data_1y32_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 1y32 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 120.712 0.292 . . . . 0.0 111.126 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.77 162.74 40.9 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 112.314 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -81.05 5.05 17.69 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.501 0.667 . . . . 0.0 111.674 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -79.62 -51.51 5.15 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.074 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.83 -33.01 24.98 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.49 -42.6 87.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.515 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -70.04 -52.6 22.68 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.5 mp -60.34 -26.18 66.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.79 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.02 -66.92 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.47 -27.62 67.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.003 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.3 tp -59.78 -30.02 68.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.401 ' CG2' ' O ' ' A' ' 13' ' ' THR . 27.5 m -97.78 27.4 4.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.1 t -130.5 -46.43 1.08 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.948 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -76.02 -31.67 59.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.3 mt -75.6 -28.2 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.239 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.41 27.37 4.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.069 0.462 . . . . 0.0 110.983 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.423 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 16.3 tp -72.06 -60.37 2.35 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.5 Cg_endo -63.9 -56.73 0.44 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.295 1.997 . . . . 0.0 112.372 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.1 t . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.046 -179.937 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 120.787 0.327 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.03 156.13 66.2 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.551 2.167 . . . . 0.0 112.296 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.27 3.78 26.21 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.549 0.69 . . . . 0.0 111.612 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.92 -45.46 16.4 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.156 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -92.1 -32.2 15.24 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.0 t -64.98 -33.84 77.01 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.435 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -91.48 -39.7 11.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.947 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 tp -62.96 -32.26 73.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.159 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.7 pp -58.63 -30.57 67.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.899 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 tp -72.05 -30.49 65.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.852 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 mp -68.37 -28.82 67.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.957 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.7 m -55.76 -28.98 58.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.4 t -99.43 -39.67 8.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.0 -45.0 95.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.982 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.425 HG21 HD11 ' A' ' 16' ' ' ILE . 39.8 mt -75.59 -24.55 17.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.319 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.09 26.38 5.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.939 0.4 . . . . 0.0 111.105 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.22 -57.44 0.4 Allowed Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.944 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -78.55 -52.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.485 2.124 . . . . 0.0 112.443 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.406 -179.84 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.666 0.269 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -69.35 148.93 68.83 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.554 2.169 . . . . 0.0 112.302 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.1 ptt85 -76.12 2.26 13.43 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.379 0.609 . . . . 0.0 112.329 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.26 -53.25 5.71 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.431 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.37 -31.05 26.95 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -65.26 -40.06 93.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.644 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 90.8 m -80.79 -35.02 33.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.84 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.72 -52.89 63.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.6 pp -58.59 -33.06 69.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.921 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.1 mt -75.61 -45.85 35.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.82 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.29 -28.55 68.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.9 m -96.87 27.8 3.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.976 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -130.66 -46.24 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.814 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -76.97 -35.67 57.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.866 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.8 mp -94.43 12.62 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.362 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.31 26.84 5.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.04 0.448 . . . . 0.0 110.957 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.527 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -61.93 -53.68 57.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.105 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 26.9 Cg_endo -63.39 -55.97 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.244 1.963 . . . . 0.0 112.195 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.089 -179.983 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.736 0.303 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.72 154.69 54.32 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.575 2.183 . . . . 0.0 112.313 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.47 1.7 15.8 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.423 0.63 . . . . 0.0 112.245 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -77.63 -46.63 9.56 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.915 -1.038 . . . . 0.0 111.469 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -86.69 -31.99 20.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.969 0.414 . . . . 0.0 109.992 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.1 t -67.25 -36.58 81.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.694 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.2 m -88.0 -30.75 19.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.009 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.6 mt -62.2 -36.75 82.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.095 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 pp -58.31 -30.56 66.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.961 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.2 mt -89.63 -42.43 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.74 -28.77 67.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.99 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 22.7 m -97.93 29.03 3.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.0 p -132.01 -46.26 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -82.31 -29.26 31.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.985 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.6 mm -77.46 -23.89 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.348 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.08 27.03 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.091 0.472 . . . . 0.0 111.105 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.468 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 18.9 mt -71.81 -56.99 4.36 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.189 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.468 ' HD3' ' HB2' ' A' ' 18' ' ' LEU . 37.7 Cg_endo -68.46 -54.32 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.343 2.029 . . . . 0.0 112.461 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.4 p . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.265 -179.978 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.092 0 CA-C-O 120.733 0.301 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -73.54 150.74 46.32 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.99 4.25 20.22 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.56 0.695 . . . . 0.0 111.653 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.56 -50.96 4.5 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.075 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -79.0 -33.24 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 178.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.06 74.96 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.507 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.5 m -62.3 -53.59 52.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.712 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.5 tp -61.54 -30.75 70.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 24.1 tp -72.42 -35.34 68.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.831 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -30.44 20.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.861 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.8 tp -65.46 -32.3 73.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 m -82.42 -25.89 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.01 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -83.75 -47.95 10.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.148 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.42 -34.53 70.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.017 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 22.7 mm -91.06 11.94 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.405 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -100.06 28.57 4.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.083 0.468 . . . . 0.0 110.859 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.514 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.3 OUTLIER -66.83 -54.17 23.1 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.178 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 34.8 Cg_endo -66.23 -55.7 0.36 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.195 1.93 . . . . 0.0 112.528 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.8 t . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.314 -179.818 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.733 0.301 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.41 142.5 45.2 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.602 2.201 . . . . 0.0 112.263 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.3 ptt-85 -76.21 3.36 10.9 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.434 0.635 . . . . 0.0 112.456 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -77.83 -55.91 4.0 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.489 179.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.17 -32.65 33.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.403 . . . . 0.0 110.037 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.67 -45.12 84.07 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.544 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.97 -52.82 38.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.667 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mp -61.24 -31.34 71.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.72 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.2 tp -66.76 -31.18 71.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.821 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.35 -26.83 22.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.983 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.5 tp -66.52 -29.74 69.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.91 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.0 m -97.67 28.84 3.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.2 p -134.47 -46.3 0.75 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -82.29 -35.8 27.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.991 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.2 mp -91.72 12.83 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.53 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -98.58 26.52 5.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.034 0.445 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.511 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 5.9 mt -70.18 -53.92 10.12 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.309 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.9 Cg_endo -63.8 -54.81 0.81 Allowed 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.216 1.944 . . . . 0.0 112.403 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.443 179.97 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.671 0.272 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.65 145.67 70.6 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.458 2.106 . . . . 0.0 112.315 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.93 2.89 24.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.549 0.69 . . . . 0.0 111.699 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.96 -47.04 7.92 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.228 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -86.0 -32.12 21.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.6 t -64.2 -41.1 97.22 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.542 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.6 m -83.69 -32.06 25.76 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.945 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.75 -48.1 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.114 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 pp -56.77 -33.13 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.011 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.6 mp -62.7 -35.5 79.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.903 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.9 tp -71.24 -32.2 68.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.2 t -98.08 29.43 3.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.95 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -131.23 -46.29 1.0 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.787 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.24 -31.65 66.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.83 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 21.7 mt -105.5 11.83 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.449 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -102.9 26.5 8.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.065 0.459 . . . . 0.0 110.866 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.458 ' N ' ' CD ' ' A' ' 19' ' ' PRO . 1.8 mt -81.93 -47.64 0.98 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.273 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 18' ' ' LEU . 72.5 Cg_endo -80.2 -51.69 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.304 2.003 . . . . 0.0 112.465 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.6 t . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.166 -179.948 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.717 0.294 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.88 138.64 41.23 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.608 2.205 . . . . 0.0 112.323 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -80.76 4.0 20.44 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.512 0.672 . . . . 0.0 111.755 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.02 -54.61 5.2 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.296 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -85.54 -31.37 22.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t -65.24 -39.47 92.76 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.471 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.2 t -78.58 -40.76 33.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.796 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.87 -40.57 73.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.091 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.6 pp -81.07 -28.83 35.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -32.79 70.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.973 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.1 tp -68.21 -30.44 69.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.883 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.5 m -84.13 -26.96 28.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.059 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.1 p -73.83 -40.77 63.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.966 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.54 -35.25 75.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.09 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.9 tp -81.18 -39.16 17.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.021 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.66 27.98 2.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.204 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.463 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 36.3 tp -66.48 -57.66 11.92 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.139 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 25.9 Cg_endo -62.51 -55.37 0.93 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.402 2.068 . . . . 0.0 112.292 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.9 m . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.547 -179.969 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.687 0.28 . . . . 0.0 111.098 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 155.37 66.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.475 2.117 . . . . 0.0 112.35 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -75.94 2.36 12.76 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.464 0.65 . . . . 0.0 112.344 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.19 -57.46 3.99 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.548 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.73 -30.68 36.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.877 0.37 . . . . 0.0 110.058 179.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.9 t -64.4 -45.8 86.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.665 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 69.1 m -71.1 -43.96 66.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.9 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -49.65 76.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.983 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.2 pp -71.15 -26.7 63.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.9 mt -56.8 -30.37 63.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.0 mp -65.86 -31.37 72.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.934 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.4 m -66.28 -31.42 72.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.912 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -98.4 -31.08 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.907 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.06 -57.1 14.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.938 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.8 mt -62.74 -38.41 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.088 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.58 27.31 5.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.434 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 13.3 tp -71.21 -59.72 3.16 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.134 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.1 Cg_endo -63.25 -56.83 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.287 1.991 . . . . 0.0 112.357 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 16.0 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.056 -179.964 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.083 0 CA-C-O 120.701 0.286 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.85 163.91 36.6 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.511 2.141 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -81.29 3.6 23.5 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.431 0.634 . . . . 0.0 111.647 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -72.49 -52.35 10.49 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.044 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -89.25 -31.29 17.95 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.4 t -62.79 -33.56 75.45 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.359 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -88.66 -40.5 13.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.796 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -56.24 -39.49 72.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 pp -57.67 -28.89 64.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.03 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.97 -28.7 64.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.013 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.35 -29.28 65.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.5 m -57.66 -30.34 65.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.6 m -98.57 -31.35 12.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -66.18 -34.7 78.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.905 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 23.4 mt -91.55 12.06 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.546 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -106.69 26.77 9.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.063 0.458 . . . . 0.0 110.916 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.425 ' CB ' ' CD ' ' A' ' 19' ' ' PRO . 0.4 OUTLIER -74.24 -62.68 0.98 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.033 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 18' ' ' LEU . 33.3 Cg_endo -66.03 -56.03 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.322 2.014 . . . . 0.0 112.409 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.4 t . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.043 179.992 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.739 0.304 . . . . 0.0 111.102 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.1 151.84 67.28 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.534 2.156 . . . . 0.0 112.354 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.09 4.74 21.92 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.499 0.666 . . . . 0.0 111.599 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.74 -51.9 6.82 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.024 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.92 -34.94 19.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -59.91 -42.16 93.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.396 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -80.73 -37.23 30.93 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.707 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 tp -53.64 -31.16 46.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.066 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 33.9 mt -54.89 -75.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -66.06 -29.17 69.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.036 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.5 tp -59.55 -30.95 68.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.9 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.8 m -98.14 28.02 4.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.891 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -135.96 -46.27 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.933 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -80.6 -27.06 37.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.958 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 21.4 mt -91.23 13.25 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.616 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -97.43 26.98 4.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 111.038 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.501 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 28.1 tp -66.63 -56.77 13.76 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.188 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 21.0 Cg_endo -61.42 -55.13 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.302 2.001 . . . . 0.0 112.256 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.3 m . . . . . 0 N--CA 1.462 0.164 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.616 -179.744 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.687 0.28 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.32 161.32 45.24 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.556 2.17 . . . . 0.0 112.312 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.97 2.52 26.51 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.552 0.691 . . . . 0.0 111.584 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.28 -44.86 10.65 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.092 178.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -86.65 -32.92 20.29 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.6 t -62.62 -39.82 95.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.588 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.4 m -85.58 -33.08 21.78 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.94 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mt -60.27 -38.45 83.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.183 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.9 pp -58.23 -27.1 63.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.167 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.9 mt -75.37 -25.29 57.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.18 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.05 -42.23 80.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.125 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.2 t -55.83 -28.42 56.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 t -82.56 -45.78 14.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.962 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.51 -50.91 69.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.024 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.1 mm -58.47 -21.76 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.239 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.16 26.54 5.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 111.125 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.481 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 42.6 tp -71.11 -57.56 4.68 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.253 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 24.3 Cg_endo -62.16 -53.78 1.8 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.32 2.014 . . . . 0.0 112.334 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.5 t . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.39 -179.83 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.744 0.307 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.68 153.6 59.53 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.619 2.213 . . . . 0.0 112.258 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -81.14 2.47 27.37 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.609 0.719 . . . . 0.0 111.68 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -79.53 -46.94 7.65 Favored Glycine 0 N--CA 1.445 -0.763 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.227 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -84.38 -34.21 23.64 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 34.8 t -61.42 -46.87 88.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.491 179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.4 m -76.47 -35.4 58.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.8 mt -60.14 -56.41 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.952 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.8 pp -58.97 -32.03 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.002 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.52 -47.66 85.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.6 mp -85.67 -31.97 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.957 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -66.06 -27.87 68.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.026 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 p -97.55 -30.63 12.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.039 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -74.4 -30.32 61.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.1 mt -96.51 -31.72 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.226 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -99.44 27.86 4.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.103 0.478 . . . . 0.0 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.464 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 23.8 tp -66.24 -58.85 9.65 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.102 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.5 Cg_endo -63.22 -55.56 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.301 2.001 . . . . 0.0 112.424 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.9 t . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.364 -179.837 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.693 0.282 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.64 153.62 69.27 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.514 2.142 . . . . 0.0 112.39 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.39 2.29 13.98 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.469 0.652 . . . . 0.0 112.436 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.42 -48.51 7.34 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.533 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -85.36 -31.5 22.93 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.1 t -66.93 -41.2 87.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.735 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.6 m -80.98 -34.76 32.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.39 -52.97 63.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.061 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.8 pp -59.31 -30.66 68.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.979 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 28.6 mt -74.71 -30.93 61.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -52.36 65.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.949 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.9 t -58.32 -29.24 65.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.979 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.6 t -82.98 -43.6 16.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.938 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -65.0 -39.8 93.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.0 mt -71.02 -19.67 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.392 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.8 26.83 4.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.075 0.464 . . . . 0.0 111.075 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.432 ' N ' ' CD ' ' A' ' 19' ' ' PRO . 8.9 tp -82.92 -50.01 0.74 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.345 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 18' ' ' LEU . 73.7 Cg_endo -79.79 -50.15 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.434 2.089 . . . . 0.0 112.509 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.1 t . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.379 -179.859 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptp . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.77 0.319 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.12 88.34 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.126 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.77 162.74 40.9 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 112.314 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -81.05 5.05 17.69 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.501 0.667 . . . . 0.0 111.674 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -79.62 -51.51 5.15 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.074 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.83 -33.01 24.98 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -66.49 -42.6 87.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.515 179.421 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -70.04 -52.6 22.68 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.5 mp -60.34 -26.18 66.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.79 179.765 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.02 -66.92 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.47 -27.62 67.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.003 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.3 tp -59.78 -30.02 68.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.401 ' CG2' ' O ' ' A' ' 13' ' ' THR . 27.5 m -97.78 27.4 4.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.1 t -130.5 -46.43 1.08 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.948 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -76.02 -31.67 59.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 29.3 mt -75.6 -28.2 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.239 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.41 27.37 4.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.069 0.462 . . . . 0.0 110.983 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.423 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 16.3 tp -72.06 -60.37 2.35 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.423 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.5 Cg_endo -63.9 -56.73 0.44 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.295 1.997 . . . . 0.0 112.372 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.1 t 60.67 30.64 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.046 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -178.02 -39.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.897 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.06 147.26 35.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.71 -69.19 0.58 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.145 179.976 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.838 0.352 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.44 53.69 3.47 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.113 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.03 156.13 66.2 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.551 2.167 . . . . 0.0 112.296 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.27 3.78 26.21 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.549 0.69 . . . . 0.0 111.612 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.92 -45.46 16.4 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.156 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -92.1 -32.2 15.24 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 9.0 t -64.98 -33.84 77.01 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.435 179.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.9 t -91.48 -39.7 11.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.947 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 tp -62.96 -32.26 73.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.159 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.7 pp -58.63 -30.57 67.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.899 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 3.8 tp -72.05 -30.49 65.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.852 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.3 mp -68.37 -28.82 67.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.957 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.7 m -55.76 -28.98 58.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 10.4 t -99.43 -39.67 8.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.0 -45.0 95.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.982 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.425 HG21 HD11 ' A' ' 16' ' ' ILE . 39.8 mt -75.59 -24.55 17.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.319 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.09 26.38 5.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.939 0.4 . . . . 0.0 111.105 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -84.22 -57.44 0.4 Allowed Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.944 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -78.55 -52.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.485 2.124 . . . . 0.0 112.443 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.1 p -53.73 -24.38 9.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.406 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.49 -33.44 44.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.188 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.1 ptt-85 -177.54 43.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.966 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.5 mmt-85 -155.88 -76.39 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.131 179.999 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.857 0.36 . . . . 0.0 111.193 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -59.63 162.65 8.44 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.099 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -69.35 148.93 68.83 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.554 2.169 . . . . 0.0 112.302 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.1 ptt85 -76.12 2.26 13.43 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.379 0.609 . . . . 0.0 112.329 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.26 -53.25 5.71 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.431 179.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.37 -31.05 26.95 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.021 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -65.26 -40.06 93.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.644 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 90.8 m -80.79 -35.02 33.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.84 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.72 -52.89 63.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 -179.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.6 pp -58.59 -33.06 69.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.921 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.1 mt -75.61 -45.85 35.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.82 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -67.29 -28.55 68.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.9 m -96.87 27.8 3.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.976 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -130.66 -46.24 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.814 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -76.97 -35.67 57.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.866 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 1.8 mp -94.43 12.62 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.362 179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.31 26.84 5.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.04 0.448 . . . . 0.0 110.957 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.527 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -61.93 -53.68 57.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.105 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.527 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 26.9 Cg_endo -63.39 -55.97 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.244 1.963 . . . . 0.0 112.195 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t -57.27 -30.84 36.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.089 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -130.82 97.9 4.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.806 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.65 166.58 1.79 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.72 143.74 25.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.938 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.096 -179.936 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.798 0.333 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.51 146.88 38.44 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.131 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.72 154.69 54.32 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.575 2.183 . . . . 0.0 112.313 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.47 1.7 15.8 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.423 0.63 . . . . 0.0 112.245 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -77.63 -46.63 9.56 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.915 -1.038 . . . . 0.0 111.469 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -86.69 -31.99 20.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.969 0.414 . . . . 0.0 109.992 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 10.1 t -67.25 -36.58 81.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.694 179.688 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.2 m -88.0 -30.75 19.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.009 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.6 mt -62.2 -36.75 82.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.095 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 pp -58.31 -30.56 66.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.961 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 41.2 mt -89.63 -42.43 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.74 -28.77 67.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.99 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 22.7 m -97.93 29.03 3.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.0 p -132.01 -46.26 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -82.31 -29.26 31.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.985 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.6 mm -77.46 -23.89 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.348 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.08 27.03 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.091 0.472 . . . . 0.0 111.105 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.468 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 18.9 mt -71.81 -56.99 4.36 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.189 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.468 ' HD3' ' HB2' ' A' ' 18' ' ' LEU . 37.7 Cg_endo -68.46 -54.32 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.343 2.029 . . . . 0.0 112.461 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.4 p -50.74 -30.4 8.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.265 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.73 -174.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.025 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 24.0 mtt85 -131.5 -45.93 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.888 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.5 tpp180 -173.86 -51.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.921 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.106 -179.977 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.0 ttt . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.825 0.345 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.63 149.64 38.64 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.093 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -73.54 150.74 46.32 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.99 4.25 20.22 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.56 0.695 . . . . 0.0 111.653 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.56 -50.96 4.5 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.075 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -79.0 -33.24 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 178.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.06 74.96 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.507 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.5 m -62.3 -53.59 52.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.712 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.5 tp -61.54 -30.75 70.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 24.1 tp -72.42 -35.34 68.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.831 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -30.44 20.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.861 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.8 tp -65.46 -32.3 73.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 m -82.42 -25.89 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.01 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -83.75 -47.95 10.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.148 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.42 -34.53 70.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.017 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 22.7 mm -91.06 11.94 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.405 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -100.06 28.57 4.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.083 0.468 . . . . 0.0 110.859 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.514 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.3 OUTLIER -66.83 -54.17 23.1 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.178 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.514 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 34.8 Cg_endo -66.23 -55.7 0.36 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.195 1.93 . . . . 0.0 112.528 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.8 t 66.07 15.85 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.314 -179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -152.92 -49.64 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.778 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -154.68 -72.27 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.839 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -158.98 142.79 15.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.908 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.119 179.985 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mpp? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.791 0.329 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.48 153.55 0.11 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.41 142.5 45.2 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.602 2.201 . . . . 0.0 112.263 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.3 ptt-85 -76.21 3.36 10.9 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.434 0.635 . . . . 0.0 112.456 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -77.83 -55.91 4.0 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.489 179.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.17 -32.65 33.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.403 . . . . 0.0 110.037 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.67 -45.12 84.07 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.544 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.97 -52.82 38.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.667 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mp -61.24 -31.34 71.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.72 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.2 tp -66.76 -31.18 71.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.821 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.35 -26.83 22.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.983 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 5.5 tp -66.52 -29.74 69.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.91 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 14.0 m -97.67 28.84 3.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.2 p -134.47 -46.3 0.75 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 34.4 mm-40 -82.29 -35.8 27.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.991 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 3.2 mp -91.72 12.83 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.53 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -98.58 26.52 5.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.034 0.445 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.511 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 5.9 mt -70.18 -53.92 10.12 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.309 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.511 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.9 Cg_endo -63.8 -54.81 0.81 Allowed 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.216 1.944 . . . . 0.0 112.403 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t -49.44 -28.14 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.443 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -115.66 -179.23 3.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.877 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -50.8 8.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.4 -176.35 3.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.097 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.837 0.351 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.98 92.87 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.092 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.65 145.67 70.6 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.458 2.106 . . . . 0.0 112.315 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.93 2.89 24.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.549 0.69 . . . . 0.0 111.699 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.96 -47.04 7.92 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.228 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -86.0 -32.12 21.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.749 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 17.6 t -64.2 -41.1 97.22 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.542 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.6 m -83.69 -32.06 25.76 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.945 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.75 -48.1 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.114 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 pp -56.77 -33.13 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.011 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 6.6 mp -62.7 -35.5 79.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.903 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.9 tp -71.24 -32.2 68.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 12.2 t -98.08 29.43 3.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.95 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -131.23 -46.29 1.0 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.787 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.24 -31.65 66.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.83 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 21.7 mt -105.5 11.83 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.449 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -102.9 26.5 8.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.065 0.459 . . . . 0.0 110.866 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.458 ' N ' ' CD ' ' A' ' 19' ' ' PRO . 1.8 mt -81.93 -47.64 0.98 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.273 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 18' ' ' LEU . 72.5 Cg_endo -80.2 -51.69 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.304 2.003 . . . . 0.0 112.465 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.6 t 68.12 29.09 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.166 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 63.2 -78.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.124 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 64.19 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.911 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -177.91 -177.99 0.66 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.861 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.094 -179.993 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 ttm . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.845 0.355 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.54 162.74 0.1 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.148 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -68.88 138.64 41.23 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.608 2.205 . . . . 0.0 112.323 179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -80.76 4.0 20.44 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.512 0.672 . . . . 0.0 111.755 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.02 -54.61 5.2 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.296 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -85.54 -31.37 22.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t -65.24 -39.47 92.76 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.471 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.2 t -78.58 -40.76 33.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.796 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.87 -40.57 73.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.091 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.6 pp -81.07 -28.83 35.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.58 -32.79 70.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.973 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.1 tp -68.21 -30.44 69.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.883 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.5 m -84.13 -26.96 28.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.059 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.1 p -73.83 -40.77 63.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.966 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.54 -35.25 75.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.09 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 10.9 tp -81.18 -39.16 17.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.021 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -94.66 27.98 2.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.204 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.463 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 36.3 tp -66.48 -57.66 11.92 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.139 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 25.9 Cg_endo -62.51 -55.37 0.93 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.402 2.068 . . . . 0.0 112.292 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 2.9 m -58.62 -18.88 13.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.547 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.26 -28.29 1.87 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.772 0.32 . . . . 0.0 111.296 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -51.47 -28.94 14.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.077 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -155.18 -70.33 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.909 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.068 179.943 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 mtp . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.766 0.317 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -165.39 158.53 13.66 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.098 179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 155.37 66.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.475 2.117 . . . . 0.0 112.35 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -75.94 2.36 12.76 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.464 0.65 . . . . 0.0 112.344 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.19 -57.46 3.99 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.548 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.73 -30.68 36.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.877 0.37 . . . . 0.0 110.058 179.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.9 t -64.4 -45.8 86.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.665 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 69.1 m -71.1 -43.96 66.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.9 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -49.65 76.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.983 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 4.2 pp -71.15 -26.7 63.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 5.9 mt -56.8 -30.37 63.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 4.0 mp -65.86 -31.37 72.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.934 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.4 m -66.28 -31.42 72.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.912 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -98.4 -31.08 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.907 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.06 -57.1 14.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.938 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 4.8 mt -62.74 -38.41 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.088 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.58 27.31 5.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.434 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 13.3 tp -71.21 -59.72 3.16 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.134 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.434 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.1 Cg_endo -63.25 -56.83 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.287 1.991 . . . . 0.0 112.357 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 16.0 t 62.35 31.11 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.056 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -137.65 31.59 2.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.872 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -108.77 -30.82 7.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.13 -24.37 9.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.148 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.13 -179.988 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.4 mmm . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.738 0.304 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -166.33 88.21 0.86 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.059 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.85 163.91 36.6 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.511 2.141 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -81.29 3.6 23.5 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.431 0.634 . . . . 0.0 111.647 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -72.49 -52.35 10.49 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.044 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -89.25 -31.29 17.95 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 4.4 t -62.79 -33.56 75.45 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.359 179.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -88.66 -40.5 13.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.796 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -56.24 -39.49 72.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.4 pp -57.67 -28.89 64.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.03 -179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.97 -28.7 64.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.013 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.35 -29.28 65.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.5 m -57.66 -30.34 65.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.6 m -98.57 -31.35 12.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 79.9 mm-40 -66.18 -34.7 78.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.905 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 23.4 mt -91.55 12.06 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.546 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -106.69 26.77 9.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.063 0.458 . . . . 0.0 110.916 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.425 ' CB ' ' CD ' ' A' ' 19' ' ' PRO . 0.4 OUTLIER -74.24 -62.68 0.98 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.033 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 18' ' ' LEU . 33.3 Cg_endo -66.03 -56.03 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.322 2.014 . . . . 0.0 112.409 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 13.4 t 59.76 31.21 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.043 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.38 80.3 0.21 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.856 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.68 -174.75 2.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -134.61 86.5 2.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.111 179.985 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptm . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.807 0.336 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -166.66 160.05 11.65 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.102 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -70.1 151.84 67.28 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.534 2.156 . . . . 0.0 112.354 179.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.09 4.74 21.92 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.499 0.666 . . . . 0.0 111.599 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.74 -51.9 6.82 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.024 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.92 -34.94 19.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -59.91 -42.16 93.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.396 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -80.73 -37.23 30.93 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.707 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 tp -53.64 -31.16 46.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.066 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 33.9 mt -54.89 -75.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -66.06 -29.17 69.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.036 -179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 2.5 tp -59.55 -30.95 68.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.9 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.8 m -98.14 28.02 4.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.891 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -135.96 -46.27 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.933 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -80.6 -27.06 37.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.958 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 21.4 mt -91.23 13.25 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.616 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.0 t0 -97.43 26.98 4.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 111.038 -179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.501 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 28.1 tp -66.63 -56.77 13.76 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.188 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.501 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 21.0 Cg_endo -61.42 -55.13 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.302 2.001 . . . . 0.0 112.256 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.3 m 43.18 77.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.616 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.19 103.66 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.936 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 35.3 ttp85 -148.11 -63.58 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.861 -179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.4 mtm105 59.58 104.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.935 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.113 -179.976 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.844 0.354 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.31 89.54 5.9 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.107 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.32 161.32 45.24 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.556 2.17 . . . . 0.0 112.312 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.97 2.52 26.51 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.552 0.691 . . . . 0.0 111.584 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.28 -44.86 10.65 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.092 178.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -86.65 -32.92 20.29 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 1.6 t -62.62 -39.82 95.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.588 179.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.4 m -85.58 -33.08 21.78 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.94 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.9 mt -60.27 -38.45 83.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.183 -179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 2.9 pp -58.23 -27.1 63.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.167 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.9 mt -75.37 -25.29 57.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.18 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.05 -42.23 80.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.125 -179.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 13.2 t -55.83 -28.42 56.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 t -82.56 -45.78 14.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.962 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.51 -50.91 69.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.024 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 38.1 mm -58.47 -21.76 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.239 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.16 26.54 5.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 111.125 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.481 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 42.6 tp -71.11 -57.56 4.68 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.253 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 24.3 Cg_endo -62.16 -53.78 1.8 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.32 2.014 . . . . 0.0 112.334 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.5 t -92.5 33.08 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.39 -179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -57.46 -38.18 74.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.892 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 mtm-85 -135.62 -56.46 0.79 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.864 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -152.35 147.3 26.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.956 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.049 179.903 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.0 mmt . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.85 0.357 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -128.6 149.38 71.72 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.085 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.68 153.6 59.53 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.619 2.213 . . . . 0.0 112.258 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -81.14 2.47 27.37 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.609 0.719 . . . . 0.0 111.68 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -79.53 -46.94 7.65 Favored Glycine 0 N--CA 1.445 -0.763 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.227 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -84.38 -34.21 23.64 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 34.8 t -61.42 -46.87 88.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.491 179.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.4 m -76.47 -35.4 58.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.8 mt -60.14 -56.41 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.952 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.8 pp -58.97 -32.03 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.002 -179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.52 -47.66 85.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.6 mp -85.67 -31.97 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.957 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -66.06 -27.87 68.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.026 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 p -97.55 -30.63 12.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.039 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -74.4 -30.32 61.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.1 mt -96.51 -31.72 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.226 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -99.44 27.86 4.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.103 0.478 . . . . 0.0 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.464 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 23.8 tp -66.24 -58.85 9.65 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.102 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.464 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.5 Cg_endo -63.22 -55.56 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.301 2.001 . . . . 0.0 112.424 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 15.9 t 67.67 15.48 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.364 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.1 pttm 176.2 156.66 0.24 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.825 0.345 . . . . 0.0 110.77 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -152.55 -64.14 0.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.863 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -164.12 -71.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.173 179.942 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.796 0.331 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.67 88.24 9.74 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.051 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.64 153.62 69.27 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.514 2.142 . . . . 0.0 112.39 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.39 2.29 13.98 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.469 0.652 . . . . 0.0 112.436 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.42 -48.51 7.34 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.533 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.2 t80 -85.36 -31.5 22.93 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.1 t -66.93 -41.2 87.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.735 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.6 m -80.98 -34.76 32.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.39 -52.97 63.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.061 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 3.8 pp -59.31 -30.66 68.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.979 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 28.6 mt -74.71 -30.93 61.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.06 -52.36 65.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.949 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.9 t -58.32 -29.24 65.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.979 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.6 t -82.98 -43.6 16.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.938 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -65.0 -39.8 93.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 9.0 mt -71.02 -19.67 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.392 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.8 26.83 4.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.075 0.464 . . . . 0.0 111.075 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.432 ' N ' ' CD ' ' A' ' 19' ' ' PRO . 8.9 tp -82.92 -50.01 0.74 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.345 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' PRO . . . . . 0.432 ' CD ' ' N ' ' A' ' 18' ' ' LEU . 73.7 Cg_endo -79.79 -50.15 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.434 2.089 . . . . 0.0 112.509 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.1 t -93.68 32.56 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.379 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.65 -33.76 75.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.899 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.0 mmm180 -94.39 46.05 1.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.86 160.29 6.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.951 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.152 -179.991 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 120.712 0.292 . . . . 0.0 111.126 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.77 162.74 40.9 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 112.314 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -81.05 5.05 17.69 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.501 0.667 . . . . 0.0 111.674 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.706 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -79.62 -51.51 5.15 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.074 178.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.83 -33.01 24.98 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.902 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.629 ' O ' HD23 ' A' ' 11' ' ' LEU . 0.3 OUTLIER -66.49 -42.6 87.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.515 179.421 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -70.04 -52.6 22.68 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.706 HD13 ' O ' ' A' ' 5' ' ' GLY . 6.5 mp -60.34 -26.18 66.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.79 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.02 -66.92 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.629 HD23 ' O ' ' A' ' 7' ' ' SER . 0.8 OUTLIER -67.47 -27.62 67.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.003 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.446 ' O ' HD12 ' A' ' 16' ' ' ILE . 5.3 tp -59.78 -30.02 68.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.637 ' O ' HG22 ' A' ' 13' ' ' THR . 27.5 m -97.78 27.4 4.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.1 t -130.5 -46.43 1.08 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.948 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -76.02 -31.67 59.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.446 HD12 ' O ' ' A' ' 12' ' ' LEU . 29.3 mt -75.6 -28.2 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.239 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.41 27.37 4.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.069 0.462 . . . . 0.0 110.983 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.431 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 16.3 tp -72.06 -60.37 2.35 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.5 Cg_endo -63.9 -56.73 0.44 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.295 1.997 . . . . 0.0 112.372 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 20' ' ' VAL . 13.1 t . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.046 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 120.787 0.327 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.03 156.13 66.2 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.551 2.167 . . . . 0.0 112.296 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -82.27 3.78 26.21 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.549 0.69 . . . . 0.0 111.612 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.92 -45.46 16.4 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.156 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -92.1 -32.2 15.24 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.672 ' HA ' HD23 ' A' ' 10' ' ' LEU . 9.0 t -64.98 -33.84 77.01 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.435 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.405 ' HB3' ' O ' ' A' ' 4' ' ' ARG . 50.9 t -91.48 -39.7 11.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.947 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.535 ' HA ' HD13 ' A' ' 12' ' ' LEU . 8.7 tp -62.96 -32.26 73.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.159 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.672 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.7 pp -58.63 -30.57 67.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.899 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.429 ' N ' HD12 ' A' ' 10' ' ' LEU . 3.8 tp -72.05 -30.49 65.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.852 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.627 HD23 HD11 ' A' ' 16' ' ' ILE . 6.3 mp -68.37 -28.82 67.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.957 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.7 m -55.76 -28.98 58.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' SER . . . . . 0.548 ' O ' HD23 ' A' ' 18' ' ' LEU . 10.4 t -99.43 -39.67 8.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.0 -45.0 95.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.982 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.627 HD11 HD23 ' A' ' 12' ' ' LEU . 39.8 mt -75.59 -24.55 17.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.319 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.09 26.38 5.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.939 0.4 . . . . 0.0 111.105 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 14' ' ' SER . 0.2 OUTLIER -84.22 -57.44 0.4 Allowed Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.944 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -78.55 -52.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.485 2.124 . . . . 0.0 112.443 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.406 -179.84 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' ALA . . . . . 0.615 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.666 0.269 . . . . 0.0 111.099 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.615 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 52.4 Cg_endo -69.35 148.93 68.83 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.554 2.169 . . . . 0.0 112.302 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.1 ptt85 -76.12 2.26 13.43 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.379 0.609 . . . . 0.0 112.329 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.628 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -76.26 -53.25 5.71 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.431 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.406 ' O ' HD23 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -83.37 -31.05 26.95 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.021 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -65.26 -40.06 93.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.644 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 90.8 m -80.79 -35.02 33.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.84 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.628 HD13 ' O ' ' A' ' 5' ' ' GLY . 0.7 OUTLIER -58.72 -52.89 63.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 -179.875 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 6' ' ' PHE . 3.6 pp -58.59 -33.06 69.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.921 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.1 mt -75.61 -45.85 35.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.82 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.712 ' O ' HD12 ' A' ' 16' ' ' ILE . 0.5 OUTLIER -67.29 -28.55 68.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.459 ' O ' HG22 ' A' ' 13' ' ' THR . 5.9 m -96.87 27.8 3.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.976 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -130.66 -46.24 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.814 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -76.97 -35.67 57.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.866 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.712 HD12 ' O ' ' A' ' 12' ' ' LEU . 1.8 mp -94.43 12.62 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.362 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.31 26.84 5.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.04 0.448 . . . . 0.0 110.957 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.548 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -61.93 -53.68 57.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.105 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 26.9 Cg_endo -63.39 -55.97 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.244 1.963 . . . . 0.0 112.195 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.089 -179.983 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.736 0.303 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.72 154.69 54.32 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.575 2.183 . . . . 0.0 112.313 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.47 1.7 15.8 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.423 0.63 . . . . 0.0 112.245 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -77.63 -46.63 9.56 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.915 -1.038 . . . . 0.0 111.469 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -86.69 -31.99 20.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.969 0.414 . . . . 0.0 109.992 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.469 ' HA ' HD23 ' A' ' 10' ' ' LEU . 10.1 t -67.25 -36.58 81.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.694 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.2 m -88.0 -30.75 19.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.009 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.6 mt -62.2 -36.75 82.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.095 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.469 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.4 pp -58.31 -30.56 66.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.961 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 11' ' ' LEU . 41.2 mt -89.63 -42.43 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.74 -28.77 67.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.99 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.608 ' O ' HG22 ' A' ' 13' ' ' THR . 22.7 m -97.93 29.03 3.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.0 p -132.01 -46.26 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -82.31 -29.26 31.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.985 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.6 mm -77.46 -23.89 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.348 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.475 ' HA ' HG12 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -98.08 27.03 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.091 0.472 . . . . 0.0 111.105 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 18.9 mt -71.81 -56.99 4.36 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.189 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.511 ' HD3' ' HB2' ' A' ' 18' ' ' LEU . 37.7 Cg_endo -68.46 -54.32 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.343 2.029 . . . . 0.0 112.461 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.475 HG12 ' HA ' ' A' ' 17' ' ' ASP . 11.4 p . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.265 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.092 0 CA-C-O 120.733 0.301 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -73.54 150.74 46.32 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.99 4.25 20.22 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.56 0.695 . . . . 0.0 111.653 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.56 -50.96 4.5 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.075 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -79.0 -33.24 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 178.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.06 74.96 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.507 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.5 m -62.3 -53.59 52.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.712 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.5 tp -61.54 -30.75 70.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 24.1 tp -72.42 -35.34 68.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.831 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -30.44 20.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.861 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.8 tp -65.46 -32.3 73.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 m -82.42 -25.89 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.01 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -83.75 -47.95 10.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.148 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.42 -34.53 70.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.017 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.622 ' O ' HG22 ' A' ' 16' ' ' ILE . 22.7 mm -91.06 11.94 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.405 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -100.06 28.57 4.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.083 0.468 . . . . 0.0 110.859 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.53 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.3 OUTLIER -66.83 -54.17 23.1 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.178 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 34.8 Cg_endo -66.23 -55.7 0.36 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.195 1.93 . . . . 0.0 112.528 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 20' ' ' VAL . 15.8 t . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.314 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.733 0.301 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.41 142.5 45.2 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.602 2.201 . . . . 0.0 112.263 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.3 ptt-85 -76.21 3.36 10.9 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.434 0.635 . . . . 0.0 112.456 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.52 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -77.83 -55.91 4.0 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.489 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.17 -32.65 33.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.403 . . . . 0.0 110.037 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.67 -45.12 84.07 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.544 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.97 -52.82 38.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.667 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 5' ' ' GLY . 3.3 mp -61.24 -31.34 71.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.72 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.2 tp -66.76 -31.18 71.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.821 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.35 -26.83 22.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.983 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.41 HD12 HD13 ' A' ' 16' ' ' ILE . 5.5 tp -66.52 -29.74 69.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.91 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.546 ' O ' HG22 ' A' ' 13' ' ' THR . 14.0 m -97.67 28.84 3.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.2 p -134.47 -46.3 0.75 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.414 ' O ' HD21 ' A' ' 18' ' ' LEU . 34.4 mm-40 -82.29 -35.8 27.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.991 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.613 ' O ' HG22 ' A' ' 16' ' ' ILE . 3.2 mp -91.72 12.83 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.53 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -98.58 26.52 5.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.034 0.445 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.526 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 5.9 mt -70.18 -53.92 10.12 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.309 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.9 Cg_endo -63.8 -54.81 0.81 Allowed 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.216 1.944 . . . . 0.0 112.403 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.443 179.97 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.671 0.272 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.65 145.67 70.6 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.458 2.106 . . . . 0.0 112.315 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.93 2.89 24.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.549 0.69 . . . . 0.0 111.699 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.96 -47.04 7.92 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.228 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.407 ' O ' HD23 ' A' ' 10' ' ' LEU . 17.7 t80 -86.0 -32.12 21.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.595 ' O ' HD13 ' A' ' 11' ' ' LEU . 17.6 t -64.2 -41.1 97.22 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.542 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.6 m -83.69 -32.06 25.76 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.945 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.75 -48.1 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.114 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.697 ' CD1' HD12 ' A' ' 11' ' ' LEU . 3.4 pp -56.77 -33.13 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.011 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.697 HD12 ' CD1' ' A' ' 10' ' ' LEU . 6.6 mp -62.7 -35.5 79.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.903 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.9 tp -71.24 -32.2 68.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 10' ' ' LEU . 12.2 t -98.08 29.43 3.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.95 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -131.23 -46.29 1.0 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.787 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.24 -31.65 66.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.83 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.592 ' O ' HG22 ' A' ' 16' ' ' ILE . 21.7 mt -105.5 11.83 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.449 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -102.9 26.5 8.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.065 0.459 . . . . 0.0 110.866 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.458 ' N ' ' CD ' ' A' ' 19' ' ' PRO . 1.8 mt -81.93 -47.64 0.98 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.273 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 18' ' ' LEU . 72.5 Cg_endo -80.2 -51.69 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.304 2.003 . . . . 0.0 112.465 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.576 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.6 t . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.166 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' ALA . . . . . 0.616 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.717 0.294 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.616 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 49.8 Cg_endo -68.88 138.64 41.23 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.608 2.205 . . . . 0.0 112.323 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -80.76 4.0 20.44 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.512 0.672 . . . . 0.0 111.755 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.02 -54.61 5.2 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.296 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -85.54 -31.37 22.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t -65.24 -39.47 92.76 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.471 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.2 t -78.58 -40.76 33.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.796 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.87 -40.57 73.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.091 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.461 HD12 ' N ' ' A' ' 11' ' ' LEU . 4.6 pp -81.07 -28.83 35.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.461 ' N ' HD12 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -59.58 -32.79 70.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.973 179.985 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.1 tp -68.21 -30.44 69.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.883 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.492 ' HA ' HG22 ' A' ' 16' ' ' ILE . 63.5 m -84.13 -26.96 28.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.059 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.1 p -73.83 -40.77 63.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.966 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.54 -35.25 75.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.09 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.492 HG22 ' HA ' ' A' ' 13' ' ' THR . 10.9 tp -81.18 -39.16 17.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.021 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.516 ' OD2' HG23 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -94.66 27.98 2.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.204 -179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.48 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 36.3 tp -66.48 -57.66 11.92 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.139 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 25.9 Cg_endo -62.51 -55.37 0.93 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.402 2.068 . . . . 0.0 112.292 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.516 HG23 ' OD2' ' A' ' 17' ' ' ASP . 2.9 m . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.547 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.687 0.28 . . . . 0.0 111.098 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 54.4 Cg_endo -69.69 155.37 66.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.475 2.117 . . . . 0.0 112.35 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -75.94 2.36 12.76 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.464 0.65 . . . . 0.0 112.344 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.19 -57.46 3.99 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.548 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.73 -30.68 36.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.877 0.37 . . . . 0.0 110.058 179.009 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.9 t -64.4 -45.8 86.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.665 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . 0.701 ' O ' HD12 ' A' ' 12' ' ' LEU . 69.1 m -71.1 -43.96 66.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.9 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -49.65 76.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.983 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.536 HD12 ' C ' ' A' ' 10' ' ' LEU . 4.2 pp -71.15 -26.7 63.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.444 ' N ' HD12 ' A' ' 10' ' ' LEU . 5.9 mt -56.8 -30.37 63.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.754 ' O ' HD12 ' A' ' 16' ' ' ILE . 4.0 mp -65.86 -31.37 72.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.934 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.4 m -66.28 -31.42 72.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.912 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -98.4 -31.08 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.907 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.06 -57.1 14.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.938 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.754 HD12 ' O ' ' A' ' 12' ' ' LEU . 4.8 mt -62.74 -38.41 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.088 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.58 27.31 5.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.446 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 13.3 tp -71.21 -59.72 3.16 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.134 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.1 Cg_endo -63.25 -56.83 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.287 1.991 . . . . 0.0 112.357 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.581 ' O ' HG12 ' A' ' 20' ' ' VAL . 16.0 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.056 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.083 0 CA-C-O 120.701 0.286 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.85 163.91 36.6 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.511 2.141 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -81.29 3.6 23.5 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.431 0.634 . . . . 0.0 111.647 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.537 ' O ' HD23 ' A' ' 9' ' ' LEU . . . -72.49 -52.35 10.49 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.044 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -89.25 -31.29 17.95 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.573 ' HA ' HD23 ' A' ' 10' ' ' LEU . 4.4 t -62.79 -33.56 75.45 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.359 179.256 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -88.66 -40.5 13.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.796 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.537 HD23 ' O ' ' A' ' 5' ' ' GLY . 1.4 mm? -56.24 -39.49 72.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.573 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.4 pp -57.67 -28.89 64.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.03 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.413 HD12 ' HG2' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -57.97 -28.7 64.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.013 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.35 -29.28 65.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.5 m -57.66 -30.34 65.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.6 m -98.57 -31.35 12.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . 0.413 ' HG2' HD12 ' A' ' 11' ' ' LEU . 79.9 mm-40 -66.18 -34.7 78.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.905 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 16' ' ' ILE . 23.4 mt -91.55 12.06 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.546 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -106.69 26.77 9.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.063 0.458 . . . . 0.0 110.916 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.425 ' CB ' ' CD ' ' A' ' 19' ' ' PRO . 0.4 OUTLIER -74.24 -62.68 0.98 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.033 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 18' ' ' LEU . 33.3 Cg_endo -66.03 -56.03 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.322 2.014 . . . . 0.0 112.409 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 20' ' ' VAL . 13.4 t . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.043 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' ALA . . . . . 0.527 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.739 0.304 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.527 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 55.8 Cg_endo -70.1 151.84 67.28 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.534 2.156 . . . . 0.0 112.354 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.09 4.74 21.92 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.499 0.666 . . . . 0.0 111.599 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.74 -51.9 6.82 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.024 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.92 -34.94 19.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -59.91 -42.16 93.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.396 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -80.73 -37.23 30.93 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.707 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 tp -53.64 -31.16 46.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.066 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 33.9 mt -54.89 -75.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 11' ' ' LEU . 4.4 mm? -66.06 -29.17 69.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.036 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.525 ' HG ' HD12 ' A' ' 16' ' ' ILE . 2.5 tp -59.55 -30.95 68.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.9 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.464 ' O ' HG22 ' A' ' 13' ' ' THR . 5.8 m -98.14 28.02 4.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.891 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -135.96 -46.27 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.933 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -80.6 -27.06 37.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.958 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.607 ' O ' HG22 ' A' ' 16' ' ' ILE . 21.4 mt -91.23 13.25 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.616 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.687 ' O ' HG13 ' A' ' 20' ' ' VAL . 3.0 t0 -97.43 26.98 4.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 111.038 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.513 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 28.1 tp -66.63 -56.77 13.76 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.188 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 21.0 Cg_endo -61.42 -55.13 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.302 2.001 . . . . 0.0 112.256 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.687 HG13 ' O ' ' A' ' 17' ' ' ASP . 6.3 m . . . . . 0 N--CA 1.462 0.164 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.616 -179.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.687 0.28 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.32 161.32 45.24 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.556 2.17 . . . . 0.0 112.312 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.97 2.52 26.51 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.552 0.691 . . . . 0.0 111.584 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.487 ' O ' HD12 ' A' ' 9' ' ' LEU . . . -78.28 -44.86 10.65 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.092 178.73 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -86.65 -32.92 20.29 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . 0.483 ' HA ' HD23 ' A' ' 10' ' ' LEU . 1.6 t -62.62 -39.82 95.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.588 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.4 m -85.58 -33.08 21.78 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.94 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.487 HD12 ' O ' ' A' ' 5' ' ' GLY . 8.9 mt -60.27 -38.45 83.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.183 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.85 ' O ' HG22 ' A' ' 13' ' ' THR . 2.9 pp -58.23 -27.1 63.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.167 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.9 mt -75.37 -25.29 57.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.18 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.721 HD23 HG12 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -57.05 -42.23 80.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.125 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.85 HG22 ' O ' ' A' ' 10' ' ' LEU . 13.2 t -55.83 -28.42 56.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 t -82.56 -45.78 14.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.962 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.51 -50.91 69.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.024 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.721 HG12 HD23 ' A' ' 12' ' ' LEU . 38.1 mm -58.47 -21.76 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.239 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.16 26.54 5.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 111.125 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.495 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 42.6 tp -71.11 -57.56 4.68 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.253 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 24.3 Cg_endo -62.16 -53.78 1.8 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.32 2.014 . . . . 0.0 112.334 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.569 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.5 t . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.39 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.744 0.307 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.68 153.6 59.53 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.619 2.213 . . . . 0.0 112.258 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -81.14 2.47 27.37 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.609 0.719 . . . . 0.0 111.68 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 9' ' ' LEU . . . -79.53 -46.94 7.65 Favored Glycine 0 N--CA 1.445 -0.763 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.227 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -84.38 -34.21 23.64 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 34.8 t -61.42 -46.87 88.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.491 179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.4 m -76.47 -35.4 58.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 5' ' ' GLY . 11.8 mt -60.14 -56.41 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.952 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.422 HD12 ' C ' ' A' ' 10' ' ' LEU . 3.8 pp -58.97 -32.03 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.002 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.52 -47.66 85.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.6 mp -85.67 -31.97 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.957 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -66.06 -27.87 68.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.026 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 p -97.55 -30.63 12.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.039 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -74.4 -30.32 61.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.1 mt -96.51 -31.72 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.226 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -99.44 27.86 4.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.103 0.478 . . . . 0.0 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.473 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 23.8 tp -66.24 -58.85 9.65 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.102 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.473 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.5 Cg_endo -63.22 -55.56 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.301 2.001 . . . . 0.0 112.424 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.594 ' O ' HG12 ' A' ' 20' ' ' VAL . 15.9 t . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.364 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.693 0.282 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.64 153.62 69.27 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.514 2.142 . . . . 0.0 112.39 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.39 2.29 13.98 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.469 0.652 . . . . 0.0 112.436 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.42 -48.51 7.34 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.533 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PHE . . . . . 0.439 ' O ' HD23 ' A' ' 10' ' ' LEU . 12.2 t80 -85.36 -31.5 22.93 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.11 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.1 t -66.93 -41.2 87.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.735 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.6 m -80.98 -34.76 32.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.39 -52.97 63.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.061 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.439 HD23 ' O ' ' A' ' 6' ' ' PHE . 3.8 pp -59.31 -30.66 68.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.979 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 11' ' ' LEU . 28.6 mt -74.71 -30.93 61.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LEU . . . . . 0.443 ' O ' HD12 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -60.06 -52.36 65.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.949 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.9 t -58.32 -29.24 65.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.979 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.6 t -82.98 -43.6 16.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.938 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -65.0 -39.8 93.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.443 HD12 ' O ' ' A' ' 12' ' ' LEU . 9.0 mt -71.02 -19.67 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.392 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.8 26.83 4.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.075 0.464 . . . . 0.0 111.075 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.445 ' HB3' ' HD3' ' A' ' 19' ' ' PRO . 8.9 tp -82.92 -50.01 0.74 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.345 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' PRO . . . . . 0.445 ' HD3' ' HB3' ' A' ' 18' ' ' LEU . 73.7 Cg_endo -79.79 -50.15 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.434 2.089 . . . . 0.0 112.509 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.1 t . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.379 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptp . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.77 0.319 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.12 88.34 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.126 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.77 162.74 40.9 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 112.314 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -81.05 5.05 17.69 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.501 0.667 . . . . 0.0 111.674 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.706 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -79.62 -51.51 5.15 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.074 178.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.83 -33.01 24.98 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.629 ' O ' HD23 ' A' ' 11' ' ' LEU . 0.3 OUTLIER -66.49 -42.6 87.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.515 179.421 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -70.04 -52.6 22.68 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.706 HD13 ' O ' ' A' ' 5' ' ' GLY . 6.5 mp -60.34 -26.18 66.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.79 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.02 -66.92 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.629 HD23 ' O ' ' A' ' 7' ' ' SER . 0.8 OUTLIER -67.47 -27.62 67.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.003 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.446 ' O ' HD12 ' A' ' 16' ' ' ILE . 5.3 tp -59.78 -30.02 68.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.637 ' O ' HG22 ' A' ' 13' ' ' THR . 27.5 m -97.78 27.4 4.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.1 t -130.5 -46.43 1.08 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.948 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -76.02 -31.67 59.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.446 HD12 ' O ' ' A' ' 12' ' ' LEU . 29.3 mt -75.6 -28.2 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.239 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.41 27.37 4.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.069 0.462 . . . . 0.0 110.983 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.431 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 16.3 tp -72.06 -60.37 2.35 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.5 Cg_endo -63.9 -56.73 0.44 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.295 1.997 . . . . 0.0 112.372 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 20' ' ' VAL . 13.1 t 60.67 30.64 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.046 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -178.02 -39.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.897 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.06 147.26 35.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.71 -69.19 0.58 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.145 179.976 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.838 0.352 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.44 53.69 3.47 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.113 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.03 156.13 66.2 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.551 2.167 . . . . 0.0 112.296 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -82.27 3.78 26.21 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.549 0.69 . . . . 0.0 111.612 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.92 -45.46 16.4 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.156 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -92.1 -32.2 15.24 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.672 ' HA ' HD23 ' A' ' 10' ' ' LEU . 9.0 t -64.98 -33.84 77.01 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.435 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.405 ' HB3' ' O ' ' A' ' 4' ' ' ARG . 50.9 t -91.48 -39.7 11.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.947 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.535 ' HA ' HD13 ' A' ' 12' ' ' LEU . 8.7 tp -62.96 -32.26 73.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.159 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.672 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.7 pp -58.63 -30.57 67.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.899 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.429 ' N ' HD12 ' A' ' 10' ' ' LEU . 3.8 tp -72.05 -30.49 65.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.852 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.627 HD23 HD11 ' A' ' 16' ' ' ILE . 6.3 mp -68.37 -28.82 67.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.957 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.7 m -55.76 -28.98 58.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' SER . . . . . 0.548 ' O ' HD23 ' A' ' 18' ' ' LEU . 10.4 t -99.43 -39.67 8.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.0 -45.0 95.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.982 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.627 HD11 HD23 ' A' ' 12' ' ' LEU . 39.8 mt -75.59 -24.55 17.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.319 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.09 26.38 5.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.939 0.4 . . . . 0.0 111.105 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 14' ' ' SER . 0.2 OUTLIER -84.22 -57.44 0.4 Allowed Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.944 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -78.55 -52.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.485 2.124 . . . . 0.0 112.443 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.1 p -53.73 -24.38 9.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.406 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.49 -33.44 44.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.188 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.1 ptt-85 -177.54 43.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.966 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.5 mmt-85 -155.88 -76.39 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.131 179.999 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.857 0.36 . . . . 0.0 111.193 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.615 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . -59.63 162.65 8.44 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.099 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.615 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 52.4 Cg_endo -69.35 148.93 68.83 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.554 2.169 . . . . 0.0 112.302 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.1 ptt85 -76.12 2.26 13.43 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.379 0.609 . . . . 0.0 112.329 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.628 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -76.26 -53.25 5.71 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.431 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.406 ' O ' HD23 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -83.37 -31.05 26.95 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.021 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -65.26 -40.06 93.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.644 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 90.8 m -80.79 -35.02 33.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.84 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.628 HD13 ' O ' ' A' ' 5' ' ' GLY . 0.7 OUTLIER -58.72 -52.89 63.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 -179.875 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 6' ' ' PHE . 3.6 pp -58.59 -33.06 69.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.921 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.1 mt -75.61 -45.85 35.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.82 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.712 ' O ' HD12 ' A' ' 16' ' ' ILE . 0.5 OUTLIER -67.29 -28.55 68.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.459 ' O ' HG22 ' A' ' 13' ' ' THR . 5.9 m -96.87 27.8 3.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.976 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -130.66 -46.24 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.814 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -76.97 -35.67 57.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.866 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.712 HD12 ' O ' ' A' ' 12' ' ' LEU . 1.8 mp -94.43 12.62 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.362 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.31 26.84 5.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.04 0.448 . . . . 0.0 110.957 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.548 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -61.93 -53.68 57.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.105 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 26.9 Cg_endo -63.39 -55.97 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.244 1.963 . . . . 0.0 112.195 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t -57.27 -30.84 36.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.089 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -130.82 97.9 4.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.806 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.65 166.58 1.79 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.72 143.74 25.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.938 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.096 -179.936 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.798 0.333 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.51 146.88 38.44 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.131 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.72 154.69 54.32 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.575 2.183 . . . . 0.0 112.313 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.47 1.7 15.8 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.423 0.63 . . . . 0.0 112.245 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -77.63 -46.63 9.56 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.915 -1.038 . . . . 0.0 111.469 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -86.69 -31.99 20.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.969 0.414 . . . . 0.0 109.992 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.469 ' HA ' HD23 ' A' ' 10' ' ' LEU . 10.1 t -67.25 -36.58 81.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.694 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.2 m -88.0 -30.75 19.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.009 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.6 mt -62.2 -36.75 82.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.095 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.469 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.4 pp -58.31 -30.56 66.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.961 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 11' ' ' LEU . 41.2 mt -89.63 -42.43 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.74 -28.77 67.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.99 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.608 ' O ' HG22 ' A' ' 13' ' ' THR . 22.7 m -97.93 29.03 3.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.0 p -132.01 -46.26 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -82.31 -29.26 31.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.985 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.6 mm -77.46 -23.89 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.348 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.475 ' HA ' HG12 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -98.08 27.03 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.091 0.472 . . . . 0.0 111.105 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 18.9 mt -71.81 -56.99 4.36 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.189 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.511 ' HD3' ' HB2' ' A' ' 18' ' ' LEU . 37.7 Cg_endo -68.46 -54.32 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.343 2.029 . . . . 0.0 112.461 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.475 HG12 ' HA ' ' A' ' 17' ' ' ASP . 11.4 p -50.74 -30.4 8.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.265 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.73 -174.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.025 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 24.0 mtt85 -131.5 -45.93 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.888 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.5 tpp180 -173.86 -51.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.921 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.106 -179.977 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.0 ttt . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.825 0.345 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.63 149.64 38.64 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.093 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -73.54 150.74 46.32 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.99 4.25 20.22 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.56 0.695 . . . . 0.0 111.653 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.56 -50.96 4.5 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.075 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -79.0 -33.24 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 178.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.06 74.96 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.507 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.5 m -62.3 -53.59 52.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.712 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.5 tp -61.54 -30.75 70.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 24.1 tp -72.42 -35.34 68.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.831 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -30.44 20.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.861 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.8 tp -65.46 -32.3 73.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 m -82.42 -25.89 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.01 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -83.75 -47.95 10.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.148 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.42 -34.53 70.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.017 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.622 ' O ' HG22 ' A' ' 16' ' ' ILE . 22.7 mm -91.06 11.94 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.405 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -100.06 28.57 4.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.083 0.468 . . . . 0.0 110.859 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.53 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.3 OUTLIER -66.83 -54.17 23.1 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.178 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 34.8 Cg_endo -66.23 -55.7 0.36 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.195 1.93 . . . . 0.0 112.528 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 20' ' ' VAL . 15.8 t 66.07 15.85 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.314 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -152.92 -49.64 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.778 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -154.68 -72.27 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.839 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -158.98 142.79 15.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.908 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.119 179.985 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mpp? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.791 0.329 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.48 153.55 0.11 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.41 142.5 45.2 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.602 2.201 . . . . 0.0 112.263 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.3 ptt-85 -76.21 3.36 10.9 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.434 0.635 . . . . 0.0 112.456 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.52 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -77.83 -55.91 4.0 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.489 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.17 -32.65 33.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.403 . . . . 0.0 110.037 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.67 -45.12 84.07 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.544 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.97 -52.82 38.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.667 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 5' ' ' GLY . 3.3 mp -61.24 -31.34 71.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.72 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.2 tp -66.76 -31.18 71.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.821 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.35 -26.83 22.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.983 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.41 HD12 HD13 ' A' ' 16' ' ' ILE . 5.5 tp -66.52 -29.74 69.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.91 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.546 ' O ' HG22 ' A' ' 13' ' ' THR . 14.0 m -97.67 28.84 3.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.2 p -134.47 -46.3 0.75 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.414 ' O ' HD21 ' A' ' 18' ' ' LEU . 34.4 mm-40 -82.29 -35.8 27.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.991 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.613 ' O ' HG22 ' A' ' 16' ' ' ILE . 3.2 mp -91.72 12.83 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.53 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -98.58 26.52 5.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.034 0.445 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.526 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 5.9 mt -70.18 -53.92 10.12 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.309 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.9 Cg_endo -63.8 -54.81 0.81 Allowed 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.216 1.944 . . . . 0.0 112.403 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t -49.44 -28.14 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.443 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -115.66 -179.23 3.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.877 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -50.8 8.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.4 -176.35 3.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.097 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.837 0.351 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.98 92.87 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.092 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.65 145.67 70.6 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.458 2.106 . . . . 0.0 112.315 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.93 2.89 24.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.549 0.69 . . . . 0.0 111.699 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.96 -47.04 7.92 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.228 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.407 ' O ' HD23 ' A' ' 10' ' ' LEU . 17.7 t80 -86.0 -32.12 21.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.749 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.595 ' O ' HD13 ' A' ' 11' ' ' LEU . 17.6 t -64.2 -41.1 97.22 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.542 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.6 m -83.69 -32.06 25.76 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.945 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.75 -48.1 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.114 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.697 ' CD1' HD12 ' A' ' 11' ' ' LEU . 3.4 pp -56.77 -33.13 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.011 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.697 HD12 ' CD1' ' A' ' 10' ' ' LEU . 6.6 mp -62.7 -35.5 79.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.903 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.9 tp -71.24 -32.2 68.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 10' ' ' LEU . 12.2 t -98.08 29.43 3.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.95 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -131.23 -46.29 1.0 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.787 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.24 -31.65 66.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.83 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.592 ' O ' HG22 ' A' ' 16' ' ' ILE . 21.7 mt -105.5 11.83 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.449 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -102.9 26.5 8.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.065 0.459 . . . . 0.0 110.866 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.458 ' N ' ' CD ' ' A' ' 19' ' ' PRO . 1.8 mt -81.93 -47.64 0.98 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.273 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 18' ' ' LEU . 72.5 Cg_endo -80.2 -51.69 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.304 2.003 . . . . 0.0 112.465 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.576 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.6 t 68.12 29.09 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.166 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 63.2 -78.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.124 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 64.19 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.911 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -177.91 -177.99 0.66 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.861 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.094 -179.993 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 ttm . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.845 0.355 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.616 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . 60.54 162.74 0.1 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.148 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.616 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 49.8 Cg_endo -68.88 138.64 41.23 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.608 2.205 . . . . 0.0 112.323 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -80.76 4.0 20.44 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.512 0.672 . . . . 0.0 111.755 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.02 -54.61 5.2 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.296 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -85.54 -31.37 22.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t -65.24 -39.47 92.76 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.471 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.2 t -78.58 -40.76 33.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.796 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.87 -40.57 73.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.091 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.461 HD12 ' N ' ' A' ' 11' ' ' LEU . 4.6 pp -81.07 -28.83 35.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.461 ' N ' HD12 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -59.58 -32.79 70.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.973 179.985 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.1 tp -68.21 -30.44 69.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.883 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.492 ' HA ' HG22 ' A' ' 16' ' ' ILE . 63.5 m -84.13 -26.96 28.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.059 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.1 p -73.83 -40.77 63.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.966 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.54 -35.25 75.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.09 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.492 HG22 ' HA ' ' A' ' 13' ' ' THR . 10.9 tp -81.18 -39.16 17.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.021 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.516 ' OD2' HG23 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -94.66 27.98 2.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.204 -179.845 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.48 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 36.3 tp -66.48 -57.66 11.92 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.139 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 25.9 Cg_endo -62.51 -55.37 0.93 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.402 2.068 . . . . 0.0 112.292 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.516 HG23 ' OD2' ' A' ' 17' ' ' ASP . 2.9 m -58.62 -18.88 13.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.547 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.26 -28.29 1.87 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.772 0.32 . . . . 0.0 111.296 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -51.47 -28.94 14.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.077 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -155.18 -70.33 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.909 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.068 179.943 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 mtp . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.766 0.317 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . -165.39 158.53 13.66 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.098 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 54.4 Cg_endo -69.69 155.37 66.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.475 2.117 . . . . 0.0 112.35 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -75.94 2.36 12.76 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.464 0.65 . . . . 0.0 112.344 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.19 -57.46 3.99 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.548 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.73 -30.68 36.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.877 0.37 . . . . 0.0 110.058 179.009 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.9 t -64.4 -45.8 86.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.665 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.701 ' O ' HD12 ' A' ' 12' ' ' LEU . 69.1 m -71.1 -43.96 66.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.9 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -49.65 76.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.983 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.536 HD12 ' C ' ' A' ' 10' ' ' LEU . 4.2 pp -71.15 -26.7 63.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.444 ' N ' HD12 ' A' ' 10' ' ' LEU . 5.9 mt -56.8 -30.37 63.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.754 ' O ' HD12 ' A' ' 16' ' ' ILE . 4.0 mp -65.86 -31.37 72.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.934 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.4 m -66.28 -31.42 72.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.912 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -98.4 -31.08 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.907 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.06 -57.1 14.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.938 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.754 HD12 ' O ' ' A' ' 12' ' ' LEU . 4.8 mt -62.74 -38.41 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.088 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.58 27.31 5.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.446 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 13.3 tp -71.21 -59.72 3.16 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.134 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.1 Cg_endo -63.25 -56.83 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.287 1.991 . . . . 0.0 112.357 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.581 ' O ' HG12 ' A' ' 20' ' ' VAL . 16.0 t 62.35 31.11 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.056 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -137.65 31.59 2.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.872 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -108.77 -30.82 7.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.13 -24.37 9.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.148 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.13 -179.988 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.4 mmm . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.738 0.304 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -166.33 88.21 0.86 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.059 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.85 163.91 36.6 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.511 2.141 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -81.29 3.6 23.5 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.431 0.634 . . . . 0.0 111.647 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.537 ' O ' HD23 ' A' ' 9' ' ' LEU . . . -72.49 -52.35 10.49 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.044 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -89.25 -31.29 17.95 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.573 ' HA ' HD23 ' A' ' 10' ' ' LEU . 4.4 t -62.79 -33.56 75.45 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.359 179.256 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -88.66 -40.5 13.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.796 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.537 HD23 ' O ' ' A' ' 5' ' ' GLY . 1.4 mm? -56.24 -39.49 72.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.573 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.4 pp -57.67 -28.89 64.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.03 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.413 HD12 ' HG2' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -57.97 -28.7 64.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.013 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.35 -29.28 65.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.5 m -57.66 -30.34 65.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.6 m -98.57 -31.35 12.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . 0.413 ' HG2' HD12 ' A' ' 11' ' ' LEU . 79.9 mm-40 -66.18 -34.7 78.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.905 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 16' ' ' ILE . 23.4 mt -91.55 12.06 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.546 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -106.69 26.77 9.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.063 0.458 . . . . 0.0 110.916 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.425 ' CB ' ' CD ' ' A' ' 19' ' ' PRO . 0.4 OUTLIER -74.24 -62.68 0.98 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.033 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 18' ' ' LEU . 33.3 Cg_endo -66.03 -56.03 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.322 2.014 . . . . 0.0 112.409 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 20' ' ' VAL . 13.4 t 59.76 31.21 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.043 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.38 80.3 0.21 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.856 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.68 -174.75 2.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -134.61 86.5 2.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.111 179.985 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptm . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.807 0.336 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.527 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . -166.66 160.05 11.65 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.102 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.527 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 55.8 Cg_endo -70.1 151.84 67.28 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.534 2.156 . . . . 0.0 112.354 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.09 4.74 21.92 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.499 0.666 . . . . 0.0 111.599 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.74 -51.9 6.82 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.024 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.92 -34.94 19.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -59.91 -42.16 93.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.396 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -80.73 -37.23 30.93 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.707 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 tp -53.64 -31.16 46.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.066 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 33.9 mt -54.89 -75.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 11' ' ' LEU . 4.4 mm? -66.06 -29.17 69.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.036 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.525 ' HG ' HD12 ' A' ' 16' ' ' ILE . 2.5 tp -59.55 -30.95 68.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.9 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.464 ' O ' HG22 ' A' ' 13' ' ' THR . 5.8 m -98.14 28.02 4.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.891 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -135.96 -46.27 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.933 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -80.6 -27.06 37.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.958 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.607 ' O ' HG22 ' A' ' 16' ' ' ILE . 21.4 mt -91.23 13.25 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.616 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.687 ' O ' HG13 ' A' ' 20' ' ' VAL . 3.0 t0 -97.43 26.98 4.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 111.038 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.513 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 28.1 tp -66.63 -56.77 13.76 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.188 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 21.0 Cg_endo -61.42 -55.13 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.302 2.001 . . . . 0.0 112.256 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.687 HG13 ' O ' ' A' ' 17' ' ' ASP . 6.3 m 43.18 77.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.616 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.19 103.66 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.936 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ARG . . . . . 0.475 ' NH1' ' HB3' ' A' ' 24' ' ' ALA . 35.3 ttp85 -148.11 -63.58 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.861 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.4 mtm105 59.58 104.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.935 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.475 ' HB3' ' NH1' ' A' ' 22' ' ' ARG . . . . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.113 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.844 0.354 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.31 89.54 5.9 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.107 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.32 161.32 45.24 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.556 2.17 . . . . 0.0 112.312 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.97 2.52 26.51 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.552 0.691 . . . . 0.0 111.584 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.487 ' O ' HD12 ' A' ' 9' ' ' LEU . . . -78.28 -44.86 10.65 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.092 178.73 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -86.65 -32.92 20.29 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . 0.483 ' HA ' HD23 ' A' ' 10' ' ' LEU . 1.6 t -62.62 -39.82 95.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.588 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.4 m -85.58 -33.08 21.78 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.94 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.487 HD12 ' O ' ' A' ' 5' ' ' GLY . 8.9 mt -60.27 -38.45 83.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.183 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.85 ' O ' HG22 ' A' ' 13' ' ' THR . 2.9 pp -58.23 -27.1 63.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.167 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.9 mt -75.37 -25.29 57.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.18 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.721 HD23 HG12 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -57.05 -42.23 80.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.125 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.85 HG22 ' O ' ' A' ' 10' ' ' LEU . 13.2 t -55.83 -28.42 56.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 t -82.56 -45.78 14.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.962 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.51 -50.91 69.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.024 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.721 HG12 HD23 ' A' ' 12' ' ' LEU . 38.1 mm -58.47 -21.76 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.239 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.16 26.54 5.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 111.125 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.495 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 42.6 tp -71.11 -57.56 4.68 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.253 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 24.3 Cg_endo -62.16 -53.78 1.8 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.32 2.014 . . . . 0.0 112.334 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.569 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.5 t -92.5 33.08 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.39 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -57.46 -38.18 74.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.892 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 mtm-85 -135.62 -56.46 0.79 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.864 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -152.35 147.3 26.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.956 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.049 179.903 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.0 mmt . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.85 0.357 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -128.6 149.38 71.72 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.085 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.68 153.6 59.53 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.619 2.213 . . . . 0.0 112.258 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -81.14 2.47 27.37 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.609 0.719 . . . . 0.0 111.68 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 9' ' ' LEU . . . -79.53 -46.94 7.65 Favored Glycine 0 N--CA 1.445 -0.763 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.227 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -84.38 -34.21 23.64 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 34.8 t -61.42 -46.87 88.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.491 179.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.4 m -76.47 -35.4 58.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 5' ' ' GLY . 11.8 mt -60.14 -56.41 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.952 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.422 HD12 ' C ' ' A' ' 10' ' ' LEU . 3.8 pp -58.97 -32.03 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.002 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.52 -47.66 85.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.6 mp -85.67 -31.97 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.957 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -66.06 -27.87 68.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.026 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 p -97.55 -30.63 12.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.039 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -74.4 -30.32 61.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.1 mt -96.51 -31.72 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.226 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -99.44 27.86 4.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.103 0.478 . . . . 0.0 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.473 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 23.8 tp -66.24 -58.85 9.65 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.102 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.473 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.5 Cg_endo -63.22 -55.56 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.301 2.001 . . . . 0.0 112.424 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.594 ' O ' HG12 ' A' ' 20' ' ' VAL . 15.9 t 67.67 15.48 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.364 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.1 pttm 176.2 156.66 0.24 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.825 0.345 . . . . 0.0 110.77 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -152.55 -64.14 0.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.863 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -164.12 -71.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.173 179.942 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.796 0.331 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.67 88.24 9.74 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.051 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.64 153.62 69.27 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.514 2.142 . . . . 0.0 112.39 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.39 2.29 13.98 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.469 0.652 . . . . 0.0 112.436 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.42 -48.51 7.34 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.533 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PHE . . . . . 0.439 ' O ' HD23 ' A' ' 10' ' ' LEU . 12.2 t80 -85.36 -31.5 22.93 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.11 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.1 t -66.93 -41.2 87.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.735 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.6 m -80.98 -34.76 32.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.39 -52.97 63.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.061 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.439 HD23 ' O ' ' A' ' 6' ' ' PHE . 3.8 pp -59.31 -30.66 68.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.979 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 11' ' ' LEU . 28.6 mt -74.71 -30.93 61.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.443 ' O ' HD12 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -60.06 -52.36 65.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.949 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.9 t -58.32 -29.24 65.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.979 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.6 t -82.98 -43.6 16.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.938 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -65.0 -39.8 93.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.443 HD12 ' O ' ' A' ' 12' ' ' LEU . 9.0 mt -71.02 -19.67 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.392 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.8 26.83 4.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.075 0.464 . . . . 0.0 111.075 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.445 ' HB3' ' HD3' ' A' ' 19' ' ' PRO . 8.9 tp -82.92 -50.01 0.74 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.345 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' PRO . . . . . 0.445 ' HD3' ' HB3' ' A' ' 18' ' ' LEU . 73.7 Cg_endo -79.79 -50.15 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.434 2.089 . . . . 0.0 112.509 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.1 t -93.68 32.56 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.379 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.65 -33.76 75.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.899 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.0 mmm180 -94.39 46.05 1.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.86 160.29 6.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.951 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.152 -179.991 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.112 0 CA-C-O 120.712 0.292 . . . . 0.0 111.126 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.77 162.74 40.9 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 112.314 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -81.05 5.05 17.69 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.501 0.667 . . . . 0.0 111.674 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.706 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -79.62 -51.51 5.15 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.074 178.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.83 -33.01 24.98 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.629 ' O ' HD23 ' A' ' 11' ' ' LEU . 0.3 OUTLIER -66.49 -42.6 87.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.515 179.421 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -70.04 -52.6 22.68 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.706 HD13 ' O ' ' A' ' 5' ' ' GLY . 6.5 mp -60.34 -26.18 66.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.79 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.02 -66.92 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.629 HD23 ' O ' ' A' ' 7' ' ' SER . 0.8 OUTLIER -67.47 -27.62 67.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.003 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.446 ' O ' HD12 ' A' ' 16' ' ' ILE . 5.3 tp -59.78 -30.02 68.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.637 ' O ' HG22 ' A' ' 13' ' ' THR . 27.5 m -97.78 27.4 4.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.1 t -130.5 -46.43 1.08 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.948 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -76.02 -31.67 59.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.446 HD12 ' O ' ' A' ' 12' ' ' LEU . 29.3 mt -75.6 -28.2 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.239 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.41 27.37 4.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.069 0.462 . . . . 0.0 110.983 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.431 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 16.3 tp -72.06 -60.37 2.35 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.5 Cg_endo -63.9 -56.73 0.44 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.295 1.997 . . . . 0.0 112.372 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 20' ' ' VAL . 13.1 t . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.046 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.114 0 CA-C-O 120.787 0.327 . . . . 0.0 111.113 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.03 156.13 66.2 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.551 2.167 . . . . 0.0 112.296 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -82.27 3.78 26.21 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.549 0.69 . . . . 0.0 111.612 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.92 -45.46 16.4 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.156 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -92.1 -32.2 15.24 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.672 ' HA ' HD23 ' A' ' 10' ' ' LEU . 9.0 t -64.98 -33.84 77.01 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.435 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.405 ' HB3' ' O ' ' A' ' 4' ' ' ARG . 50.9 t -91.48 -39.7 11.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.947 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.535 ' HA ' HD13 ' A' ' 12' ' ' LEU . 8.7 tp -62.96 -32.26 73.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.159 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.672 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.7 pp -58.63 -30.57 67.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.899 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.429 ' N ' HD12 ' A' ' 10' ' ' LEU . 3.8 tp -72.05 -30.49 65.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.852 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.627 HD23 HD11 ' A' ' 16' ' ' ILE . 6.3 mp -68.37 -28.82 67.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.957 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.7 m -55.76 -28.98 58.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . 0.548 ' O ' HD23 ' A' ' 18' ' ' LEU . 10.4 t -99.43 -39.67 8.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.0 -45.0 95.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.982 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.627 HD11 HD23 ' A' ' 12' ' ' LEU . 39.8 mt -75.59 -24.55 17.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.319 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.09 26.38 5.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.939 0.4 . . . . 0.0 111.105 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 14' ' ' SER . 0.2 OUTLIER -84.22 -57.44 0.4 Allowed Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.944 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -78.55 -52.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.485 2.124 . . . . 0.0 112.443 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.1 p . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.406 -179.84 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . 0.615 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.666 0.269 . . . . 0.0 111.099 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.615 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 52.4 Cg_endo -69.35 148.93 68.83 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.554 2.169 . . . . 0.0 112.302 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.1 ptt85 -76.12 2.26 13.43 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.379 0.609 . . . . 0.0 112.329 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.628 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -76.26 -53.25 5.71 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.431 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.406 ' O ' HD23 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -83.37 -31.05 26.95 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.021 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -65.26 -40.06 93.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.644 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 90.8 m -80.79 -35.02 33.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.84 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.628 HD13 ' O ' ' A' ' 5' ' ' GLY . 0.7 OUTLIER -58.72 -52.89 63.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 -179.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 6' ' ' PHE . 3.6 pp -58.59 -33.06 69.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.921 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.1 mt -75.61 -45.85 35.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.82 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.712 ' O ' HD12 ' A' ' 16' ' ' ILE . 0.5 OUTLIER -67.29 -28.55 68.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.459 ' O ' HG22 ' A' ' 13' ' ' THR . 5.9 m -96.87 27.8 3.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.976 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -130.66 -46.24 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.814 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -76.97 -35.67 57.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.866 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.712 HD12 ' O ' ' A' ' 12' ' ' LEU . 1.8 mp -94.43 12.62 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.362 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.31 26.84 5.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.04 0.448 . . . . 0.0 110.957 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.548 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -61.93 -53.68 57.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.105 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 26.9 Cg_endo -63.39 -55.97 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.244 1.963 . . . . 0.0 112.195 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.089 -179.983 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.083 0 CA-C-O 120.736 0.303 . . . . 0.0 111.131 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.72 154.69 54.32 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.575 2.183 . . . . 0.0 112.313 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.47 1.7 15.8 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.423 0.63 . . . . 0.0 112.245 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -77.63 -46.63 9.56 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.915 -1.038 . . . . 0.0 111.469 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -86.69 -31.99 20.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.969 0.414 . . . . 0.0 109.992 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.469 ' HA ' HD23 ' A' ' 10' ' ' LEU . 10.1 t -67.25 -36.58 81.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.694 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.2 m -88.0 -30.75 19.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.009 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.6 mt -62.2 -36.75 82.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.095 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.469 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.4 pp -58.31 -30.56 66.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.961 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 11' ' ' LEU . 41.2 mt -89.63 -42.43 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.74 -28.77 67.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.99 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.608 ' O ' HG22 ' A' ' 13' ' ' THR . 22.7 m -97.93 29.03 3.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.0 p -132.01 -46.26 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -82.31 -29.26 31.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.985 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.6 mm -77.46 -23.89 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.348 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.475 ' HA ' HG12 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -98.08 27.03 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.091 0.472 . . . . 0.0 111.105 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 18.9 mt -71.81 -56.99 4.36 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.189 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.511 ' HD3' ' HB2' ' A' ' 18' ' ' LEU . 37.7 Cg_endo -68.46 -54.32 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.343 2.029 . . . . 0.0 112.461 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.475 HG12 ' HA ' ' A' ' 17' ' ' ASP . 11.4 p . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.265 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.092 0 CA-C-O 120.733 0.301 . . . . 0.0 111.093 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -73.54 150.74 46.32 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.99 4.25 20.22 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.56 0.695 . . . . 0.0 111.653 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.56 -50.96 4.5 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.075 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -79.0 -33.24 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 178.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.06 74.96 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.507 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.5 m -62.3 -53.59 52.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.712 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.5 tp -61.54 -30.75 70.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 24.1 tp -72.42 -35.34 68.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.831 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -30.44 20.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.861 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.8 tp -65.46 -32.3 73.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 m -82.42 -25.89 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.01 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -83.75 -47.95 10.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.148 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.42 -34.53 70.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.017 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.622 ' O ' HG22 ' A' ' 16' ' ' ILE . 22.7 mm -91.06 11.94 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.405 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -100.06 28.57 4.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.083 0.468 . . . . 0.0 110.859 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.53 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.3 OUTLIER -66.83 -54.17 23.1 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.178 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 34.8 Cg_endo -66.23 -55.7 0.36 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.195 1.93 . . . . 0.0 112.528 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 20' ' ' VAL . 15.8 t . . . . . 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.314 -179.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.733 0.301 . . . . 0.0 111.128 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.41 142.5 45.2 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.602 2.201 . . . . 0.0 112.263 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.3 ptt-85 -76.21 3.36 10.9 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.434 0.635 . . . . 0.0 112.456 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.52 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -77.83 -55.91 4.0 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.489 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.17 -32.65 33.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.403 . . . . 0.0 110.037 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.67 -45.12 84.07 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.544 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.97 -52.82 38.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.667 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 5' ' ' GLY . 3.3 mp -61.24 -31.34 71.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.72 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.2 tp -66.76 -31.18 71.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.821 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.35 -26.83 22.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.983 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.41 HD12 HD13 ' A' ' 16' ' ' ILE . 5.5 tp -66.52 -29.74 69.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.91 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.546 ' O ' HG22 ' A' ' 13' ' ' THR . 14.0 m -97.67 28.84 3.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.2 p -134.47 -46.3 0.75 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.414 ' O ' HD21 ' A' ' 18' ' ' LEU . 34.4 mm-40 -82.29 -35.8 27.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.991 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.613 ' O ' HG22 ' A' ' 16' ' ' ILE . 3.2 mp -91.72 12.83 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.53 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -98.58 26.52 5.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.034 0.445 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.526 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 5.9 mt -70.18 -53.92 10.12 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.309 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.9 Cg_endo -63.8 -54.81 0.81 Allowed 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.216 1.944 . . . . 0.0 112.403 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.443 179.97 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.671 0.272 . . . . 0.0 111.092 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.65 145.67 70.6 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.458 2.106 . . . . 0.0 112.315 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.93 2.89 24.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.549 0.69 . . . . 0.0 111.699 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.96 -47.04 7.92 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.228 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.407 ' O ' HD23 ' A' ' 10' ' ' LEU . 17.7 t80 -86.0 -32.12 21.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.595 ' O ' HD13 ' A' ' 11' ' ' LEU . 17.6 t -64.2 -41.1 97.22 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.542 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.6 m -83.69 -32.06 25.76 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.945 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.75 -48.1 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.114 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.697 ' CD1' HD12 ' A' ' 11' ' ' LEU . 3.4 pp -56.77 -33.13 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.011 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.697 HD12 ' CD1' ' A' ' 10' ' ' LEU . 6.6 mp -62.7 -35.5 79.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.903 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.9 tp -71.24 -32.2 68.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 10' ' ' LEU . 12.2 t -98.08 29.43 3.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.95 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -131.23 -46.29 1.0 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.787 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.24 -31.65 66.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.83 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.592 ' O ' HG22 ' A' ' 16' ' ' ILE . 21.7 mt -105.5 11.83 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.449 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -102.9 26.5 8.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.065 0.459 . . . . 0.0 110.866 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.458 ' N ' ' CD ' ' A' ' 19' ' ' PRO . 1.8 mt -81.93 -47.64 0.98 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.273 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 18' ' ' LEU . 72.5 Cg_endo -80.2 -51.69 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.304 2.003 . . . . 0.0 112.465 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.576 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.6 t . . . . . 0 C--N 1.327 -0.39 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.166 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . 0.616 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . . . . . . 0 C--O 1.232 0.137 0 CA-C-O 120.717 0.294 . . . . 0.0 111.148 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.616 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 49.8 Cg_endo -68.88 138.64 41.23 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.608 2.205 . . . . 0.0 112.323 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -80.76 4.0 20.44 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.512 0.672 . . . . 0.0 111.755 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.02 -54.61 5.2 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.296 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -85.54 -31.37 22.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t -65.24 -39.47 92.76 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.471 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.2 t -78.58 -40.76 33.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.796 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.87 -40.57 73.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.091 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.461 HD12 ' N ' ' A' ' 11' ' ' LEU . 4.6 pp -81.07 -28.83 35.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.461 ' N ' HD12 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -59.58 -32.79 70.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.973 179.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.1 tp -68.21 -30.44 69.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.883 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.492 ' HA ' HG22 ' A' ' 16' ' ' ILE . 63.5 m -84.13 -26.96 28.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.059 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.1 p -73.83 -40.77 63.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.966 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.54 -35.25 75.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.09 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.492 HG22 ' HA ' ' A' ' 13' ' ' THR . 10.9 tp -81.18 -39.16 17.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.021 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.516 ' OD2' HG23 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -94.66 27.98 2.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.204 -179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.48 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 36.3 tp -66.48 -57.66 11.92 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.139 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 25.9 Cg_endo -62.51 -55.37 0.93 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.402 2.068 . . . . 0.0 112.292 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.516 HG23 ' OD2' ' A' ' 17' ' ' ASP . 2.9 m . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.547 -179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.687 0.28 . . . . 0.0 111.098 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 54.4 Cg_endo -69.69 155.37 66.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.475 2.117 . . . . 0.0 112.35 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -75.94 2.36 12.76 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.464 0.65 . . . . 0.0 112.344 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.19 -57.46 3.99 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.548 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.73 -30.68 36.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.877 0.37 . . . . 0.0 110.058 179.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.9 t -64.4 -45.8 86.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.665 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . 0.701 ' O ' HD12 ' A' ' 12' ' ' LEU . 69.1 m -71.1 -43.96 66.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.9 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -49.65 76.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.983 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.536 HD12 ' C ' ' A' ' 10' ' ' LEU . 4.2 pp -71.15 -26.7 63.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.444 ' N ' HD12 ' A' ' 10' ' ' LEU . 5.9 mt -56.8 -30.37 63.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.754 ' O ' HD12 ' A' ' 16' ' ' ILE . 4.0 mp -65.86 -31.37 72.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.934 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.4 m -66.28 -31.42 72.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.912 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -98.4 -31.08 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.907 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.06 -57.1 14.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.938 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.754 HD12 ' O ' ' A' ' 12' ' ' LEU . 4.8 mt -62.74 -38.41 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.088 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.58 27.31 5.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.446 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 13.3 tp -71.21 -59.72 3.16 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.134 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.1 Cg_endo -63.25 -56.83 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.287 1.991 . . . . 0.0 112.357 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.581 ' O ' HG12 ' A' ' 20' ' ' VAL . 16.0 t . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.056 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.083 0 CA-C-O 120.701 0.286 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.85 163.91 36.6 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.511 2.141 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -81.29 3.6 23.5 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.431 0.634 . . . . 0.0 111.647 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.537 ' O ' HD23 ' A' ' 9' ' ' LEU . . . -72.49 -52.35 10.49 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.044 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -89.25 -31.29 17.95 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.573 ' HA ' HD23 ' A' ' 10' ' ' LEU . 4.4 t -62.79 -33.56 75.45 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.359 179.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -88.66 -40.5 13.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.796 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.537 HD23 ' O ' ' A' ' 5' ' ' GLY . 1.4 mm? -56.24 -39.49 72.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.573 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.4 pp -57.67 -28.89 64.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.03 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.413 HD12 ' HG2' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -57.97 -28.7 64.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.013 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.35 -29.28 65.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.5 m -57.66 -30.34 65.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.6 m -98.57 -31.35 12.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . 0.413 ' HG2' HD12 ' A' ' 11' ' ' LEU . 79.9 mm-40 -66.18 -34.7 78.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.905 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 16' ' ' ILE . 23.4 mt -91.55 12.06 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.546 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -106.69 26.77 9.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.063 0.458 . . . . 0.0 110.916 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.425 ' CB ' ' CD ' ' A' ' 19' ' ' PRO . 0.4 OUTLIER -74.24 -62.68 0.98 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.033 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 18' ' ' LEU . 33.3 Cg_endo -66.03 -56.03 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.322 2.014 . . . . 0.0 112.409 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 20' ' ' VAL . 13.4 t . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.043 179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . 0.527 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . . . . . . 0 C--O 1.231 0.093 0 CA-C-O 120.739 0.304 . . . . 0.0 111.102 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.527 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 55.8 Cg_endo -70.1 151.84 67.28 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.534 2.156 . . . . 0.0 112.354 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.09 4.74 21.92 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.499 0.666 . . . . 0.0 111.599 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.74 -51.9 6.82 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.024 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.92 -34.94 19.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -59.91 -42.16 93.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.396 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -80.73 -37.23 30.93 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.707 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 tp -53.64 -31.16 46.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.066 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 33.9 mt -54.89 -75.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 11' ' ' LEU . 4.4 mm? -66.06 -29.17 69.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.036 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.525 ' HG ' HD12 ' A' ' 16' ' ' ILE . 2.5 tp -59.55 -30.95 68.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.9 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.464 ' O ' HG22 ' A' ' 13' ' ' THR . 5.8 m -98.14 28.02 4.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.891 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -135.96 -46.27 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.933 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -80.6 -27.06 37.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.958 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.607 ' O ' HG22 ' A' ' 16' ' ' ILE . 21.4 mt -91.23 13.25 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.616 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.687 ' O ' HG13 ' A' ' 20' ' ' VAL . 3.0 t0 -97.43 26.98 4.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 111.038 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.513 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 28.1 tp -66.63 -56.77 13.76 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.188 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 21.0 Cg_endo -61.42 -55.13 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.302 2.001 . . . . 0.0 112.256 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.687 HG13 ' O ' ' A' ' 17' ' ' ASP . 6.3 m . . . . . 0 N--CA 1.462 0.164 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.616 -179.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.687 0.28 . . . . 0.0 111.107 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.32 161.32 45.24 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.556 2.17 . . . . 0.0 112.312 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.97 2.52 26.51 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.552 0.691 . . . . 0.0 111.584 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.487 ' O ' HD12 ' A' ' 9' ' ' LEU . . . -78.28 -44.86 10.65 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.092 178.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -86.65 -32.92 20.29 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . 0.483 ' HA ' HD23 ' A' ' 10' ' ' LEU . 1.6 t -62.62 -39.82 95.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.588 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.4 m -85.58 -33.08 21.78 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.94 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.487 HD12 ' O ' ' A' ' 5' ' ' GLY . 8.9 mt -60.27 -38.45 83.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.183 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.85 ' O ' HG22 ' A' ' 13' ' ' THR . 2.9 pp -58.23 -27.1 63.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.167 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.9 mt -75.37 -25.29 57.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.18 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.721 HD23 HG12 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -57.05 -42.23 80.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.125 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.85 HG22 ' O ' ' A' ' 10' ' ' LEU . 13.2 t -55.83 -28.42 56.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 t -82.56 -45.78 14.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.962 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.51 -50.91 69.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.024 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.721 HG12 HD23 ' A' ' 12' ' ' LEU . 38.1 mm -58.47 -21.76 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.239 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.16 26.54 5.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 111.125 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.495 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 42.6 tp -71.11 -57.56 4.68 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.253 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 24.3 Cg_endo -62.16 -53.78 1.8 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.32 2.014 . . . . 0.0 112.334 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.569 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.5 t . . . . . 0 C--N 1.328 -0.369 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.39 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.744 0.307 . . . . 0.0 111.085 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.68 153.6 59.53 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.619 2.213 . . . . 0.0 112.258 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -81.14 2.47 27.37 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.609 0.719 . . . . 0.0 111.68 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 9' ' ' LEU . . . -79.53 -46.94 7.65 Favored Glycine 0 N--CA 1.445 -0.763 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.227 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -84.38 -34.21 23.64 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 34.8 t -61.42 -46.87 88.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.491 179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.4 m -76.47 -35.4 58.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 5' ' ' GLY . 11.8 mt -60.14 -56.41 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.952 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.422 HD12 ' C ' ' A' ' 10' ' ' LEU . 3.8 pp -58.97 -32.03 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.002 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.52 -47.66 85.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.6 mp -85.67 -31.97 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.957 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -66.06 -27.87 68.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.026 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 p -97.55 -30.63 12.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.039 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -74.4 -30.32 61.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.1 mt -96.51 -31.72 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.226 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -99.44 27.86 4.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.103 0.478 . . . . 0.0 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.473 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 23.8 tp -66.24 -58.85 9.65 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.102 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.473 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.5 Cg_endo -63.22 -55.56 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.301 2.001 . . . . 0.0 112.424 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.594 ' O ' HG12 ' A' ' 20' ' ' VAL . 15.9 t . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.364 -179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.693 0.282 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.64 153.62 69.27 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.514 2.142 . . . . 0.0 112.39 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.39 2.29 13.98 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.469 0.652 . . . . 0.0 112.436 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.42 -48.51 7.34 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.533 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PHE . . . . . 0.439 ' O ' HD23 ' A' ' 10' ' ' LEU . 12.2 t80 -85.36 -31.5 22.93 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.1 t -66.93 -41.2 87.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.735 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.6 m -80.98 -34.76 32.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.39 -52.97 63.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.061 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.439 HD23 ' O ' ' A' ' 6' ' ' PHE . 3.8 pp -59.31 -30.66 68.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.979 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 11' ' ' LEU . 28.6 mt -74.71 -30.93 61.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LEU . . . . . 0.443 ' O ' HD12 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -60.06 -52.36 65.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.949 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.9 t -58.32 -29.24 65.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.979 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.6 t -82.98 -43.6 16.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.938 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -65.0 -39.8 93.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.443 HD12 ' O ' ' A' ' 12' ' ' LEU . 9.0 mt -71.02 -19.67 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.392 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.8 26.83 4.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.075 0.464 . . . . 0.0 111.075 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.445 ' HB3' ' HD3' ' A' ' 19' ' ' PRO . 8.9 tp -82.92 -50.01 0.74 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.345 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' PRO . . . . . 0.445 ' HD3' ' HB3' ' A' ' 18' ' ' LEU . 73.7 Cg_endo -79.79 -50.15 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.434 2.089 . . . . 0.0 112.509 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.1 t . . . . . 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.379 -179.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptp . . . . . 0 N--CA 1.486 1.352 0 CA-C-O 120.77 0.319 . . . . 0.0 111.21 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.12 88.34 0.12 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.126 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.77 162.74 40.9 Favored 'Trans proline' 0 C--N 1.345 0.356 0 C-N-CA 122.513 2.142 . . . . 0.0 112.314 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 17.7 ttp180 -81.05 5.05 17.69 Favored 'General case' 0 CA--C 1.516 -0.354 0 CA-C-O 121.501 0.667 . . . . 0.0 111.674 179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.706 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -79.62 -51.51 5.15 Favored Glycine 0 N--CA 1.444 -0.825 0 CA-C-N 114.785 -1.098 . . . . 0.0 111.074 178.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -83.83 -33.01 24.98 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 178.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.629 ' O ' HD23 ' A' ' 11' ' ' LEU . 0.3 OUTLIER -66.49 -42.6 87.17 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.515 179.421 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.5 t -70.04 -52.6 22.68 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.58 179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.706 HD13 ' O ' ' A' ' 5' ' ' GLY . 6.5 mp -60.34 -26.18 66.39 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.79 179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 13.0 tp -59.02 -66.92 0.43 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.189 -0.459 . . . . 0.0 110.854 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.629 HD23 ' O ' ' A' ' 7' ' ' SER . 0.8 OUTLIER -67.47 -27.62 67.17 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.003 -179.976 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.446 ' O ' HD12 ' A' ' 16' ' ' ILE . 5.3 tp -59.78 -30.02 68.6 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.901 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.637 ' O ' HG22 ' A' ' 13' ' ' THR . 27.5 m -97.78 27.4 4.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.985 179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 29.1 t -130.5 -46.43 1.08 Allowed 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.948 179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -76.02 -31.67 59.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.941 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.446 HD12 ' O ' ' A' ' 12' ' ' LEU . 29.3 mt -75.6 -28.2 19.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.25 -0.432 . . . . 0.0 111.239 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -98.41 27.37 4.77 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.069 0.462 . . . . 0.0 110.983 -179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.431 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 16.3 tp -72.06 -60.37 2.35 Favored Pre-proline 0 C--N 1.323 -0.548 0 CA-C-N 115.779 -0.646 . . . . 0.0 111.031 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.431 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.5 Cg_endo -63.9 -56.73 0.44 Allowed 'Trans proline' 0 C--N 1.347 0.493 0 C-N-CA 122.295 1.997 . . . . 0.0 112.372 -179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.566 ' O ' HG12 ' A' ' 20' ' ' VAL . 13.1 t 60.67 30.64 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.046 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -178.02 -39.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.897 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -59.06 147.26 35.42 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.928 -179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -78.71 -69.19 0.58 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.935 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.365 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.145 179.976 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.349 0 CA-C-O 120.838 0.352 . . . . 0.0 111.172 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.44 53.69 3.47 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.113 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -69.03 156.13 66.2 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.551 2.167 . . . . 0.0 112.296 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . 0.405 ' O ' ' HB3' ' A' ' 8' ' ' CYS . 0.0 OUTLIER -82.27 3.78 26.21 Favored 'General case' 0 CA--C 1.516 -0.334 0 CA-C-O 121.549 0.69 . . . . 0.0 111.612 179.947 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.92 -45.46 16.4 Favored Glycine 0 N--CA 1.445 -0.708 0 CA-C-N 114.661 -1.154 . . . . 0.0 111.156 178.805 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.3 t80 -92.1 -32.2 15.24 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.733 -0.469 . . . . 0.0 109.733 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.672 ' HA ' HD23 ' A' ' 10' ' ' LEU . 9.0 t -64.98 -33.84 77.01 Favored 'General case' 0 N--CA 1.456 -0.171 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.435 179.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.405 ' HB3' ' O ' ' A' ' 4' ' ' ARG . 50.9 t -91.48 -39.7 11.8 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.947 179.755 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.535 ' HA ' HD13 ' A' ' 12' ' ' LEU . 8.7 tp -62.96 -32.26 73.54 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.159 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.672 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.7 pp -58.63 -30.57 67.37 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.899 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.429 ' N ' HD12 ' A' ' 10' ' ' LEU . 3.8 tp -72.05 -30.49 65.21 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.852 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.627 HD23 HD11 ' A' ' 16' ' ' ILE . 6.3 mp -68.37 -28.82 67.46 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.957 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 61.7 m -55.76 -28.98 58.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.025 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . 0.548 ' O ' HD23 ' A' ' 18' ' ' LEU . 10.4 t -99.43 -39.67 8.25 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.277 -0.42 . . . . 0.0 110.897 179.964 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -62.0 -45.0 95.51 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.982 -179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.627 HD11 HD23 ' A' ' 12' ' ' LEU . 39.8 mt -75.59 -24.55 17.14 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.319 -179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.09 26.38 5.33 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.939 0.4 . . . . 0.0 111.105 -179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.548 HD23 ' O ' ' A' ' 14' ' ' SER . 0.2 OUTLIER -84.22 -57.44 0.4 Allowed Pre-proline 0 C--N 1.322 -0.591 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.944 179.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -78.55 -52.23 0.06 OUTLIER 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.485 2.124 . . . . 0.0 112.443 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 12.1 p -53.73 -24.38 9.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.406 -179.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -52.49 -33.44 44.84 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.188 -179.943 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 1.1 ptt-85 -177.54 43.46 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.966 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 9.5 mmt-85 -155.88 -76.39 0.1 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.892 179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.131 179.999 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.487 1.394 0 CA-C-O 120.857 0.36 . . . . 0.0 111.193 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.615 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . -59.63 162.65 8.44 Favored Pre-proline 0 C--N 1.33 -0.249 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.099 -179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.615 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 52.4 Cg_endo -69.35 148.93 68.83 Favored 'Trans proline' 0 C--O 1.233 0.274 0 C-N-CA 122.554 2.169 . . . . 0.0 112.302 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 4.1 ptt85 -76.12 2.26 13.43 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.379 0.609 . . . . 0.0 112.329 -179.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.628 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -76.26 -53.25 5.71 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-N 114.966 -1.016 . . . . 0.0 111.431 179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.406 ' O ' HD23 ' A' ' 10' ' ' LEU . 0.3 OUTLIER -83.37 -31.05 26.95 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.007 -0.368 . . . . 0.0 110.007 179.021 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.6 t -65.26 -40.06 93.47 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.012 -0.54 . . . . 0.0 110.644 179.697 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 90.8 m -80.79 -35.02 33.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.84 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.628 HD13 ' O ' ' A' ' 5' ' ' GLY . 0.7 OUTLIER -58.72 -52.89 63.77 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.975 -179.875 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.406 HD23 ' O ' ' A' ' 6' ' ' PHE . 3.6 pp -58.59 -33.06 69.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.921 -179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 38.1 mt -75.61 -45.85 35.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.82 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.712 ' O ' HD12 ' A' ' 16' ' ' ILE . 0.5 OUTLIER -67.29 -28.55 68.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.141 -0.481 . . . . 0.0 110.915 179.92 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.459 ' O ' HG22 ' A' ' 13' ' ' THR . 5.9 m -96.87 27.8 3.81 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.976 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 20.1 t -130.66 -46.24 1.06 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.814 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -76.97 -35.67 57.03 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.866 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.712 HD12 ' O ' ' A' ' 12' ' ' LEU . 1.8 mp -94.43 12.62 3.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.362 179.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.31 26.84 5.62 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.04 0.448 . . . . 0.0 110.957 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.548 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.6 OUTLIER -61.93 -53.68 57.7 Favored Pre-proline 0 C--N 1.324 -0.534 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.105 179.911 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.548 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 26.9 Cg_endo -63.39 -55.97 0.63 Allowed 'Trans proline' 0 C--N 1.347 0.464 0 C-N-CA 122.244 1.963 . . . . 0.0 112.195 -179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.5 t -57.27 -30.84 36.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.089 -179.983 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 24.0 mttt -130.82 97.9 4.47 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.806 179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.65 166.58 1.79 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.003 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.72 143.74 25.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.938 179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.156 -0.474 . . . . 0.0 111.096 -179.936 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.0 mpt? . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.798 0.333 . . . . 0.0 111.23 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -88.51 146.88 38.44 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.131 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.72 154.69 54.32 Favored 'Trans proline' 0 C--N 1.345 0.383 0 C-N-CA 122.575 2.183 . . . . 0.0 112.313 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -76.47 1.7 15.8 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-O 121.423 0.63 . . . . 0.0 112.245 -179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -77.63 -46.63 9.56 Favored Glycine 0 N--CA 1.446 -0.661 0 CA-C-N 114.915 -1.038 . . . . 0.0 111.469 179.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 23.8 t80 -86.69 -31.99 20.73 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.969 0.414 . . . . 0.0 109.992 179.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.469 ' HA ' HD23 ' A' ' 10' ' ' LEU . 10.1 t -67.25 -36.58 81.91 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.694 179.688 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 77.2 m -88.0 -30.75 19.76 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.009 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.6 mt -62.2 -36.75 82.89 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.095 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.469 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.4 pp -58.31 -30.56 66.76 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.961 -179.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.409 HD23 ' HA ' ' A' ' 11' ' ' LEU . 41.2 mt -89.63 -42.43 11.38 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.877 179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -68.74 -28.77 67.11 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.044 -0.526 . . . . 0.0 110.99 179.797 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.608 ' O ' HG22 ' A' ' 13' ' ' THR . 22.7 m -97.93 29.03 3.61 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.942 179.899 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 59.0 p -132.01 -46.26 0.94 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.944 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 26.9 mm-40 -82.31 -29.26 31.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.985 179.988 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 24.6 mm -77.46 -23.89 14.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.348 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.475 ' HA ' HG12 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -98.08 27.03 4.81 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.091 0.472 . . . . 0.0 111.105 -179.876 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.511 ' HB2' ' HD3' ' A' ' 19' ' ' PRO . 18.9 mt -71.81 -56.99 4.36 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.746 -0.661 . . . . 0.0 111.189 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.511 ' HD3' ' HB2' ' A' ' 18' ' ' LEU . 37.7 Cg_endo -68.46 -54.32 0.3 Allowed 'Trans proline' 0 C--N 1.347 0.488 0 C-N-CA 122.343 2.029 . . . . 0.0 112.461 -179.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.475 HG12 ' HA ' ' A' ' 17' ' ' ASP . 11.4 p -50.74 -30.4 8.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.265 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER 57.73 -174.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.266 -0.425 . . . . 0.0 111.025 179.914 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 24.0 mtt85 -131.5 -45.93 0.98 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.888 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 25.5 tpp180 -173.86 -51.85 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.921 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.106 -179.977 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.0 ttt . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.825 0.345 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -106.63 149.64 38.64 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-N 116.189 -0.46 . . . . 0.0 111.093 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 63.6 Cg_endo -73.54 150.74 46.32 Favored 'Trans proline' 0 C--N 1.344 0.312 0 C-N-CA 122.606 2.204 . . . . 0.0 112.343 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.99 4.25 20.22 Favored 'General case' 0 CA--C 1.517 -0.306 0 CA-C-O 121.56 0.695 . . . . 0.0 111.653 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -82.56 -50.96 4.5 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-N 114.66 -1.155 . . . . 0.0 111.075 178.747 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -79.0 -33.24 45.15 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 109.628 -0.508 . . . . 0.0 109.628 178.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.12 -48.06 74.96 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.507 179.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 18.5 m -62.3 -53.59 52.94 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.371 -0.377 . . . . 0.0 110.712 179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.5 tp -61.54 -30.75 70.85 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.871 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 24.1 tp -72.42 -35.34 68.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.831 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -87.54 -30.44 20.56 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.861 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 52.8 tp -65.46 -32.3 73.85 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.842 179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 2.2 m -82.42 -25.89 33.27 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.01 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.7 t -83.75 -47.95 10.63 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.148 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -58.42 -34.53 70.89 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.017 -179.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.622 ' O ' HG22 ' A' ' 16' ' ' ILE . 22.7 mm -91.06 11.94 2.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.405 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -100.06 28.57 4.77 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.083 0.468 . . . . 0.0 110.859 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.53 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 0.3 OUTLIER -66.83 -54.17 23.1 Favored Pre-proline 0 C--N 1.324 -0.531 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.178 -179.889 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.53 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 34.8 Cg_endo -66.23 -55.7 0.36 Allowed 'Trans proline' 0 C--N 1.348 0.534 0 C-N-CA 122.195 1.93 . . . . 0.0 112.528 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.606 ' O ' HG12 ' A' ' 20' ' ' VAL . 15.8 t 66.07 15.85 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.22 -0.445 . . . . 0.0 111.314 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -152.92 -49.64 0.1 Allowed 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.44 -0.346 . . . . 0.0 110.778 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 7.1 tmm_? -154.68 -72.27 0.12 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.839 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 31.2 mtp180 -158.98 142.79 15.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.908 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.119 179.985 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.0 mpp? . . . . . 0 N--CA 1.487 1.406 0 CA-C-O 120.791 0.329 . . . . 0.0 111.227 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 61.48 153.55 0.11 Allowed Pre-proline 0 C--N 1.329 -0.312 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.128 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -70.41 142.5 45.2 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.602 2.201 . . . . 0.0 112.263 179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 13.3 ptt-85 -76.21 3.36 10.9 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.434 0.635 . . . . 0.0 112.456 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.52 ' O ' HD13 ' A' ' 9' ' ' LEU . . . -77.83 -55.91 4.0 Favored Glycine 0 N--CA 1.446 -0.635 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.489 179.137 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -81.17 -32.65 33.52 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.945 0.403 . . . . 0.0 110.037 179.113 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.67 -45.12 84.07 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.544 179.558 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 50.4 t -66.97 -52.82 38.01 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.667 179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.52 HD13 ' O ' ' A' ' 5' ' ' GLY . 3.3 mp -61.24 -31.34 71.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.72 179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 22.2 tp -66.76 -31.18 71.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.821 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.35 -26.83 22.01 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.983 -180.0 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.41 HD12 HD13 ' A' ' 16' ' ' ILE . 5.5 tp -66.52 -29.74 69.9 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.91 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.546 ' O ' HG22 ' A' ' 13' ' ' THR . 14.0 m -97.67 28.84 3.6 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.933 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 25.2 p -134.47 -46.3 0.75 Allowed 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.308 -0.406 . . . . 0.0 110.994 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.414 ' O ' HD21 ' A' ' 18' ' ' LEU . 34.4 mm-40 -82.29 -35.8 27.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.991 -179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.613 ' O ' HG22 ' A' ' 16' ' ' ILE . 3.2 mp -91.72 12.83 2.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.53 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.7 t0 -98.58 26.52 5.49 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 121.034 0.445 . . . . 0.0 110.981 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.526 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 5.9 mt -70.18 -53.92 10.12 Favored Pre-proline 0 C--N 1.323 -0.564 0 CA-C-N 115.743 -0.662 . . . . 0.0 111.309 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.526 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 28.9 Cg_endo -63.8 -54.81 0.81 Allowed 'Trans proline' 0 C--N 1.349 0.557 0 C-N-CA 122.216 1.944 . . . . 0.0 112.403 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t -49.44 -28.14 3.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.443 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 20.9 mmtt -115.66 -179.23 3.59 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.877 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.93 -50.8 8.74 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.274 -0.421 . . . . 0.0 110.873 -179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -130.4 -176.35 3.93 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.944 179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.359 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.097 179.987 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.343 0 CA-C-O 120.837 0.351 . . . . 0.0 111.162 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 60.98 92.87 0.06 OUTLIER Pre-proline 0 C--N 1.33 -0.279 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.092 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 41.6 Cg_endo -67.65 145.67 70.6 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.458 2.106 . . . . 0.0 112.315 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.93 2.89 24.79 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-O 121.549 0.69 . . . . 0.0 111.699 -179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.96 -47.04 7.92 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-N 114.729 -1.123 . . . . 0.0 111.228 178.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.407 ' O ' HD23 ' A' ' 10' ' ' LEU . 17.7 t80 -86.0 -32.12 21.68 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 178.749 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.595 ' O ' HD13 ' A' ' 11' ' ' LEU . 17.6 t -64.2 -41.1 97.22 Favored 'General case' 0 N--CA 1.456 -0.174 0 CA-C-N 115.89 -0.595 . . . . 0.0 110.542 179.487 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 68.6 m -83.69 -32.06 25.76 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.945 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 11.5 mt -63.75 -48.1 78.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.114 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.697 ' CD1' HD12 ' A' ' 11' ' ' LEU . 3.4 pp -56.77 -33.13 66.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.328 -0.397 . . . . 0.0 111.011 -179.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.697 HD12 ' CD1' ' A' ' 10' ' ' LEU . 6.6 mp -62.7 -35.5 79.9 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.903 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.9 tp -71.24 -32.2 68.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.918 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.506 HG22 ' HA ' ' A' ' 10' ' ' LEU . 12.2 t -98.08 29.43 3.5 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.95 179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.9 t -131.23 -46.29 1.0 Allowed 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.787 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.24 -31.65 66.01 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.83 -179.991 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.592 ' O ' HG22 ' A' ' 16' ' ' ILE . 21.7 mt -105.5 11.83 8.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.449 179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -102.9 26.5 8.04 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.065 0.459 . . . . 0.0 110.866 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.458 ' N ' ' CD ' ' A' ' 19' ' ' PRO . 1.8 mt -81.93 -47.64 0.98 Allowed Pre-proline 0 C--N 1.323 -0.55 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.273 179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 18' ' ' LEU . 72.5 Cg_endo -80.2 -51.69 0.05 OUTLIER 'Trans proline' 0 C--N 1.348 0.523 0 C-N-CA 122.304 2.003 . . . . 0.0 112.465 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.576 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.6 t 68.12 29.09 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.39 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.166 -179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 63.2 -78.04 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.124 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 6.2 mtp180 64.19 -79.43 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.911 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -177.91 -177.99 0.66 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.861 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.246 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.094 -179.993 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 ttm . . . . . 0 N--CA 1.487 1.399 0 CA-C-O 120.845 0.355 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.616 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . 60.54 162.74 0.1 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.148 179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.616 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 49.8 Cg_endo -68.88 138.64 41.23 Favored 'Trans proline' 0 C--N 1.344 0.315 0 C-N-CA 122.608 2.205 . . . . 0.0 112.323 179.917 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 3.2 ttp180 -80.76 4.0 20.44 Favored 'General case' 0 CA--C 1.516 -0.363 0 CA-C-O 121.512 0.672 . . . . 0.0 111.755 -179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.02 -54.61 5.2 Favored Glycine 0 N--CA 1.446 -0.692 0 CA-C-N 114.764 -1.107 . . . . 0.0 111.296 178.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -85.54 -31.37 22.75 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 109.876 -0.416 . . . . 0.0 109.876 178.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 5.6 t -65.24 -39.47 92.76 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.471 179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.2 t -78.58 -40.76 33.75 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.2 -0.454 . . . . 0.0 110.796 179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.2 mt -55.87 -40.57 73.13 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.091 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.461 HD12 ' N ' ' A' ' 11' ' ' LEU . 4.6 pp -81.07 -28.83 35.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.461 ' N ' HD12 ' A' ' 10' ' ' LEU . 0.1 OUTLIER -59.58 -32.79 70.69 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.973 179.985 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 8.1 tp -68.21 -30.44 69.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.883 -179.938 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.492 ' HA ' HG22 ' A' ' 16' ' ' ILE . 63.5 m -84.13 -26.96 28.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 0.0 111.059 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 55.1 p -73.83 -40.77 63.07 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.966 -179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.54 -35.25 75.26 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.09 -179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.492 HG22 ' HA ' ' A' ' 13' ' ' THR . 10.9 tp -81.18 -39.16 17.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.021 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.516 ' OD2' HG23 ' A' ' 20' ' ' VAL . 0.4 OUTLIER -94.66 27.98 2.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.204 -179.845 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.48 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 36.3 tp -66.48 -57.66 11.92 Favored Pre-proline 0 C--N 1.324 -0.5 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.139 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 25.9 Cg_endo -62.51 -55.37 0.93 Allowed 'Trans proline' 0 C--N 1.347 0.494 0 C-N-CA 122.402 2.068 . . . . 0.0 112.292 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.516 HG23 ' OD2' ' A' ' 17' ' ' ASP . 2.9 m -58.62 -18.88 13.3 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.547 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -47.26 -28.29 1.87 Allowed 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 120.772 0.32 . . . . 0.0 111.296 179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 32.3 mtm180 -51.47 -28.94 14.65 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.077 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.6 mmt180 -155.18 -70.33 0.12 Allowed 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.909 179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.068 179.943 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 7.7 mtp . . . . . 0 N--CA 1.486 1.336 0 CA-C-O 120.766 0.317 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.467 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . -165.39 158.53 13.66 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.2 -0.455 . . . . 0.0 111.098 179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.467 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 54.4 Cg_endo -69.69 155.37 66.34 Favored 'Trans proline' 0 C--N 1.344 0.325 0 C-N-CA 122.475 2.117 . . . . 0.0 112.35 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.4 ptp85 -75.94 2.36 12.76 Favored 'General case' 0 CA--C 1.518 -0.287 0 CA-C-O 121.464 0.65 . . . . 0.0 112.344 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -76.19 -57.46 3.99 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-N 114.977 -1.011 . . . . 0.0 111.548 179.139 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -80.73 -30.68 36.19 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 120.877 0.37 . . . . 0.0 110.058 179.009 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 7.9 t -64.4 -45.8 86.06 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.035 -0.529 . . . . 0.0 110.665 179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.701 ' O ' HD12 ' A' ' 12' ' ' LEU . 69.1 m -71.1 -43.96 66.62 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.32 -0.4 . . . . 0.0 110.9 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -58.17 -49.65 76.27 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.983 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.536 HD12 ' C ' ' A' ' 10' ' ' LEU . 4.2 pp -71.15 -26.7 63.11 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.23 -0.441 . . . . 0.0 111.004 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.444 ' N ' HD12 ' A' ' 10' ' ' LEU . 5.9 mt -56.8 -30.37 63.62 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.977 -179.927 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.754 ' O ' HD12 ' A' ' 16' ' ' ILE . 4.0 mp -65.86 -31.37 72.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.934 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 62.4 m -66.28 -31.42 72.22 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.912 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.6 p -98.4 -31.08 12.2 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.244 -0.435 . . . . 0.0 110.907 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.06 -57.1 14.0 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.938 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.754 HD12 ' O ' ' A' ' 12' ' ' LEU . 4.8 mt -62.74 -38.41 81.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.088 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -99.58 27.31 5.41 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.053 0.454 . . . . 0.0 110.96 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.446 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 13.3 tp -71.21 -59.72 3.16 Favored Pre-proline 0 C--N 1.323 -0.549 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.134 -179.976 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.446 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.1 Cg_endo -63.25 -56.83 0.47 Allowed 'Trans proline' 0 C--N 1.347 0.484 0 C-N-CA 122.287 1.991 . . . . 0.0 112.357 -179.872 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.581 ' O ' HG12 ' A' ' 20' ' ' VAL . 16.0 t 62.35 31.11 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.056 -179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.6 tttm -137.65 31.59 2.53 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.187 -0.461 . . . . 0.0 110.872 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -108.77 -30.82 7.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.889 179.964 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.13 -24.37 9.91 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.148 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.241 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.13 -179.988 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.4 mmm . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.738 0.304 . . . . 0.0 111.2 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -166.33 88.21 0.86 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.059 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.85 163.91 36.6 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.511 2.141 . . . . 0.0 112.37 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -81.29 3.6 23.5 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.431 0.634 . . . . 0.0 111.647 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.537 ' O ' HD23 ' A' ' 9' ' ' LEU . . . -72.49 -52.35 10.49 Favored Glycine 0 N--CA 1.446 -0.682 0 CA-C-N 114.805 -1.089 . . . . 0.0 111.044 178.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -89.25 -31.29 17.95 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.573 ' HA ' HD23 ' A' ' 10' ' ' LEU . 4.4 t -62.79 -33.56 75.45 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-N 115.967 -0.561 . . . . 0.0 110.359 179.256 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.9 t -88.66 -40.5 13.25 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.796 179.747 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.537 HD23 ' O ' ' A' ' 5' ' ' GLY . 1.4 mm? -56.24 -39.49 72.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.154 -179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.573 HD23 ' HA ' ' A' ' 7' ' ' SER . 3.4 pp -57.67 -28.89 64.18 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.03 -179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.413 HD12 ' HG2' ' A' ' 15' ' ' GLU . 0.1 OUTLIER -57.97 -28.7 64.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.013 -179.954 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 11.2 mp -58.35 -29.28 65.83 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.963 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.5 m -57.66 -30.34 65.35 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.92 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 5.6 m -98.57 -31.35 12.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.916 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . 0.413 ' HG2' HD12 ' A' ' 11' ' ' LEU . 79.9 mm-40 -66.18 -34.7 78.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.905 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.605 ' O ' HG22 ' A' ' 16' ' ' ILE . 23.4 mt -91.55 12.06 2.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.546 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -106.69 26.77 9.58 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 121.063 0.458 . . . . 0.0 110.916 179.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.425 ' CB ' ' CD ' ' A' ' 19' ' ' PRO . 0.4 OUTLIER -74.24 -62.68 0.98 Allowed Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.033 -179.948 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.425 ' CD ' ' CB ' ' A' ' 18' ' ' LEU . 33.3 Cg_endo -66.03 -56.03 0.34 Allowed 'Trans proline' 0 C--N 1.346 0.436 0 C-N-CA 122.322 2.014 . . . . 0.0 112.409 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.564 ' O ' HG12 ' A' ' 20' ' ' VAL . 13.4 t 59.76 31.21 0.14 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.043 179.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 60.38 80.3 0.21 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.856 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -110.68 -174.75 2.55 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.865 -179.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 4.4 tmt_? -134.61 86.5 2.27 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.92 179.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.157 -0.474 . . . . 0.0 111.111 179.985 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.7 ptm . . . . . 0 N--CA 1.486 1.359 0 CA-C-O 120.807 0.336 . . . . 0.0 111.248 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.527 ' HB1' ' HD2' ' A' ' 3' ' ' PRO . . . -166.66 160.05 11.65 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 0.0 111.102 -179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.527 ' HD2' ' HB1' ' A' ' 2' ' ' ALA . 55.8 Cg_endo -70.1 151.84 67.28 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 122.534 2.156 . . . . 0.0 112.354 179.968 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -82.09 4.74 21.92 Favored 'General case' 0 CA--C 1.516 -0.359 0 CA-C-O 121.499 0.666 . . . . 0.0 111.599 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -75.74 -51.9 6.82 Favored Glycine 0 N--CA 1.444 -0.779 0 CA-C-N 114.778 -1.101 . . . . 0.0 111.024 178.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.92 -34.94 19.2 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 109.572 -0.529 . . . . 0.0 109.572 178.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 8.5 t -59.91 -42.16 93.25 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.396 179.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 51.8 t -80.73 -37.23 30.93 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.707 179.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.3 tp -53.64 -31.16 46.24 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.066 179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 33.9 mt -54.89 -75.77 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.035 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' A' ' 11' ' ' LEU . 4.4 mm? -66.06 -29.17 69.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.036 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.525 ' HG ' HD12 ' A' ' 16' ' ' ILE . 2.5 tp -59.55 -30.95 68.98 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.9 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.464 ' O ' HG22 ' A' ' 13' ' ' THR . 5.8 m -98.14 28.02 4.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.891 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.5 m -135.96 -46.27 0.65 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.933 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -80.6 -27.06 37.48 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.958 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.607 ' O ' HG22 ' A' ' 16' ' ' ILE . 21.4 mt -91.23 13.25 1.86 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.616 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.687 ' O ' HG13 ' A' ' 20' ' ' VAL . 3.0 t0 -97.43 26.98 4.5 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 121.061 0.458 . . . . 0.0 111.038 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.513 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 28.1 tp -66.63 -56.77 13.76 Favored Pre-proline 0 C--N 1.324 -0.508 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.188 -179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.513 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 21.0 Cg_endo -61.42 -55.13 1.31 Allowed 'Trans proline' 0 C--N 1.348 0.549 0 C-N-CA 122.302 2.001 . . . . 0.0 112.256 -179.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.687 HG13 ' O ' ' A' ' 17' ' ' ASP . 6.3 m 43.18 77.65 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.616 -179.744 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 69.19 103.66 0.06 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.936 -179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . 0.475 ' NH1' ' HB3' ' A' ' 24' ' ' ALA . 35.3 ttp85 -148.11 -63.58 0.26 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.861 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 11.4 mtm105 59.58 104.62 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.935 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.475 ' HB3' ' NH1' ' A' ' 22' ' ' ARG . . . . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.113 -179.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.487 1.376 0 CA-C-O 120.844 0.354 . . . . 0.0 111.18 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.31 89.54 5.9 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.164 -0.471 . . . . 0.0 111.107 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -68.32 161.32 45.24 Favored 'Trans proline' 0 C--O 1.234 0.316 0 C-N-CA 122.556 2.17 . . . . 0.0 112.312 -179.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -80.97 2.52 26.51 Favored 'General case' 0 CA--C 1.517 -0.307 0 CA-C-O 121.552 0.691 . . . . 0.0 111.584 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.487 ' O ' HD12 ' A' ' 9' ' ' LEU . . . -78.28 -44.86 10.65 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.092 178.73 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 15.8 t80 -86.65 -32.92 20.29 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . 0.483 ' HA ' HD23 ' A' ' 10' ' ' LEU . 1.6 t -62.62 -39.82 95.0 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.588 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 36.4 m -85.58 -33.08 21.78 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.321 -0.399 . . . . 0.0 110.94 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.487 HD12 ' O ' ' A' ' 5' ' ' GLY . 8.9 mt -60.27 -38.45 83.57 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.183 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.85 ' O ' HG22 ' A' ' 13' ' ' THR . 2.9 pp -58.23 -27.1 63.64 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.167 -179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 15.9 mt -75.37 -25.29 57.56 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.382 -0.372 . . . . 0.0 111.18 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.721 HD23 HG12 ' A' ' 16' ' ' ILE . 0.3 OUTLIER -57.05 -42.23 80.13 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.125 -179.929 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.85 HG22 ' O ' ' A' ' 10' ' ' LEU . 13.2 t -55.83 -28.42 56.25 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.074 -179.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 17.7 t -82.56 -45.78 14.19 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.962 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 68.2 mm-40 -62.51 -50.91 69.51 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.024 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.721 HG12 HD23 ' A' ' 12' ' ' LEU . 38.1 mm -58.47 -21.76 18.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.239 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -98.16 26.54 5.24 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-O 121.055 0.455 . . . . 0.0 111.125 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.495 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 42.6 tp -71.11 -57.56 4.68 Favored Pre-proline 0 C--N 1.324 -0.515 0 CA-C-N 115.758 -0.656 . . . . 0.0 111.253 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 24.3 Cg_endo -62.16 -53.78 1.8 Allowed 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 122.32 2.014 . . . . 0.0 112.334 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.569 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.5 t -92.5 33.08 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.369 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.39 -179.83 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.1 pttt -57.46 -38.18 74.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.892 179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 21.4 mtm-85 -135.62 -56.46 0.79 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.864 -179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 3.4 tpt180 -152.35 147.3 26.16 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.956 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.049 179.903 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.0 mmt . . . . . 0 N--CA 1.486 1.367 0 CA-C-O 120.85 0.357 . . . . 0.0 111.228 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -128.6 149.38 71.72 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.085 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 58.5 Cg_endo -71.68 153.6 59.53 Favored 'Trans proline' 0 C--N 1.344 0.296 0 C-N-CA 122.619 2.213 . . . . 0.0 112.258 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 1.9 ttt180 -81.14 2.47 27.37 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-O 121.609 0.719 . . . . 0.0 111.68 179.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . 0.401 ' O ' HD12 ' A' ' 9' ' ' LEU . . . -79.53 -46.94 7.65 Favored Glycine 0 N--CA 1.445 -0.763 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.227 178.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . . . . . . . . . 16.5 t80 -84.38 -34.21 23.64 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.7 -0.481 . . . . 0.0 109.7 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 34.8 t -61.42 -46.87 88.31 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.491 179.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 56.4 m -76.47 -35.4 58.45 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.88 179.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.401 HD12 ' O ' ' A' ' 5' ' ' GLY . 11.8 mt -60.14 -56.41 21.89 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.952 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.422 HD12 ' C ' ' A' ' 10' ' ' LEU . 3.8 pp -58.97 -32.03 69.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.002 -179.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.52 -47.66 85.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.983 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 6.6 mp -85.67 -31.97 22.23 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.957 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 88.7 m -66.06 -27.87 68.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.026 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 19.6 p -97.55 -30.63 12.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.039 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -74.4 -30.32 61.89 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.165 -0.471 . . . . 0.0 110.999 -179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 18.1 mt -96.51 -31.72 4.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.226 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -99.44 27.86 4.97 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.103 0.478 . . . . 0.0 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.473 ' N ' ' HD2' ' A' ' 19' ' ' PRO . 23.8 tp -66.24 -58.85 9.65 Favored Pre-proline 0 C--N 1.324 -0.504 0 CA-C-N 115.718 -0.674 . . . . 0.0 111.102 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.473 ' HD2' ' N ' ' A' ' 18' ' ' LEU . 27.5 Cg_endo -63.22 -55.56 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.468 0 C-N-CA 122.301 2.001 . . . . 0.0 112.424 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.594 ' O ' HG12 ' A' ' 20' ' ' VAL . 15.9 t 67.67 15.48 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.364 -179.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 3.1 pttm 176.2 156.66 0.24 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.825 0.345 . . . . 0.0 110.77 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -152.55 -64.14 0.16 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.863 -179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -164.12 -71.0 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.91 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.173 179.942 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.796 0.331 . . . . 0.0 111.219 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -141.67 88.24 9.74 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-N 116.159 -0.473 . . . . 0.0 111.051 -179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.64 153.62 69.27 Favored 'Trans proline' 0 C--N 1.344 0.305 0 C-N-CA 122.514 2.142 . . . . 0.0 112.39 179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.39 2.29 13.98 Favored 'General case' 0 CA--C 1.517 -0.298 0 CA-C-O 121.469 0.652 . . . . 0.0 112.436 -179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -78.42 -48.51 7.34 Favored Glycine 0 N--CA 1.445 -0.7 0 CA-C-N 114.97 -1.014 . . . . 0.0 111.533 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.439 ' O ' HD23 ' A' ' 10' ' ' LEU . 12.2 t80 -85.36 -31.5 22.93 Favored 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.11 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 48.1 t -66.93 -41.2 87.43 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.735 179.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 99.6 m -80.98 -34.76 32.83 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.927 179.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 58.5 tp -58.39 -52.97 63.37 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.061 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.439 HD23 ' O ' ' A' ' 6' ' ' PHE . 3.8 pp -59.31 -30.66 68.5 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.979 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.425 HD23 ' HA ' ' A' ' 11' ' ' LEU . 28.6 mt -74.71 -30.93 61.7 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.961 -179.985 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.443 ' O ' HD12 ' A' ' 16' ' ' ILE . 0.4 OUTLIER -60.06 -52.36 65.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.949 -179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.9 t -58.32 -29.24 65.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.979 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 11.6 t -82.98 -43.6 16.21 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.938 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 2.1 mm-40 -65.0 -39.8 93.99 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.95 -179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.443 HD12 ' O ' ' A' ' 12' ' ' LEU . 9.0 mt -71.02 -19.67 21.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.392 -179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -97.8 26.83 4.81 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.075 0.464 . . . . 0.0 111.075 -179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.445 ' HB3' ' HD3' ' A' ' 19' ' ' PRO . 8.9 tp -82.92 -50.01 0.74 Allowed Pre-proline 0 C--N 1.324 -0.501 0 CA-C-N 115.74 -0.664 . . . . 0.0 111.345 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' PRO . . . . . 0.445 ' HD3' ' HB3' ' A' ' 18' ' ' LEU . 73.7 Cg_endo -79.79 -50.15 0.06 OUTLIER 'Trans proline' 0 C--N 1.347 0.475 0 C-N-CA 122.434 2.089 . . . . 0.0 112.509 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.579 ' O ' HG12 ' A' ' 20' ' ' VAL . 14.1 t -93.68 32.56 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.379 -179.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.65 -33.76 75.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.899 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ARG . . . . . . . . . . . . . 3.0 mmm180 -94.39 46.05 1.14 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.879 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -170.86 160.29 6.69 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.243 -0.435 . . . . 0.0 110.951 179.906 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.152 -179.991 . . . . . . . . 0 0 . 1 stop_ save_