 . . . . 55.0 106.056 169.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -73.83 -31.61 63.3 Favored 'General case' 0 C--O 1.218 -0.6 0 CA-C-N 113.658 -1.61 . . . . 64.43 108.189 175.132 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.618 HG23 ' CD1' ' A' ' 40' ' ' PHE . 51.6 m -71.25 -39.67 71.48 Favored 'General case' 0 N--CA 1.433 -1.308 0 CA-C-N 115.538 -0.756 . . . . 64.04 111.07 177.449 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.494 ' HD1' ' O ' ' A' ' 95' ' ' VAL . 47.3 t-105 -63.9 -35.01 79.24 Favored 'General case' 0 CA--C 1.532 0.251 0 N-CA-C 107.696 -1.224 . . . . 72.43 107.696 174.131 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.941 ' HA ' ' CG2' ' A' ' 95' ' ' VAL . 78.5 tttt -62.23 -45.85 91.5 Favored 'General case' 1 N--CA 1.366 -4.671 0 N-CA-C 114.832 1.419 . . . . 73.32 114.832 173.292 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 56.2 m -62.75 -34.95 78.26 Favored 'General case' 0 N--CA 1.41 -2.425 0 CA-C-O 122.081 0.943 . . . . 71.12 109.342 175.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . 0.417 ' HB3' ' O ' ' A' ' 73' ' ' TRP . 73.2 t80 -62.26 -52.44 63.72 Favored 'General case' 0 N--CA 1.43 -1.457 0 CA-C-N 113.835 -1.529 . . . . 60.4 112.623 -178.708 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.709 HG13 ' HA ' ' A' ' 95' ' ' VAL . 50.2 mm -68.04 -29.13 43.65 Favored 'Isoleucine or valine' 0 C--N 1.35 0.612 0 C-N-CA 119.022 -1.071 . . . . 74.21 111.094 -175.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 39.5 m-80 -63.76 -41.22 98.02 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.188 -0.46 . . . . 73.23 110.93 176.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 72.6 m-20 -76.12 -37.04 58.57 Favored 'General case' 0 C--O 1.21 -1.015 0 C-N-CA 120.412 -0.515 . . . . 73.2 110.307 177.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -50.49 -54.21 24.03 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.989 1.315 . . . . 71.04 109.388 178.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.462 ' SG ' HD13 ' A' ' 88' ' ' LEU . 60.1 m -64.16 -38.36 90.77 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-N 115.405 -0.816 . . . . 71.55 111.654 -178.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 50.8 t80 -75.57 -48.18 23.46 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 116.067 -0.515 . . . . 75.0 111.404 -175.83 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 46.8 mm-40 -76.48 -33.66 58.68 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 114.918 1.451 . . . . 74.2 114.918 -175.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 92.6 mt -83.14 -21.63 33.54 Favored 'General case' 0 C--N 1.309 -1.164 0 C-N-CA 119.661 -0.815 . . . . 74.03 111.324 179.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 70.89 -9.06 0.87 Allowed 'General case' 0 N--CA 1.487 1.41 0 C-N-CA 124.321 1.048 . . . . 62.31 112.935 179.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.02 137.56 94.65 Favored Pre-proline 0 N--CA 1.437 -1.11 0 N-CA-C 109.092 -0.707 . . . . 75.13 109.092 178.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -84.41 102.81 0.9 Allowed 'Trans proline' 0 N--CA 1.436 -1.854 0 C-N-CA 121.755 1.637 . . . . 61.23 112.978 -177.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.462 HD13 ' SG ' ' A' ' 81' ' ' CYS . 4.5 mp -90.96 -41.07 11.33 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 107.936 -1.135 . . . . 61.44 107.936 173.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.9 t70 68.71 -54.33 0.55 Allowed 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.531 1.532 . . . . 74.43 112.923 178.625 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 64.4 mtt -96.94 82.3 3.22 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.593 -0.892 . . . . 53.05 108.593 175.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 0.0 OUTLIER -71.3 -34.31 70.5 Favored 'General case' 0 C--N 1.303 -1.441 0 C-N-CA 125.735 1.614 . . . . 73.14 112.257 -176.093 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.563 ' HB ' ' HD3' ' A' ' 93' ' ' PRO . 50.1 mm -49.66 -52.07 54.04 Favored Pre-proline 0 CA--C 1.572 1.792 0 C-N-CA 125.004 1.322 . . . . 72.52 113.475 -173.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.563 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 13.8 Cg_exo -58.84 -37.94 91.12 Favored 'Trans proline' 0 CA--C 1.545 1.043 0 C-N-CA 121.526 1.484 . . . . 74.31 111.649 176.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.636 ' O ' HG22 ' A' ' 97' ' ' ILE . 4.2 mm? -64.04 -37.46 87.51 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.567 0.747 . . . . 42.53 111.286 176.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.941 ' CG2' ' HA ' ' A' ' 74' ' ' LYS . 0.8 OUTLIER -85.69 -27.64 6.32 Favored 'Isoleucine or valine' 0 C--N 1.286 -2.179 0 CA-C-O 121.877 0.846 . . . . 74.5 112.712 -171.234 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . 0.447 ' CB ' ' HG2' ' A' ' 9' ' ' GLU . 9.4 t -101.66 5.3 41.43 Favored 'General case' 0 C--N 1.256 -3.485 0 C-N-CA 119.245 -0.982 . . . . 72.33 111.279 -177.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.636 HG22 ' O ' ' A' ' 94' ' ' LEU . 15.5 tt -77.14 -49.62 22.46 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.766 0 N-CA-C 112.643 0.609 . . . . 73.44 112.643 -177.589 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 2.2 m0 66.19 -31.52 0.16 Allowed 'General case' 0 CA--C 1.56 1.36 0 C-N-CA 126.23 1.812 . . . . 64.32 113.124 -176.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 97' ' ' ILE . . . 105.3 -174.19 21.06 Favored Glycine 0 N--CA 1.429 -1.78 0 N-CA-C 110.822 -0.911 . . . . 62.24 110.822 177.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 33.3 Cg_exo -61.46 109.66 0.78 Allowed 'Trans proline' 0 C--O 1.25 1.1 0 C-N-CA 122.501 2.134 . . . . 60.01 110.59 176.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 76.0 ttt180 . . . . . 0 N--CA 1.42 -1.94 0 N-CA-C 108.48 -0.933 . . . . 64.2 108.48 -179.768 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.509 -0.307 0 N-CA-C 110.779 -0.928 . . . . 71.22 110.779 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -64.86 -24.09 61.51 Favored 'Trans proline' 0 CA--C 1.544 0.976 0 C-N-CA 122.75 2.3 . . . . 64.14 114.012 -177.538 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 6.8 mp -108.76 155.23 21.0 Favored 'General case' 0 C--O 1.245 0.867 0 O-C-N 122.254 -0.279 . . . . 75.22 110.382 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -168.88 -95.11 0.1 OUTLIER Glycine 0 N--CA 1.438 -1.195 0 N-CA-C 110.833 -0.907 . . . . 61.43 110.833 179.064 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.433 ' HB2' ' HB2' ' A' ' 8' ' ' ALA . 49.5 m -139.72 120.32 14.19 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.98 -0.748 . . . . 65.51 108.98 179.147 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.543 ' SD ' ' HB3' ' A' ' 74' ' ' LYS . 34.6 tpp -81.03 -12.28 59.38 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-O 121.621 0.724 . . . . 73.24 110.53 -176.982 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 27.5 m-20 -109.03 24.96 12.37 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.743 -0.662 . . . . 75.32 110.606 177.071 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.514 ' HA ' HD13 ' A' ' 11' ' ' ILE . . . -79.46 -7.43 58.41 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-O 122.111 0.958 . . . . 72.0 109.721 173.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.408 ' H ' ' HG3' ' A' ' 9' ' ' GLU . 0.0 OUTLIER -69.85 -30.05 67.44 Favored 'General case' 0 C--N 1.31 -1.148 0 C-N-CA 124.937 1.295 . . . . 75.3 111.791 -178.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.735 ' HB2' HD12 ' A' ' 11' ' ' ILE . 49.6 m -57.39 -29.32 63.99 Favored 'General case' 0 C--N 1.294 -1.841 0 C-N-CA 125.418 1.487 . . . . 73.33 110.348 174.236 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.735 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -88.13 -34.28 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.415 -2.218 0 CA-C-N 114.126 -1.397 . . . . 74.31 111.666 -175.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -75.22 -66.63 0.74 Allowed 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 115.223 1.564 . . . . 74.34 115.223 -167.02 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 54.9 177.09 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.132 0 N-CA-C 115.31 1.596 . . . . 70.11 115.31 -178.562 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 38.7 t30 68.92 126.66 0.03 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 125.317 1.447 . . . . 64.51 110.472 -176.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.534 ' HB2' HG13 ' A' ' 97' ' ' ILE . 9.1 p30 -150.84 28.21 0.69 Allowed 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 114.315 1.228 . . . . 74.45 114.315 -173.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -65.48 -49.97 67.07 Favored 'General case' 0 C--N 1.311 -1.074 0 C-N-CA 119.294 -0.963 . . . . 60.51 113.288 -176.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -75.52 -33.03 60.69 Favored 'General case' 0 C--N 1.313 -0.979 0 N-CA-C 108.246 -1.02 . . . . 73.45 108.246 -179.73 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.646 HD21 ' HA ' ' A' ' 94' ' ' LEU . 0.2 OUTLIER -55.76 -46.61 77.83 Favored 'General case' 0 N--CA 1.442 -0.865 0 CA-C-N 113.73 -1.577 . . . . 74.05 111.262 178.865 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 71.2 t-105 -59.57 -48.15 82.8 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.431 -0.804 . . . . 74.51 110.986 179.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -69.03 -27.71 65.91 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.2 -0.455 . . . . 73.34 111.362 -178.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.42 ' HE1' HD21 ' A' ' 88' ' ' LEU . 42.1 t-105 -71.1 -51.4 25.33 Favored 'General case' 0 N--CA 1.443 -0.812 0 N-CA-C 110.269 -0.271 . . . . 70.11 110.269 175.203 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 50.1 tp -62.91 -51.17 67.97 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.023 -0.535 . . . . 73.32 110.473 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 41.5 t -60.11 -45.14 96.15 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.066 0 CA-C-N 115.602 -0.727 . . . . 75.3 112.73 -178.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.48 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 75.7 ttt180 -71.82 -41.93 67.61 Favored 'General case' 0 C--N 1.317 -0.842 0 C-N-CA 120.483 -0.487 . . . . 74.2 110.864 -177.44 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.498 HD12 HD13 ' A' ' 84' ' ' LEU . 1.9 tm? -65.66 -41.91 91.96 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.255 0.55 . . . . 73.43 109.864 -177.15 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.662 HD13 HD23 ' A' ' 33' ' ' LEU . 4.3 mt -72.17 -24.96 61.52 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 112.342 0.497 . . . . 73.43 112.342 178.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 40.8 t -67.04 -24.65 66.02 Favored 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 108.4 -0.963 . . . . 71.14 108.4 177.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.48 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 59.5 mttt -87.02 -12.95 45.85 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.612 -0.722 . . . . 44.22 109.66 178.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.416 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 49.6 m-80 -129.97 54.06 13.43 Favored Pre-proline 0 N--CA 1.444 -0.747 0 CA-C-N 115.353 -0.84 . . . . 64.24 113.208 -173.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.416 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 14.0 Cg_exo -69.48 -22.2 33.72 Favored 'Trans proline' 0 C--N 1.357 1.003 0 N-CA-C 108.24 -1.485 . . . . 64.45 108.24 177.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -65.83 -41.8 91.32 Favored 'General case' 0 N--CA 1.436 -1.171 0 CA-C-N 113.593 -1.639 . . . . 74.34 109.893 178.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.5 ' CZ2' ' HG3' ' A' ' 36' ' ' LYS . 76.5 t90 -75.3 -43.64 49.9 Favored 'General case' 0 N--CA 1.443 -0.802 0 C-N-CA 119.518 -0.873 . . . . 74.45 109.934 178.351 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.662 HD23 HD13 ' A' ' 26' ' ' LEU . 1.9 tm? -60.69 -40.16 91.16 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.38 -1.282 . . . . 73.42 111.191 -173.335 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.543 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 51.0 p -53.46 -53.52 50.26 Favored 'General case' 0 N--CA 1.47 0.57 0 O-C-N 123.196 0.31 . . . . 74.1 111.21 176.915 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.432 ' HA ' ' NE ' ' A' ' 38' ' ' ARG . . . -52.1 -48.62 64.65 Favored 'General case' 0 C--N 1.323 -0.561 0 C-N-CA 125.519 1.528 . . . . 74.43 112.192 179.045 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 69.0 mmtt -69.27 -32.03 70.95 Favored 'General case' 0 C--N 1.309 -1.186 0 C-N-CA 120.424 -0.51 . . . . 34.31 111.921 178.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.566 HD12 HD22 ' A' ' 46' ' ' LEU . 37.4 mt -67.15 -31.05 71.22 Favored 'General case' 0 C--O 1.187 -2.212 0 C-N-CA 120.127 -0.629 . . . . 74.43 110.367 173.701 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.543 ' HG3' ' O ' ' A' ' 34' ' ' SER . 24.6 mtm180 -61.79 -33.61 74.42 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-O 121.792 0.806 . . . . 74.22 109.589 177.253 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . 0.41 ' HB2' ' O ' ' A' ' 36' ' ' LYS . 75.3 m -78.4 -29.66 47.34 Favored 'General case' 0 N--CA 1.398 -3.073 0 C-N-CA 125.126 1.37 . . . . 64.33 113.174 -178.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.571 ' CD1' HG23 ' A' ' 72' ' ' THR . 52.5 m-85 -102.16 -46.63 4.78 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 112.863 0.69 . . . . 74.31 112.863 -178.243 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 44' ' ' MET . 8.7 mp -91.29 135.59 28.03 Favored Pre-proline 0 C--N 1.294 -1.84 0 C-N-CA 124.491 1.116 . . . . 52.15 110.701 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -90.86 -14.44 1.89 Allowed 'Trans proline' 0 C--N 1.299 -2.04 0 C-N-CA 122.343 2.029 . . . . 60.02 110.453 169.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 10.2 p -114.01 28.2 8.94 Favored 'General case' 0 C--N 1.321 -0.651 0 C-N-CA 124.44 1.096 . . . . 71.22 111.531 -175.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.488 ' HB3' ' HB2' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -68.43 113.2 5.78 Favored 'General case' 0 C--N 1.296 -1.72 0 CA-C-N 114.664 -1.153 . . . . 73.54 112.733 -177.295 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -147.14 75.55 1.38 Allowed 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 114.364 -1.289 . . . . 71.15 109.008 173.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.566 HD22 HD12 ' A' ' 37' ' ' LEU . 1.0 OUTLIER -92.81 -12.29 31.55 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 114.126 -1.397 . . . . 65.44 108.744 -179.268 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -68.98 -16.66 63.79 Favored 'General case' 0 C--N 1.312 -1.023 0 CA-C-N 114.264 -1.335 . . . . 72.45 111.538 -178.316 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 51.8 t -79.72 92.95 5.47 Favored 'General case' 0 C--N 1.288 -2.079 0 N-CA-C 106.98 -1.489 . . . . 64.43 106.98 173.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 24.5 m -91.32 86.34 6.09 Favored 'General case' 0 N--CA 1.411 -2.378 0 CA-C-O 121.783 0.802 . . . . 72.02 111.733 -176.094 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -57.72 -41.57 82.05 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-O 122.867 1.318 . . . . 74.12 108.597 173.035 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.586 ' HG3' ' CG2' ' A' ' 57' ' ' VAL . 2.5 pt-20 -137.34 163.37 49.38 Favored Pre-proline 0 C--N 1.258 -3.386 0 CA-C-N 112.216 -2.265 . . . . 63.14 108.097 170.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . 0.424 ' HD2' ' HB2' ' A' ' 51' ' ' GLU . 57.8 Cg_endo -69.42 -156.43 0.04 OUTLIER 'Trans proline' 0 CA--C 1.548 1.181 0 C-N-CA 122.814 2.343 . . . . 64.11 113.057 -177.301 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.0 m -75.59 38.75 0.15 Allowed 'General case' 0 C--O 1.251 1.157 0 C-N-CA 124.616 1.166 . . . . 71.3 112.571 -176.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.462 ' HB2' HG23 ' A' ' 57' ' ' VAL . 95.8 m-20 -58.47 152.06 46.65 Favored Pre-proline 0 N--CA 1.436 -1.17 0 C-N-CA 125.5 1.52 . . . . 72.41 111.025 177.607 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -54.73 -39.11 90.95 Favored 'Trans proline' 0 CA--C 1.537 0.648 0 C-N-CA 123.514 2.809 . . . . 75.45 112.732 179.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -72.75 -31.96 65.31 Favored 'General case' 0 C--N 1.317 -0.844 0 CA-C-N 115.683 -0.69 . . . . 72.43 110.05 -179.223 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.586 ' CG2' ' HG3' ' A' ' 51' ' ' GLU . 67.5 t -69.66 -46.33 75.35 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.961 0 CA-C-N 115.298 -0.864 . . . . 61.34 108.89 178.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.444 ' O ' HD23 ' A' ' 62' ' ' LEU . 46.5 mm -59.45 -46.92 92.36 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.88 0 CA-C-N 115.037 -0.983 . . . . 75.54 109.338 175.818 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 17.2 t-80 -55.93 -39.68 72.04 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 122.791 0.436 . . . . 73.35 111.483 178.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 71.1 ttt180 -64.07 -39.82 94.92 Favored 'General case' 0 C--N 1.314 -0.94 0 CA-C-O 121.349 0.595 . . . . 64.04 111.2 179.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.45 HE21 HG12 ' A' ' 57' ' ' VAL . 78.2 mt-30 -70.81 -45.49 64.51 Favored 'General case' 0 C--N 1.301 -1.506 0 CA-C-N 115.019 -0.992 . . . . 74.13 110.395 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.444 HD23 ' O ' ' A' ' 58' ' ' ILE . 3.9 mm? -66.14 -31.08 71.71 Favored 'General case' 0 C--N 1.297 -1.711 0 CA-C-N 114.254 -1.339 . . . . 51.34 111.509 -178.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -52.75 -43.06 65.51 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 124.869 1.268 . . . . 74.13 110.57 178.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 32.2 mmt180 -56.88 -30.09 63.55 Favored 'General case' 0 C--N 1.305 -1.327 0 CA-C-N 114.305 -1.316 . . . . 73.24 113.076 179.119 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.439 HD12 HD13 ' A' ' 62' ' ' LEU . 90.9 mt -72.34 -42.29 65.51 Favored 'General case' 0 CA--C 1.498 -1.035 0 CA-C-O 120.623 0.249 . . . . 62.42 111.431 -177.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 67.4 t80 -70.55 -28.14 64.68 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.367 -0.975 . . . . 65.34 108.367 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -64.56 -41.07 96.54 Favored 'General case' 0 N--CA 1.44 -0.941 0 CA-C-N 115.079 -0.964 . . . . 44.25 109.841 174.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.497 ' HB2' HG21 ' A' ' 72' ' ' THR . 43.5 mm-40 -63.96 -47.19 81.4 Favored 'General case' 0 N--CA 1.426 -1.666 0 N-CA-C 109.641 -0.503 . . . . 63.23 109.641 176.201 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -176.92 143.44 6.31 Favored Glycine 0 N--CA 1.407 -3.261 0 C-N-CA 120.356 -0.926 . . . . 73.34 113.841 -176.111 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -69.87 -27.11 64.55 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 106.565 -1.643 . . . . 74.44 106.565 169.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -76.05 -37.66 58.03 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 114.407 -1.269 . . . . 34.33 108.473 175.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.571 HG23 ' CD1' ' A' ' 40' ' ' PHE . 94.0 m -59.6 -35.66 74.76 Favored 'General case' 0 N--CA 1.442 -0.835 0 CA-C-N 115.093 -0.958 . . . . 75.24 110.754 177.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.559 ' CD1' HG23 ' A' ' 95' ' ' VAL . 58.5 t-105 -63.88 -42.69 97.44 Favored 'General case' 0 CA--C 1.557 1.246 0 N-CA-C 109.668 -0.493 . . . . 75.23 109.668 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.782 ' HA ' HG21 ' A' ' 95' ' ' VAL . 50.3 mttt -62.84 -47.09 84.9 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 123.198 0.599 . . . . 75.55 110.887 177.278 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 48.7 m -61.32 -40.8 95.55 Favored 'General case' 0 N--CA 1.409 -2.504 0 CA-C-N 115.914 -0.584 . . . . 71.12 110.882 177.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -60.64 -50.65 72.64 Favored 'General case' 0 N--CA 1.438 -1.026 0 CA-C-N 115.363 -0.835 . . . . 64.2 111.016 178.313 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.532 HG13 ' HA ' ' A' ' 95' ' ' VAL . 32.4 mm -66.88 -33.38 63.02 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.452 0 C-N-CA 120.482 -0.487 . . . . 63.42 111.528 -175.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -60.63 -43.16 97.85 Favored 'General case' 0 C--N 1.325 -0.495 0 N-CA-C 109.862 -0.422 . . . . 52.12 109.862 176.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.497 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 3.3 m-20 -71.66 -42.11 67.92 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 115.98 -0.554 . . . . 72.43 111.274 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.45 ' HA ' ' CZ2' ' A' ' 32' ' ' TRP . 2.4 tm? -50.45 -54.62 20.7 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.346 1.458 . . . . 72.35 109.774 178.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' A' ' 88' ' ' LEU . 46.9 t -67.55 -32.21 72.83 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 114.806 -1.088 . . . . 73.1 111.24 -178.197 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 44.7 t80 -72.85 -44.58 61.22 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.448 -0.796 . . . . 74.3 111.65 -176.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.497 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 9.8 mt-10 -89.24 -19.67 25.09 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 113.98 1.104 . . . . 63.55 113.98 -171.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.498 HD13 HD12 ' A' ' 25' ' ' LEU 0.255 85.3 mt -82.16 49.13 1.35 Allowed 'General case' 0 C--N 1.309 -1.19 0 N-CA-C 115.658 1.725 . . . . 70.23 115.658 -174.579 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.464 ' OD2' HG23 ' A' ' 86' ' ' VAL . 26.6 t70 71.73 -73.11 0.1 Allowed 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.684 1.364 . . . . 43.43 114.684 173.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.464 HG23 ' OD2' ' A' ' 85' ' ' ASP . 71.3 t -99.77 124.46 43.94 Favored Pre-proline 0 C--N 1.299 -1.602 0 O-C-N 122.385 -0.197 . . . . 73.44 110.917 -176.137 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 23.8 Cg_endo -64.28 107.06 0.76 Allowed 'Trans proline' 0 C--O 1.252 1.202 0 C-N-CA 122.845 2.363 . . . . 74.12 111.481 177.458 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.44 ' HB2' ' SG ' ' A' ' 81' ' ' CYS . 4.8 mp -64.45 -38.87 92.55 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-N 115.312 -0.858 . . . . 70.4 109.606 179.459 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 38.9 t70 65.38 9.94 6.13 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-O 122.818 1.294 . . . . 45.31 111.333 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.455 ' C ' ' HD2' ' A' ' 93' ' ' PRO . 25.5 ptm -124.43 39.95 3.85 Favored 'General case' 0 C--N 1.3 -1.545 0 N-CA-C 107.657 -1.238 . . . . 74.2 107.657 177.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.53 -40.13 95.05 Favored 'General case' 0 C--O 1.203 -1.386 0 CA-C-N 114.021 -1.445 . . . . 63.04 111.003 -179.49 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.729 ' HA ' HG12 ' A' ' 95' ' ' VAL . 31.1 mm -64.53 -48.33 74.76 Favored Pre-proline 0 C--N 1.29 -2.003 0 CA-C-O 119.088 -0.482 . . . . 70.41 111.518 179.433 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.455 ' HD2' ' C ' ' A' ' 90' ' ' MET . 84.6 Cg_exo -51.23 -38.44 61.4 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 121.507 1.471 . . . . 75.23 111.01 170.077 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.646 ' HA ' HD21 ' A' ' 18' ' ' LEU . 3.2 mm? -63.48 -46.47 86.0 Favored 'General case' 0 C--O 1.188 -2.178 0 O-C-N 123.371 0.42 . . . . 74.12 112.076 175.195 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.782 HG21 ' HA ' ' A' ' 74' ' ' LYS . 5.7 p -68.79 -31.53 51.12 Favored 'Isoleucine or valine' 0 C--O 1.251 1.18 0 CA-C-O 122.377 1.084 . . . . 72.23 112.817 -178.822 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 15.5 t -62.36 -6.86 3.59 Favored 'General case' 0 C--N 1.265 -3.088 0 CA-C-N 113.329 -1.759 . . . . 62.14 111.621 177.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.534 HG13 ' HB2' ' A' ' 15' ' ' ASN . 15.3 tt -61.21 -28.58 44.1 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 C-N-CA 124.333 1.053 . . . . 75.35 111.869 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . 0.485 ' O ' ' HD3' ' A' ' 100' ' ' PRO . 34.0 t-105 -151.73 -20.44 0.19 Allowed 'General case' 0 C--N 1.315 -0.91 0 C-N-CA 120.539 -0.465 . . . . 72.13 111.478 -174.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -114.3 88.53 0.48 Allowed Glycine 0 N--CA 1.435 -1.409 0 C-N-CA 119.874 -1.155 . . . . 70.1 111.972 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.485 ' HD3' ' O ' ' A' ' 98' ' ' TRP . 19.4 Cg_endo -99.01 105.62 0.06 OUTLIER 'Trans proline' 0 N--CA 1.442 -1.541 0 C-N-CA 123.079 2.519 . . . . 60.21 111.734 175.594 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 . . . . . 0 N--CA 1.428 -1.561 0 C-N-CA 126.932 2.093 . . . . 73.34 112.036 178.386 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.855 0 N-CA-C 109.948 -1.261 . . . . 50.3 109.948 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -71.82 -32.1 11.94 Favored 'Trans proline' 0 CA--C 1.532 0.384 0 C-N-CA 122.638 2.225 . . . . 64.54 112.581 -178.21 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 5.4 mp -93.49 119.63 32.8 Favored 'General case' 0 N--CA 1.445 -0.709 0 CA-C-O 120.786 0.326 . . . . 72.32 110.389 -178.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.14 112.83 1.93 Allowed Glycine 0 N--CA 1.426 -1.998 0 C-N-CA 120.448 -0.882 . . . . 72.04 111.538 177.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 32.4 t 74.61 -64.02 0.4 Allowed 'General case' 0 C--O 1.242 0.667 0 C-N-CA 124.998 1.319 . . . . 64.43 111.393 177.761 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.503 ' O ' ' HG2' ' A' ' 9' ' ' GLU . 2.1 mpt? 61.29 19.1 9.84 Favored 'General case' 0 C--O 1.213 -0.832 0 C-N-CA 124.404 1.081 . . . . 74.23 111.343 -176.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -81.16 24.58 0.52 Allowed 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 113.055 0.761 . . . . 74.41 113.055 -174.083 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.433 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -78.46 -17.66 56.0 Favored 'General case' 0 C--N 1.308 -1.213 0 N-CA-C 109.425 -0.583 . . . . 74.31 109.425 174.116 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 6' ' ' MET . 0.3 OUTLIER -54.18 -43.63 70.85 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.078 0.951 . . . . 74.45 111.527 178.973 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 15.3 m -55.83 -31.54 62.81 Favored 'General case' 0 C--N 1.313 -0.99 0 C-N-CA 124.743 1.217 . . . . 72.42 111.224 178.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.433 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.2 mp -87.6 -34.84 7.65 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.57 0 C-N-CA 124.825 1.25 . . . . 65.34 111.521 -176.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 28.6 mmt180 -91.63 -44.27 9.14 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 115.436 1.643 . . . . 75.33 115.436 -171.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.0 mm? 64.44 171.01 0.19 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 123.778 0.831 . . . . 75.22 112.989 -174.532 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . 0.414 ' CB ' ' HA ' ' A' ' 97' ' ' ILE . 4.4 p-10 -108.56 -176.97 3.19 Favored 'General case' 0 C--N 1.311 -1.065 0 N-CA-C 112.724 0.638 . . . . 65.31 112.724 -175.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.5 ' O ' ' HB3' ' A' ' 18' ' ' LEU . 45.2 t-20 -155.26 142.95 19.78 Favored 'General case' 0 CA--C 1.543 0.693 0 N-CA-C 108.557 -0.905 . . . . 74.34 108.557 -176.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -69.83 -29.83 67.19 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 112.779 0.659 . . . . 71.53 112.779 -179.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -68.41 -32.85 73.18 Favored 'General case' 0 N--CA 1.48 1.073 0 CA-C-O 122.405 1.098 . . . . 62.03 108.959 178.01 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.529 HD21 ' HA ' ' A' ' 94' ' ' LEU . 7.0 tt -69.92 -35.11 74.31 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-N 113.158 -1.837 . . . . 74.34 109.568 -179.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 59.2 t-105 -63.63 -44.97 92.34 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.596 -0.52 . . . . 75.43 109.596 175.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.46 -40.99 93.18 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.033 -0.531 . . . . 74.14 110.308 178.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -57.49 -50.57 72.64 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.643 -0.708 . . . . 65.53 110.704 176.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.48 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 57.4 tp -59.53 -51.32 70.34 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 116.059 -0.519 . . . . 74.23 110.609 -179.425 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 69.8 t -56.54 -51.4 65.86 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 116.095 -0.502 . . . . 71.13 111.984 -179.184 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.443 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 31.3 mmt180 -70.27 -38.46 75.08 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 111.964 0.357 . . . . 75.33 111.964 -174.304 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -66.47 -41.52 88.89 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.881 -0.785 . . . . 75.3 108.881 -179.281 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.701 HD13 HD23 ' A' ' 33' ' ' LEU . 5.4 mt -70.71 -24.89 62.73 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 112.412 0.523 . . . . 71.32 112.412 177.913 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 63.1 m -68.46 -20.91 64.65 Favored 'General case' 0 N--CA 1.445 -0.722 0 N-CA-C 109.024 -0.732 . . . . 73.11 109.024 175.425 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.443 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 34.1 mtmt -92.06 -3.56 55.61 Favored 'General case' 0 N--CA 1.438 -1.075 0 CA-C-N 115.799 -0.637 . . . . 63.31 109.31 177.998 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.437 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 54.1 m-80 -137.53 54.08 7.48 Favored Pre-proline 0 N--CA 1.443 -0.819 0 CA-C-N 115.641 -0.709 . . . . 65.42 111.945 -177.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.437 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 13.4 Cg_exo -70.41 -19.86 32.5 Favored 'Trans proline' 0 C--N 1.358 1.044 0 N-CA-C 108.643 -1.329 . . . . 71.53 108.643 179.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -69.56 -43.93 71.9 Favored 'General case' 0 N--CA 1.417 -2.1 0 CA-C-N 114.06 -1.427 . . . . 51.55 109.731 -179.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 65.0 t90 -74.77 -43.05 56.87 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 120.133 -0.627 . . . . 74.33 110.196 177.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.701 HD23 HD13 ' A' ' 26' ' ' LEU . 2.4 tm? -59.77 -45.78 91.2 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 115.178 -0.919 . . . . 72.33 111.016 -173.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.407 ' HB2' HD22 ' A' ' 46' ' ' LEU . 32.1 p -62.54 -35.37 79.23 Favored 'General case' 0 CA--C 1.551 1.006 0 N-CA-C 112.025 0.38 . . . . 25.12 112.025 178.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.53 99.7 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 121.469 0.652 . . . . 65.24 110.391 177.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.9 mmtt -72.48 -31.7 65.61 Favored 'General case' 0 N--CA 1.427 -1.622 0 C-N-CA 120.234 -0.586 . . . . 73.02 111.714 175.931 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 73.0 mt -58.43 -50.84 72.25 Favored 'General case' 0 C--O 1.201 -1.462 0 CA-C-O 119.864 -0.112 . . . . 72.34 111.229 176.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 8.1 ppt_? -60.4 -30.49 69.63 Favored 'General case' 0 CA--C 1.508 -0.667 0 N-CA-C 113.232 0.826 . . . . 74.52 113.232 -178.436 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 52.4 m -72.38 -50.13 28.83 Favored 'General case' 1 N--CA 1.375 -4.214 0 CA-C-N 114.55 -1.204 . . . . 74.14 112.078 176.61 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.437 ' CD1' HG23 ' A' ' 72' ' ' THR . 55.5 m-85 -80.8 -43.89 19.37 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 113.507 0.929 . . . . 72.4 113.507 -175.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.6 ' HG ' ' OE1' ' A' ' 68' ' ' GLN . 6.5 mp -79.43 124.78 83.89 Favored Pre-proline 0 C--N 1.287 -2.116 0 C-N-CA 124.125 0.97 . . . . 62.11 111.605 -176.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -82.08 -10.33 11.45 Favored 'Trans proline' 0 CA--C 1.538 0.723 0 C-N-CA 121.875 1.716 . . . . 70.42 107.957 168.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 8.2 p -111.48 29.33 7.92 Favored 'General case' 0 N--CA 1.425 -1.706 0 C-N-CA 127.29 2.236 . . . . 74.31 109.987 -178.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . 0.314 0.0 OUTLIER -54.0 92.41 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 116.502 2.038 . . . . 73.14 116.502 -179.401 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . 0.641 ' HB3' ' SG ' ' A' ' 48' ' ' CYS . 8.7 m-20 -118.44 81.65 1.72 Allowed 'General case' 0 C--N 1.293 -1.857 0 N-CA-C 106.607 -1.627 . . . . 74.4 106.607 174.557 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.407 HD22 ' HB2' ' A' ' 34' ' ' SER . 3.7 pp -95.51 -6.52 40.37 Favored 'General case' 0 C--N 1.301 -1.539 0 CA-C-N 114.161 -1.381 . . . . 62.45 111.52 -176.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -88.78 4.0 49.05 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.391 -0.822 . . . . 75.34 110.375 -179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . 0.641 ' SG ' ' HB3' ' A' ' 45' ' ' ASP . 64.3 m -88.32 30.46 0.88 Allowed 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.414 0.626 . . . . 73.4 111.57 -177.173 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.6 m -80.2 89.51 5.46 Favored 'General case' 0 N--CA 1.424 -1.738 0 N-CA-C 109.236 -0.653 . . . . 64.2 109.236 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -68.37 -25.51 65.11 Favored 'General case' 0 N--CA 1.475 0.782 0 CA-C-N 115.049 -0.978 . . . . 72.52 112.584 178.288 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -132.58 167.75 21.15 Favored Pre-proline 1 N--CA 1.378 -4.039 0 CA-C-N 113.925 -1.489 . . . . 65.44 107.176 178.098 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_exo -63.79 -141.06 0.01 OUTLIER 'Trans proline' 0 CA--C 1.545 1.04 0 C-N-CA 123.388 2.725 . . . . 72.03 113.285 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 17.4 m -76.21 37.65 0.16 Allowed 'General case' 0 C--N 1.312 -1.061 0 C-N-CA 123.773 0.829 . . . . 65.33 111.963 -177.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.465 ' HB2' HG23 ' A' ' 57' ' ' VAL . 6.4 m120 -67.64 145.78 98.3 Favored Pre-proline 0 C--N 1.301 -1.519 0 C-N-CA 124.497 1.119 . . . . 55.51 111.491 179.634 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 16.1 Cg_endo -58.1 -38.2 92.57 Favored 'Trans proline' 0 C--N 1.348 0.518 0 C-N-CA 123.413 2.742 . . . . 71.2 113.187 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -75.08 -28.69 60.43 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 120.741 0.305 . . . . 61.42 110.359 -178.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.465 HG23 ' HB2' ' A' ' 54' ' ' ASN . 86.1 t -66.04 -50.9 66.04 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.511 0 N-CA-C 107.835 -1.172 . . . . 74.53 107.835 176.362 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 46.4 mm -59.67 -42.7 89.34 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.858 0 CA-C-N 114.329 -1.305 . . . . 63.13 109.873 177.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 20.3 t-160 -58.44 -36.29 73.42 Favored 'General case' 0 C--O 1.213 -0.823 0 CA-C-N 115.978 -0.556 . . . . 63.12 111.592 -178.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.433 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 31.7 ttm-85 -63.16 -41.79 99.3 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.951 0.882 . . . . 71.12 110.731 177.247 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.406 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 74.6 mt-30 -67.23 -39.65 86.25 Favored 'General case' 0 C--N 1.292 -1.926 0 CA-C-N 114.547 -1.206 . . . . 74.4 110.313 -177.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.462 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -74.09 -31.05 62.65 Favored 'General case' 0 C--N 1.297 -1.692 0 CA-C-N 114.8 -1.091 . . . . 72.04 110.676 177.138 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.433 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 8.6 t30 -61.87 -35.51 78.51 Favored 'General case' 0 CA--C 1.51 -0.571 0 C-N-CA 124.247 1.019 . . . . 70.22 109.364 178.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 19.0 mmt180 -58.26 -55.84 29.85 Favored 'General case' 0 N--CA 1.434 -1.253 0 CA-C-N 114.98 -1.009 . . . . 74.4 110.257 175.664 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.599 ' HA ' ' HB2' ' A' ' 68' ' ' GLN . 79.6 mt -57.27 -33.83 68.02 Favored 'General case' 0 C--N 1.322 -0.597 0 C-N-CA 122.929 0.491 . . . . 74.32 111.327 -177.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 61.0 t80 -57.15 -45.86 83.21 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 115.554 -0.748 . . . . 72.13 109.561 176.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.83 -27.4 40.24 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.049 -0.523 . . . . 61.51 110.811 179.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.6 ' OE1' ' HG ' ' A' ' 41' ' ' LEU . 0.0 OUTLIER -60.25 -47.68 84.98 Favored 'General case' 0 CA--C 1.5 -0.977 0 C-N-CA 123.842 0.857 . . . . 73.4 111.067 177.046 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 166.47 138.46 2.44 Favored Glycine 0 N--CA 1.411 -3.03 0 C-N-CA 119.867 -1.159 . . . . 55.2 112.695 -178.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.442 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 27.2 ptt? -70.29 -27.07 64.11 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 105.913 -1.884 . . . . 75.41 105.913 170.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -72.68 -38.4 67.59 Favored 'General case' 0 N--CA 1.437 -1.104 0 CA-C-N 114.111 -1.404 . . . . 54.03 108.044 175.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.495 HG21 ' HB3' ' A' ' 68' ' ' GLN . 98.7 m -64.93 -34.43 78.38 Favored 'General case' 0 N--CA 1.432 -1.358 0 CA-C-N 115.356 -0.838 . . . . 52.45 110.087 177.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.642 ' HD1' HG23 ' A' ' 95' ' ' VAL . 33.1 t-105 -66.56 -39.52 88.55 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.503 -0.554 . . . . 73.43 109.503 179.062 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.778 ' HA ' HG21 ' A' ' 95' ' ' VAL . 84.3 mttt -57.17 -52.0 67.06 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 122.874 0.469 . . . . 74.41 111.084 174.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 15.6 m -58.09 -41.82 84.31 Favored 'General case' 0 N--CA 1.411 -2.383 0 CA-C-O 121.791 0.805 . . . . 62.41 110.13 178.17 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 75.3 t80 -61.12 -49.96 75.16 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 114.497 -1.229 . . . . 74.12 111.567 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.538 HG21 ' O ' ' A' ' 91' ' ' GLU . 49.1 mm -68.15 -31.38 51.47 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.493 0 C-N-CA 119.676 -0.809 . . . . 65.13 112.01 -175.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -62.04 -37.47 85.04 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-O 121.195 0.521 . . . . 73.21 109.745 175.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -78.21 -35.92 47.9 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.426 -0.51 . . . . 75.51 111.733 176.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -53.02 -54.88 28.77 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 124.657 1.183 . . . . 75.1 109.004 178.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 14.8 p -68.34 -36.82 79.82 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-N 115.839 -0.618 . . . . 63.2 112.605 -178.648 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.6 t80 -74.66 -54.43 7.44 Favored 'General case' 0 C--N 1.31 -1.122 0 CA-C-N 115.932 -0.576 . . . . 54.13 112.029 -175.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 66.5 mm-40 -76.31 -21.31 56.38 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 113.93 1.085 . . . . 75.13 113.93 -172.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 87.4 mt -86.33 19.21 2.83 Favored 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 112.21 0.448 . . . . 72.12 112.21 -178.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 72.94 -63.33 0.44 Allowed 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.478 1.511 . . . . 75.25 112.65 173.847 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.5 m -72.63 120.69 82.04 Favored Pre-proline 0 C--N 1.306 -1.311 0 CA-C-O 121.115 0.483 . . . . 74.34 112.087 -176.163 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -72.1 117.38 5.11 Favored 'Trans proline' 0 N--CA 1.44 -1.652 0 C-N-CA 121.813 1.675 . . . . 55.24 109.719 177.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 80.5 mt -79.97 -28.94 39.5 Favored 'General case' 0 C--N 1.303 -1.429 0 CA-C-N 116.231 -0.44 . . . . 75.2 110.231 -178.202 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 31.9 t70 71.66 -44.47 0.59 Allowed 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 126.116 1.766 . . . . 74.3 111.301 -178.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.489 ' O ' HD23 ' A' ' 94' ' ' LEU . 67.8 mtt -84.22 47.92 1.41 Allowed 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 125.192 1.397 . . . . 72.13 110.273 177.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.538 ' O ' HG21 ' A' ' 77' ' ' ILE . 10.7 pt-20 -70.68 -35.63 72.91 Favored 'General case' 0 C--N 1.298 -1.642 0 CA-C-O 121.254 0.55 . . . . 74.42 111.147 -178.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.778 ' HA ' HG12 ' A' ' 95' ' ' VAL . 24.4 mm -63.96 -47.8 79.61 Favored Pre-proline 0 C--O 1.184 -2.354 0 CA-C-O 118.292 -0.861 . . . . 60.12 111.028 178.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.463 ' HD2' ' C ' ' A' ' 90' ' ' MET . 25.4 Cg_exo -48.76 -37.41 35.44 Favored 'Trans proline' 0 CA--C 1.55 1.323 0 C-N-CA 122.098 1.865 . . . . 73.13 112.176 170.525 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.529 ' HA ' HD21 ' A' ' 18' ' ' LEU . 4.5 mm? -67.51 -36.42 81.02 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 123.193 0.597 . . . . 74.35 111.287 175.983 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.778 HG21 ' HA ' ' A' ' 74' ' ' LYS . 7.5 p -84.58 -32.69 7.99 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 CA-C-O 122.178 0.99 . . . . 71.24 113.026 179.252 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.5 t -63.13 -6.5 4.28 Favored 'General case' 0 C--N 1.271 -2.845 0 CA-C-N 113.935 -1.484 . . . . 73.55 112.427 -179.766 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.414 ' HA ' ' CB ' ' A' ' 14' ' ' ASN . 13.8 tt -71.63 -17.36 19.45 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.896 0 CA-C-O 121.829 0.823 . . . . 53.32 109.654 177.493 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 0.0 OUTLIER -128.43 29.64 5.29 Favored 'General case' 0 N--CA 1.43 -1.469 0 N-CA-C 104.899 -2.26 . . . . 70.2 104.899 175.775 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -104.77 -171.61 24.51 Favored Glycine 0 N--CA 1.424 -2.121 0 CA-C-N 113.575 -1.648 . . . . 71.24 111.348 -179.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -74.85 115.83 4.41 Favored 'Trans proline' 0 N--CA 1.444 -1.431 0 C-N-CA 123.296 2.664 . . . . 65.0 112.427 -174.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 20.1 ptt180 . . . . . 0 C--N 1.295 -1.781 0 CA-C-N 115.43 -0.805 . . . . 75.41 108.878 176.481 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.504 -0.606 0 N-CA-C 110.701 -0.96 . . . . 71.22 110.701 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -80.56 -178.37 4.4 Favored 'Trans proline' 0 N--CA 1.45 -1.066 0 C-N-CA 122.795 2.33 . . . . 73.12 111.172 179.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 90.6 mt -61.15 107.18 0.7 Allowed 'General case' 0 C--O 1.241 0.642 0 CA-C-O 121.256 0.551 . . . . 75.32 109.587 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 137.36 -45.21 1.08 Allowed Glycine 0 N--CA 1.428 -1.877 0 N-CA-C 110.475 -1.05 . . . . 52.43 110.475 -175.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 39.5 m -72.31 127.27 32.05 Favored 'General case' 0 N--CA 1.433 -1.276 0 N-CA-C 108.28 -1.008 . . . . 52.04 108.28 176.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.538 ' SD ' HD12 ' A' ' 92' ' ' ILE . 47.8 tpp 72.21 4.24 4.95 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 122.57 1.176 . . . . 74.41 110.005 -176.698 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . 0.455 ' O ' HD13 ' A' ' 11' ' ' ILE . 52.4 m-20 -118.88 24.76 10.65 Favored 'General case' 0 CA--C 1.5 -0.962 0 CA-C-N 114.157 -1.383 . . . . 75.02 108.524 177.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -78.52 -19.74 52.26 Favored 'General case' 0 C--N 1.307 -1.25 0 N-CA-C 108.935 -0.765 . . . . 45.4 108.935 175.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.476 ' HA ' ' HG3' ' A' ' 93' ' ' PRO . 0.0 OUTLIER -53.66 -45.5 70.28 Favored 'General case' 0 C--O 1.207 -1.148 0 N-CA-C 114.735 1.383 . . . . 75.41 114.735 -177.248 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . 0.539 ' HB2' HD12 ' A' ' 11' ' ' ILE . 73.0 m -65.24 -35.91 82.51 Favored 'General case' 0 C--N 1.287 -2.12 0 CA-C-O 121.74 0.781 . . . . 72.44 111.895 179.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.539 HD12 ' HB2' ' A' ' 10' ' ' SER . 1.1 mp -87.4 -41.06 14.32 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.93 0 C-N-CA 124.383 1.073 . . . . 55.55 111.852 -172.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 31.0 mmm180 -103.18 7.89 38.59 Favored 'General case' 0 C--N 1.309 -1.153 0 C-N-CA 123.846 0.858 . . . . 72.43 112.008 -172.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 6.4 tt -43.78 126.43 4.65 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 114.571 1.322 . . . . 71.33 114.571 -173.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 37.6 t-20 -152.36 132.07 13.17 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 103.642 -2.725 . . . . 70.35 103.642 174.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 51.1 t30 -118.84 -61.37 1.66 Allowed 'General case' 0 C--N 1.302 -1.481 0 C-N-CA 119.667 -0.813 . . . . 63.41 112.841 -174.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -71.11 -48.4 52.43 Favored 'General case' 0 C--N 1.313 -1.01 0 N-CA-C 112.349 0.499 . . . . 62.14 112.349 -171.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 13.7 m120 -66.1 -35.83 81.56 Favored 'General case' 0 CA--C 1.499 -0.987 0 CA-C-O 121.871 0.844 . . . . 51.22 109.557 -178.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.9 tt -70.43 -42.32 71.72 Favored 'General case' 0 N--CA 1.426 -1.638 0 CA-C-N 114.304 -1.316 . . . . 74.12 110.051 -178.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . . . . . . . . . 64.4 t-105 -60.0 -51.37 69.95 Favored 'General case' 0 CA--C 1.513 -0.445 0 N-CA-C 109.575 -0.528 . . . . 72.32 109.575 175.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.423 ' O ' ' HG3' ' A' ' 24' ' ' ARG . . . -57.71 -48.54 79.28 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-N 115.79 -0.641 . . . . 73.11 111.119 -178.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.693 ' CH2' ' HB2' ' A' ' 25' ' ' LEU . 7.7 t-105 -56.25 -50.91 69.98 Favored 'General case' 0 CA--C 1.539 0.528 0 O-C-N 123.252 0.345 . . . . 72.13 111.276 176.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 54.0 tp -59.89 -42.73 94.45 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 110.358 -0.238 . . . . 63.43 110.358 -176.361 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 59.0 t -61.41 -46.04 97.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-N 116.248 -0.433 . . . . 65.34 110.787 177.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.594 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 67.0 mtt180 -62.85 -48.17 80.18 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 109.786 -0.45 . . . . 73.02 109.786 178.49 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.693 ' HB2' ' CH2' ' A' ' 21' ' ' TRP . 30.1 tp -55.45 -48.56 74.3 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.693 1.197 . . . . 72.44 111.705 179.814 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.582 HD13 HD23 ' A' ' 33' ' ' LEU . 9.8 mt -73.65 -23.98 59.93 Favored 'General case' 0 C--N 1.281 -2.393 0 CA-C-N 115.475 -0.784 . . . . 63.42 112.73 -179.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 38.6 t -75.22 -16.93 60.44 Favored 'General case' 0 N--CA 1.43 -1.426 0 N-CA-C 107.735 -1.209 . . . . 62.2 107.735 174.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.594 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 39.1 mtmt -90.61 -13.81 33.65 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 109.361 -0.607 . . . . 64.23 109.361 174.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.482 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 50.0 m-80 -137.34 49.48 2.84 Favored Pre-proline 0 C--O 1.241 0.657 0 CA-C-N 115.489 -0.778 . . . . 65.01 112.187 -175.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.482 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 7.1 Cg_exo -71.33 -20.79 27.41 Favored 'Trans proline' 0 C--N 1.362 1.265 0 N-CA-C 108.522 -1.376 . . . . 65.15 108.522 -178.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -69.14 -39.45 78.83 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-N 113.851 -1.522 . . . . 74.42 109.839 178.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.559 ' CH2' ' HA ' ' A' ' 80' ' ' LEU . 61.4 t90 -74.08 -40.13 62.97 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 118.872 -1.131 . . . . 74.02 109.136 178.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.582 HD23 HD13 ' A' ' 26' ' ' LEU . 1.4 tm? -62.84 -39.86 95.65 Favored 'General case' 0 N--CA 1.434 -1.239 0 CA-C-N 114.674 -1.148 . . . . 75.5 109.783 -175.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.502 ' O ' ' HG3' ' A' ' 38' ' ' ARG . 65.9 m -53.28 -49.53 66.75 Favored 'General case' 0 CA--C 1.553 1.074 0 O-C-N 123.468 0.48 . . . . 74.33 111.024 175.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -54.46 -46.09 73.25 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.332 1.053 . . . . 64.52 112.002 177.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.424 ' HG3' ' CZ2' ' A' ' 32' ' ' TRP . 67.5 mmtt -68.6 -35.33 77.18 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 121.054 -0.258 . . . . 74.41 111.433 176.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 33' ' ' LEU . 83.9 mt -60.24 -34.31 73.51 Favored 'General case' 0 C--O 1.209 -1.035 0 O-C-N 122.333 -0.229 . . . . 61.04 110.523 175.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.502 ' HG3' ' O ' ' A' ' 34' ' ' SER . 17.9 mtm180 -61.75 -35.93 79.54 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.635 0.731 . . . . 63.11 110.264 179.542 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 69.1 m -78.69 -28.52 45.23 Favored 'General case' 0 N--CA 1.402 -2.856 0 C-N-CA 125.362 1.465 . . . . 73.41 113.055 -177.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.602 ' CD1' HG23 ' A' ' 72' ' ' THR . 61.4 m-85 -102.44 -45.8 4.97 Favored 'General case' 0 C--N 1.312 -1.028 0 N-CA-C 113.75 1.019 . . . . 54.42 113.75 -176.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 mp -85.0 125.53 70.28 Favored Pre-proline 0 C--N 1.309 -1.165 0 N-CA-C 114.359 1.244 . . . . 74.34 114.359 -173.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.64 -0.3 5.83 Favored 'Trans proline' 0 N--CA 1.451 -0.993 0 C-N-CA 122.555 2.17 . . . . 53.25 108.396 166.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 15.3 p -106.89 17.48 23.06 Favored 'General case' 0 N--CA 1.437 -1.094 0 C-N-CA 126.297 1.839 . . . . 52.35 109.902 -178.951 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -62.24 92.07 0.04 OUTLIER 'General case' 0 N--CA 1.41 -2.459 0 CA-C-N 114.168 -1.378 . . . . 73.24 111.269 179.225 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -129.47 56.6 1.7 Allowed 'General case' 0 CA--C 1.484 -1.588 0 N-CA-C 102.811 -3.033 . . . . 72.1 102.811 169.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 pp -90.2 -18.4 25.8 Favored 'General case' 0 C--N 1.295 -1.771 0 CA-C-N 113.484 -1.689 . . . . 52.25 110.051 -171.802 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -68.94 -19.88 64.19 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 114.729 -1.123 . . . . 55.33 109.833 -179.563 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 49.2 t -100.85 107.78 19.4 Favored 'General case' 0 C--N 1.284 -2.247 0 CA-C-N 114.504 -1.225 . . . . 74.33 107.762 177.55 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 73.4 m -133.28 117.39 17.31 Favored 'General case' 0 C--N 1.302 -1.495 0 CA-C-O 121.677 0.751 . . . . 73.34 110.799 179.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -69.97 -15.04 62.98 Favored 'General case' 0 CA--C 1.506 -0.725 0 CA-C-N 114.5 -1.227 . . . . 73.13 114.028 -178.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 38.4 mt-10 -137.0 165.86 31.62 Favored Pre-proline 0 N--CA 1.382 -3.848 0 N-CA-C 107.423 -1.325 . . . . 64.42 107.423 -178.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -78.67 -149.51 0.04 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.171 0 C-N-CA 122.241 1.961 . . . . 73.43 110.737 175.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 20.2 m -76.2 37.9 0.17 Allowed 'General case' 0 CA--C 1.561 1.395 0 C-N-CA 124.019 0.928 . . . . 61.13 112.61 -176.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.41 ' HB2' HG23 ' A' ' 57' ' ' VAL . 80.3 m-20 -63.69 153.01 84.96 Favored Pre-proline 0 N--CA 1.448 -0.562 0 C-N-CA 123.968 0.907 . . . . 74.12 112.196 -177.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.79 -44.56 43.98 Favored 'Trans proline' 0 C--N 1.363 1.301 0 C-N-CA 123.828 3.019 . . . . 65.31 113.341 -179.395 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 66.8 mm-40 -73.92 -23.1 59.49 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 112.301 0.482 . . . . 71.44 112.301 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.639 ' O ' ' HB3' ' A' ' 60' ' ' ARG . 91.6 t -75.59 -36.87 35.65 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 N-CA-C 108.093 -1.077 . . . . 71.4 108.093 177.257 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 45.9 mm -64.53 -45.59 95.16 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.056 0 N-CA-C 108.036 -1.098 . . . . 72.21 108.036 172.043 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -54.16 -42.7 69.89 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.011 0.924 . . . . 74.4 110.462 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.639 ' HB3' ' O ' ' A' ' 57' ' ' VAL . 36.2 ttt180 -54.5 -49.11 70.93 Favored 'General case' 0 C--N 1.318 -0.788 0 C-N-CA 125.583 1.553 . . . . 73.34 110.831 174.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.543 ' HG3' ' O ' ' A' ' 57' ' ' VAL . 90.4 mt-30 -64.58 -48.71 73.96 Favored 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.298 -0.865 . . . . 74.23 111.173 -177.407 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.514 HD12 ' CH2' ' A' ' 73' ' ' TRP . 3.8 mm? -72.13 -30.55 65.17 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-N 114.86 -1.064 . . . . 64.14 111.546 -175.202 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -53.35 -50.5 64.9 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 124.382 1.073 . . . . 71.43 111.01 175.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 38.2 mmt180 -54.92 -32.28 61.05 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-N 114.007 -1.451 . . . . 62.43 112.831 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 92.7 mt -72.18 -43.46 64.51 Favored 'General case' 0 C--N 1.311 -1.083 0 CA-C-N 116.559 -0.291 . . . . 52.13 111.019 -179.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.52 ' CE1' ' HG2' ' A' ' 70' ' ' MET . 78.1 t80 -68.04 -30.21 69.38 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.768 -0.827 . . . . 70.04 108.768 177.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -67.85 -29.56 68.73 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.038 -0.983 . . . . 42.12 110.777 176.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.44 ' HB2' HG21 ' A' ' 72' ' ' THR . 10.3 mm-40 -70.93 -55.43 8.4 Favored 'General case' 0 N--CA 1.422 -1.856 0 N-CA-C 108.748 -0.834 . . . . 72.34 108.748 174.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -171.63 145.97 9.13 Favored Glycine 0 CA--C 1.476 -2.364 0 CA-C-N 115.147 -0.933 . . . . 64.25 112.016 -175.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.52 ' HG2' ' CE1' ' A' ' 66' ' ' PHE . 66.3 mtm -70.52 -27.97 64.58 Favored 'General case' 0 C--N 1.309 -1.165 0 N-CA-C 105.51 -2.033 . . . . 72.12 105.51 170.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . 0.504 ' HA ' ' HE3' ' A' ' 74' ' ' LYS . . . -74.13 -39.4 63.35 Favored 'General case' 0 N--CA 1.438 -1.031 0 CA-C-N 113.342 -1.754 . . . . 72.54 108.719 175.895 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.602 HG23 ' CD1' ' A' ' 40' ' ' PHE . 66.8 m -58.87 -42.05 88.53 Favored 'General case' 0 N--CA 1.438 -1.054 0 CA-C-N 115.693 -0.685 . . . . 75.11 109.286 174.187 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.532 ' HD1' HG23 ' A' ' 95' ' ' VAL . 70.4 t-105 -65.88 -40.51 91.65 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 116.307 -0.406 . . . . 70.44 111.556 179.779 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.713 ' CB ' HG21 ' A' ' 95' ' ' VAL . 14.7 ptpt -67.93 -41.89 81.86 Favored 'General case' 0 CA--C 1.506 -0.72 0 O-C-N 121.518 -0.739 . . . . 71.23 112.22 179.822 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 44.3 m -63.69 -37.15 86.27 Favored 'General case' 0 N--CA 1.406 -2.674 0 CA-C-N 115.332 -0.849 . . . . 73.51 110.171 174.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 72.5 t80 -61.41 -50.72 71.7 Favored 'General case' 0 C--N 1.31 -1.117 0 CA-C-N 115.174 -0.921 . . . . 71.13 111.557 175.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.511 HG21 ' O ' ' A' ' 91' ' ' GLU . 47.3 mm -62.55 -32.12 54.29 Favored 'Isoleucine or valine' 0 C--O 1.25 1.109 0 CA-C-O 121.407 0.622 . . . . 64.55 111.013 -176.046 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 7.6 t30 -57.61 -45.75 84.94 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 114.826 -1.079 . . . . 70.42 110.151 175.213 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.494 ' O ' ' HG3' ' A' ' 83' ' ' GLU . 10.5 m-20 -78.19 -38.42 43.37 Favored 'General case' 0 C--O 1.21 -0.974 0 CA-C-N 116.407 -0.36 . . . . 72.54 111.408 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.559 ' HA ' ' CH2' ' A' ' 32' ' ' TRP . 2.2 tm? -50.07 -55.01 16.57 Favored 'General case' 0 C--N 1.311 -1.086 0 C-N-CA 125.492 1.517 . . . . 74.22 110.552 -178.698 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . 0.434 ' SG ' ' HG3' ' A' ' 91' ' ' GLU . 51.3 m -67.83 -32.68 73.39 Favored 'General case' 0 C--N 1.306 -1.317 0 CA-C-N 115.893 -0.594 . . . . 73.44 111.701 -178.352 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -70.73 -51.51 26.82 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.61 -0.723 . . . . 73.32 111.163 -177.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.494 ' HG3' ' O ' ' A' ' 79' ' ' ASP . 13.4 mt-10 -79.23 -17.43 54.8 Favored 'General case' 0 C--N 1.309 -1.155 0 N-CA-C 112.98 0.733 . . . . 61.24 112.98 -171.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 97.2 mt -90.4 11.11 22.54 Favored 'General case' 0 C--N 1.312 -1.063 0 CA-C-O 121.168 0.509 . . . . 54.43 111.431 178.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.6 t70 69.62 -59.71 0.49 Allowed 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 115.142 1.534 . . . . 53.24 115.142 172.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.424 ' HA ' ' HD3' ' A' ' 87' ' ' PRO . 31.1 m -70.29 132.53 87.87 Favored Pre-proline 0 C--N 1.299 -1.598 0 N-CA-C 112.343 0.497 . . . . 63.13 112.343 -175.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.424 ' HD3' ' HA ' ' A' ' 86' ' ' VAL . 17.3 Cg_exo -68.11 109.4 1.95 Allowed 'Trans proline' 0 C--N 1.349 0.577 0 C-N-CA 122.468 2.112 . . . . 71.24 109.252 175.218 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 79.5 mt -79.75 -44.17 21.21 Favored 'General case' 0 C--N 1.299 -1.625 0 CA-C-N 116.503 -0.317 . . . . 74.34 111.435 -174.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 26.0 t0 71.18 161.99 0.24 Allowed 'General case' 0 C--O 1.243 0.76 0 C-N-CA 125.259 1.424 . . . . 74.43 109.945 -175.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 1.6 mpt? 65.86 23.22 11.36 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 109.572 -0.529 . . . . 53.01 109.572 -171.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.629 ' O ' ' HB2' ' A' ' 94' ' ' LEU . 33.4 tt0 -56.28 -37.75 70.25 Favored 'General case' 0 C--O 1.21 -0.992 0 C-N-CA 125.641 1.576 . . . . 71.25 111.359 -177.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.553 ' HA ' HG12 ' A' ' 95' ' ' VAL . 38.5 mm -72.16 -48.78 10.18 Favored Pre-proline 0 C--N 1.274 -2.705 0 O-C-N 120.983 -1.073 . . . . 73.33 109.996 178.653 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.476 ' HG3' ' HA ' ' A' ' 9' ' ' GLU . 68.1 Cg_exo -51.35 -29.9 32.19 Favored 'Trans proline' 0 CA--C 1.563 1.928 0 C-N-CA 121.311 1.341 . . . . 73.22 111.844 166.085 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.629 ' HB2' ' O ' ' A' ' 91' ' ' GLU . 9.2 mp -59.63 -36.5 76.47 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.835 -0.432 . . . . 62.25 109.835 171.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.713 HG21 ' CB ' ' A' ' 74' ' ' LYS . 3.7 p -85.88 -41.63 15.42 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.718 0 CA-C-O 122.375 1.083 . . . . 54.34 113.246 178.544 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 75.2 m -71.4 7.17 1.45 Allowed 'General case' 0 C--N 1.246 -3.904 0 C-N-CA 125.189 1.396 . . . . 65.44 113.845 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 15.1 tt -73.34 -17.9 17.84 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.455 0 N-CA-C 114.193 1.183 . . . . 75.5 114.193 -172.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -89.28 -78.49 0.35 Allowed 'General case' 0 C--N 1.315 -0.915 0 N-CA-C 114.738 1.385 . . . . 74.4 114.738 -174.13 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -120.52 -108.95 2.18 Favored Glycine 0 N--CA 1.429 -1.783 0 CA-C-N 115.931 -0.577 . . . . 43.31 113.332 -170.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_exo -55.96 116.76 3.4 Favored 'Trans proline' 0 C--O 1.248 1.006 0 C-N-CA 123.406 2.737 . . . . 63.12 113.448 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 11.9 mpt_? . . . . . 0 N--CA 1.436 -1.154 0 N-CA-C 107.977 -1.12 . . . . 72.25 107.977 172.815 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 111.076 -0.81 . . . . 73.44 111.076 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 21.8 Cg_endo -92.91 30.54 0.29 Allowed 'Trans proline' 0 CA--C 1.537 0.672 0 C-N-CA 123.616 2.877 . . . . 74.2 112.39 -176.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 65.94 95.74 0.06 Allowed 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.166 0.986 . . . . 75.13 111.807 -179.078 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -69.39 -50.2 33.85 Favored Glycine 0 CA--C 1.489 -1.551 0 N-CA-C 108.795 -1.722 . . . . 61.34 108.795 176.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 18.6 m -80.95 99.15 8.24 Favored 'General case' 0 N--CA 1.417 -2.11 0 N-CA-C 107.376 -1.342 . . . . 62.53 107.376 174.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' MET . . . . . 0.403 ' HG3' HD11 ' A' ' 92' ' ' ILE . 22.5 ttt -80.04 -18.37 50.31 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-O 122.005 0.907 . . . . 63.21 109.698 -176.389 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -91.29 25.83 2.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 115.267 -0.879 . . . . 71.43 109.926 178.374 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . 0.423 ' O ' ' HB ' ' A' ' 11' ' ' ILE . . . -76.7 -10.35 59.32 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 114.937 -1.029 . . . . 52.02 108.882 173.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . 0.615 ' OE2' ' HE2' ' A' ' 74' ' ' LYS . 6.1 pt-20 -58.64 -38.68 78.62 Favored 'General case' 0 C--O 1.215 -0.745 0 CA-C-N 115.241 -0.891 . . . . 74.4 109.697 175.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 50.0 m -57.78 -26.73 62.33 Favored 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 125.226 1.41 . . . . 71.44 111.165 179.566 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ILE . . . . . 0.423 ' HB ' ' O ' ' A' ' 8' ' ' ALA . 1.1 mp -88.04 -27.59 5.56 Favored 'Isoleucine or valine' 0 N--CA 1.416 -2.136 0 CA-C-N 114.471 -1.241 . . . . 74.21 110.66 -176.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -82.55 -66.82 0.84 Allowed 'General case' 0 C--O 1.244 0.786 0 N-CA-C 113.793 1.034 . . . . 73.11 113.793 -172.688 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 43.99 -172.19 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 115.508 1.67 . . . . 71.11 115.508 -178.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 56.9 t30 40.19 88.38 0.01 OUTLIER 'General case' 0 N--CA 1.488 1.459 0 C-N-CA 126.679 1.992 . . . . 74.4 115.843 171.325 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.1 t-20 -179.48 108.24 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.57 0.7 . . . . 75.24 110.356 174.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -71.98 -28.42 63.4 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 124.636 1.174 . . . . 61.45 112.526 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -58.6 -27.6 64.8 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 112.782 0.66 . . . . 63.32 112.782 -174.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.48 ' HB2' HD12 ' A' ' 97' ' ' ILE . 3.1 mm? -64.32 -36.3 83.68 Favored 'General case' 0 CA--C 1.517 -0.318 0 C-N-CA 121.099 -0.24 . . . . 73.44 110.519 176.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TRP . . . . . 0.514 ' HB2' HD11 ' A' ' 97' ' ' ILE . 74.7 t-105 -69.63 -49.58 52.54 Favored 'General case' 0 N--CA 1.441 -0.912 0 CA-C-N 116.128 -0.487 . . . . 75.44 110.219 -176.818 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -61.27 -39.75 91.55 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 116.136 -0.484 . . . . 61.12 110.813 179.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TRP . . . . . 0.502 ' HE1' ' HG ' ' A' ' 88' ' ' LEU . 13.6 t-105 -60.85 -50.32 73.89 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 116.202 -0.454 . . . . 74.25 110.306 176.084 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.455 ' O ' ' HG ' ' A' ' 26' ' ' LEU . 3.3 tm? -57.63 -53.07 62.29 Favored 'General case' 0 N--CA 1.451 -0.417 0 O-C-N 124.073 0.858 . . . . 70.34 109.418 -178.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 64.1 t -58.41 -47.36 88.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-N 115.873 -0.603 . . . . 60.13 112.227 -178.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.489 ' O ' ' HG3' ' A' ' 28' ' ' LYS . 74.7 mtp180 -69.18 -44.42 72.22 Favored 'General case' 0 C--N 1.314 -0.978 0 N-CA-C 112.163 0.431 . . . . 63.4 112.163 -176.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.476 HD12 HD13 ' A' ' 84' ' ' LEU . 1.8 tm? -67.57 -39.84 84.9 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 109.199 -0.667 . . . . 75.23 109.199 -176.316 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.455 ' HG ' ' O ' ' A' ' 22' ' ' LEU . 4.7 mt -73.9 -25.1 59.83 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 116.165 -0.471 . . . . 75.41 112.233 177.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 34.2 t -67.02 -20.99 65.95 Favored 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 108.176 -1.046 . . . . 64.42 108.176 175.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.489 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 33.5 mtmt -91.79 -15.21 28.61 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-O 121.548 0.69 . . . . 62.34 109.716 177.629 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.447 ' N ' ' HD3' ' A' ' 30' ' ' PRO . 45.3 m-80 -129.84 51.86 8.28 Favored Pre-proline 0 C--O 1.241 0.647 0 CA-C-N 115.375 -0.829 . . . . 61.41 112.683 -175.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.447 ' HD3' ' N ' ' A' ' 29' ' ' ASN . 17.8 Cg_exo -68.56 -20.66 40.88 Favored 'Trans proline' 0 C--N 1.365 1.416 0 N-CA-C 108.546 -1.367 . . . . 64.32 108.546 178.176 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -63.25 -43.21 98.66 Favored 'General case' 0 N--CA 1.429 -1.485 0 CA-C-N 113.187 -1.824 . . . . 75.32 109.549 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TRP . . . . . 0.458 ' HE1' ' HG3' ' A' ' 83' ' ' GLU . 67.8 t90 -76.02 -47.7 23.82 Favored 'General case' 0 N--CA 1.445 -0.713 0 CA-C-O 121.943 0.878 . . . . 65.54 110.419 176.419 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.488 ' O ' ' HG ' ' A' ' 37' ' ' LEU . 2.3 tm? -58.89 -44.29 91.12 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 114.181 -1.372 . . . . 62.35 112.221 -172.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.7 p -52.76 -54.15 37.98 Favored 'General case' 0 C--N 1.316 -0.879 0 O-C-N 123.54 0.525 . . . . 64.22 111.67 178.047 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -55.24 -45.49 76.01 Favored 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.108 1.363 . . . . 72.41 111.703 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 45.2 mmtt -64.6 -43.9 92.32 Favored 'General case' 0 N--CA 1.436 -1.164 0 N-CA-C 112.511 0.56 . . . . 74.52 112.511 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.578 ' HB3' ' SD ' ' A' ' 44' ' ' MET . 77.2 mt -55.54 -39.68 70.87 Favored 'General case' 0 C--O 1.213 -0.866 0 O-C-N 123.382 0.426 . . . . 72.14 111.135 177.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 17.1 mtp180 -62.29 -26.23 68.29 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.387 0.613 . . . . 73.03 112.224 -178.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 42.6 t -83.52 -22.26 32.51 Favored 'General case' 0 CA--C 1.549 0.941 0 CA-C-N 115.693 -0.685 . . . . 54.52 110.311 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PHE . . . . . 0.458 ' CD1' HG23 ' A' ' 72' ' ' THR . 48.4 m-85 -98.05 -57.42 2.22 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 116.281 -0.418 . . . . 64.23 111.784 -178.095 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.561 ' CD1' ' HB3' ' A' ' 64' ' ' ARG . 1.4 mm? -85.34 113.19 49.14 Favored Pre-proline 0 N--CA 1.423 -1.778 0 N-CA-C 109.009 -0.737 . . . . 74.31 109.009 -178.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 33.2 Cg_endo -63.17 -33.38 72.56 Favored 'Trans proline' 0 CA--C 1.538 0.686 0 C-N-CA 123.276 2.651 . . . . 72.41 115.532 -171.032 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -114.49 28.22 8.9 Favored 'General case' 0 C--N 1.296 -1.758 0 CA-C-O 121.912 0.863 . . . . 61.2 112.525 -176.059 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.578 ' SD ' ' HB3' ' A' ' 37' ' ' LEU . 23.2 ttm -89.25 106.55 18.51 Favored 'General case' 0 N--CA 1.406 -2.641 0 N-CA-C 115.275 1.583 . . . . 75.24 115.275 -175.791 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -111.78 79.23 1.19 Allowed 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 105.214 -2.143 . . . . 50.14 105.214 169.44 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -86.19 -2.0 57.96 Favored 'General case' 0 C--N 1.303 -1.422 0 CA-C-N 115.145 -0.934 . . . . 41.44 111.727 -173.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -78.39 45.84 0.59 Allowed 'General case' 0 C--N 1.318 -0.786 0 CA-C-O 122.818 1.294 . . . . 73.0 112.678 -174.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 5.2 p -117.04 97.92 6.19 Favored 'General case' 0 C--N 1.284 -2.264 0 N-CA-C 107.118 -1.438 . . . . 63.15 107.118 174.217 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 20.2 m -81.86 83.72 7.11 Favored 'General case' 0 N--CA 1.422 -1.851 0 CA-C-O 121.86 0.838 . . . . 74.12 112.053 -175.074 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -76.74 -33.55 58.11 Favored 'General case' 0 C--N 1.307 -1.239 0 CA-C-O 122.529 1.157 . . . . 65.2 110.837 174.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -137.48 167.51 20.32 Favored Pre-proline 0 N--CA 1.384 -3.769 0 C-N-CA 126.695 1.998 . . . . 72.14 106.501 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -81.93 -148.42 0.03 OUTLIER 'Trans proline' 0 N--CA 1.446 -1.275 0 C-N-CA 122.001 1.801 . . . . 72.32 110.664 174.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 6.4 m -76.26 37.28 0.16 Allowed 'General case' 0 C--N 1.303 -1.418 0 C-N-CA 124.291 1.036 . . . . 73.22 111.776 -176.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.483 ' HB2' HG23 ' A' ' 57' ' ' VAL . 76.5 m-20 -64.18 148.25 95.85 Favored Pre-proline 0 N--CA 1.44 -0.975 0 C-N-CA 123.605 0.762 . . . . 73.31 112.983 -175.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 17.1 Cg_endo -58.31 -35.12 99.04 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 123.479 2.786 . . . . 65.41 112.68 -179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -72.6 -31.27 65.05 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.171 0.51 . . . . 71.4 109.96 -179.773 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.483 HG23 ' HB2' ' A' ' 54' ' ' ASN . 94.6 t -67.8 -52.03 44.26 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.999 0 N-CA-C 108.347 -0.983 . . . . 73.41 108.347 177.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 47.1 mm -55.06 -43.45 69.82 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 CA-C-N 114.478 -1.237 . . . . 72.31 109.849 176.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -58.71 -40.53 83.98 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.133 -0.94 . . . . 72.34 111.039 -178.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.416 ' O ' ' HB3' ' A' ' 63' ' ' ASN . 37.0 ttt180 -64.81 -37.55 88.01 Favored 'General case' 0 C--O 1.242 0.693 0 CA-C-O 121.681 0.753 . . . . 72.52 110.554 178.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.451 ' O ' ' HB2' ' A' ' 64' ' ' ARG . 94.5 mt-30 -72.66 -48.68 37.29 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-N 114.492 -1.231 . . . . 72.34 111.525 -176.648 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.511 HD13 HD12 ' A' ' 65' ' ' LEU . 4.3 mm? -67.36 -30.61 70.46 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 115.269 -0.878 . . . . 62.34 110.885 -178.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.416 ' HB3' ' O ' ' A' ' 60' ' ' ARG . 3.5 t-20 -54.06 -46.08 71.86 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.658 1.183 . . . . 74.23 110.222 174.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.561 ' HB3' ' CD1' ' A' ' 41' ' ' LEU . 26.1 mmt180 -56.39 -36.65 69.14 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 114.626 -1.17 . . . . 62.35 112.594 178.86 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LEU . . . . . 0.511 HD12 HD13 ' A' ' 62' ' ' LEU . 97.8 mt -71.04 -31.0 67.34 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 111.7 0.259 . . . . 62.12 111.7 -177.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' PHE . . . . . . . . . . . . . 78.9 t80 -59.32 -35.74 74.37 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.055 -0.72 . . . . 74.2 109.055 176.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -74.82 -27.41 60.28 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 115.072 -0.967 . . . . 73.21 112.103 -179.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.419 ' CB ' HG21 ' A' ' 72' ' ' THR . 5.1 mm-40 -70.66 -52.7 19.47 Favored 'General case' 0 N--CA 1.423 -1.778 0 C-N-CA 120.824 -0.35 . . . . 63.11 111.36 -179.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 178.42 143.75 5.32 Favored Glycine 0 CA--C 1.477 -2.319 0 C-N-CA 118.835 -1.65 . . . . 61.44 114.537 -173.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.418 ' O ' ' HG3' ' A' ' 74' ' ' LYS . 26.2 ptm -67.38 -30.67 70.51 Favored 'General case' 0 C--N 1.314 -0.951 0 N-CA-C 106.887 -1.523 . . . . 71.2 106.887 168.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -75.7 -37.37 59.54 Favored 'General case' 0 N--CA 1.443 -0.781 0 CA-C-N 114.36 -1.291 . . . . 40.43 108.538 177.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 0.458 HG23 ' CD1' ' A' ' 40' ' ' PHE . 86.6 m -62.19 -38.73 90.21 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 114.912 -1.04 . . . . 65.14 111.089 178.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' TRP . . . . . 0.518 ' CD1' ' HA ' ' A' ' 95' ' ' VAL . 39.8 t-105 -68.25 -36.06 78.86 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.491 -0.559 . . . . 71.15 109.491 179.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . 0.615 ' HE2' ' OE2' ' A' ' 9' ' ' GLU . 85.5 mttt -58.17 -52.27 66.26 Favored 'General case' 0 CA--C 1.505 -0.782 0 CA-C-O 120.763 0.316 . . . . 74.4 110.199 174.22 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 49.1 m -60.34 -38.48 83.91 Favored 'General case' 0 N--CA 1.405 -2.688 0 CA-C-N 115.433 -0.803 . . . . 72.21 111.136 179.147 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -61.14 -50.58 72.63 Favored 'General case' 0 N--CA 1.431 -1.387 0 CA-C-N 115.112 -0.949 . . . . 74.51 110.798 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.509 HG21 ' O ' ' A' ' 91' ' ' GLU . 46.5 mm -70.15 -30.89 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.129 0 C-N-CA 119.627 -0.829 . . . . 53.03 110.573 -177.469 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -57.84 -47.47 82.59 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.376 -0.829 . . . . 74.31 109.874 176.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -73.28 -37.25 66.32 Favored 'General case' 0 CA--C 1.512 -0.489 0 CA-C-N 115.951 -0.568 . . . . 74.32 111.239 177.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 0.417 HD12 HD21 ' A' ' 88' ' ' LEU . 1.9 tm? -50.45 -54.27 23.3 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.846 1.259 . . . . 74.31 109.449 178.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 56.6 m -66.71 -44.4 81.76 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.687 -0.688 . . . . 65.13 111.347 -178.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -61.62 -54.24 45.59 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 121.291 0.567 . . . . 65.42 111.097 -175.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.458 ' HG3' ' HE1' ' A' ' 32' ' ' TRP . 22.5 mm-40 -70.21 -40.62 74.43 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.173 -0.921 . . . . 74.41 113.485 -175.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.476 HD13 HD12 ' A' ' 25' ' ' LEU . 82.6 mt -80.32 -39.8 27.98 Favored 'General case' 0 N--CA 1.431 -1.423 0 C-N-CA 120.011 -0.676 . . . . 53.35 112.63 -174.638 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -169.2 -96.62 0.01 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 118.03 0.377 . . . . 65.13 110.821 179.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.492 ' HB ' ' HD2' ' A' ' 87' ' ' PRO . 34.8 m -141.04 173.28 5.04 Favored Pre-proline 0 C--N 1.314 -0.947 0 N-CA-C 104.945 -2.243 . . . . 63.14 104.945 175.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.492 ' HD2' ' HB ' ' A' ' 86' ' ' VAL . 5.6 Cg_endo -50.89 105.48 0.1 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 121.859 1.706 . . . . 71.21 110.3 171.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LEU . . . . . 0.588 HD22 ' H ' ' A' ' 88' ' ' LEU . 0.0 OUTLIER -50.39 -53.3 30.28 Favored 'General case' 0 N--CA 1.464 0.261 0 C-N-CA 125.314 1.446 . . . . 74.32 111.227 -172.446 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -154.2 48.81 0.62 Allowed 'General case' 0 C--N 1.301 -1.531 0 N-CA-C 104.344 -2.465 . . . . 50.11 104.344 178.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' MET . . . . . 0.518 ' O ' HD23 ' A' ' 94' ' ' LEU . 65.7 mtt 74.31 146.14 0.08 Allowed 'General case' 0 C--O 1.221 -0.436 0 CA-C-N 112.655 -2.066 . . . . 71.34 109.84 -170.529 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLU . . . . . 0.509 ' O ' HG21 ' A' ' 77' ' ' ILE . 0.8 OUTLIER -71.73 -35.18 70.08 Favored 'General case' 0 C--N 1.29 -2.01 0 CA-C-O 122.273 1.035 . . . . 73.41 110.817 178.107 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.684 ' HA ' HG12 ' A' ' 95' ' ' VAL . 31.3 mm -59.42 -49.8 90.58 Favored Pre-proline 0 C--N 1.279 -2.487 0 CA-C-N 114.353 -1.294 . . . . 74.33 114.043 -172.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . 0.407 ' HD3' ' HB ' ' A' ' 92' ' ' ILE . 74.8 Cg_exo -54.85 -35.46 88.78 Favored 'Trans proline' 0 N--CA 1.488 1.184 0 C-N-CA 122.211 1.941 . . . . 74.51 111.259 174.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LEU . . . . . 0.518 HD23 ' O ' ' A' ' 90' ' ' MET . 4.0 mm? -71.42 -33.6 69.57 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 114.845 -1.07 . . . . 63.42 110.916 178.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' VAL . . . . . 0.684 HG12 ' HA ' ' A' ' 92' ' ' ILE . 4.3 p -83.59 -33.63 9.88 Favored 'Isoleucine or valine' 0 CA--C 1.499 -1.01 0 C-N-CA 119.355 -0.938 . . . . 71.24 112.3 179.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.3 t -55.71 -26.39 44.98 Favored 'General case' 0 C--N 1.269 -2.915 0 CA-C-N 113.768 -1.56 . . . . 54.14 112.068 177.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.514 HD11 ' HB2' ' A' ' 19' ' ' TRP . 12.0 tt -69.02 -30.38 46.45 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.096 0 CA-C-N 116.505 -0.316 . . . . 45.35 110.59 -177.683 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 16.7 t90 28.49 80.77 0.02 OUTLIER 'General case' 0 C--O 1.244 0.812 0 C-N-CA 127.265 2.226 . . . . 72.42 116.019 -177.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 100.64 -172.45 23.88 Favored Glycine 0 N--CA 1.418 -2.516 0 CA-C-N 115.042 -0.981 . . . . 62.14 112.243 175.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 10.3 Cg_endo -91.17 48.96 0.7 Allowed 'Trans proline' 0 N--CA 1.449 -1.11 0 C-N-CA 123.866 3.044 . . . . 74.45 111.409 -179.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 38.4 ptt180 . . . . . 0 C--N 1.3 -1.573 0 CA-C-N 115.957 -0.565 . . . . 72.31 110.606 179.97 . . . . . . . . 0 0 . 1 stop_ save_