data_1u4a_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 1u4a _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 ' 15' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.767 0.318 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -142.22 146.14 34.88 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.5 pt -93.27 125.63 45.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.055 0.455 . . . . 0.0 111.208 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -94.18 89.37 5.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.836 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.25 123.68 34.24 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.25 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.85 93.18 4.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.261 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 31.9 t -85.52 125.34 40.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.17 -179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.73 117.07 33.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.953 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.67 149.75 27.42 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.634 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -19.59 54.15 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.06 31.84 0.96 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.24 41.07 94.69 Favored Glycine 0 C--N 1.338 0.655 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.846 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.2 t -115.67 127.32 55.09 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.607 0.242 . . . . 0.0 111.094 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.3 m -117.09 115.29 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.118 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.2 t -136.95 134.23 48.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.248 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -105.56 154.64 20.1 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.159 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -135.78 146.18 47.33 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -119.02 111.94 18.94 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.144 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.1 pt -145.86 178.87 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.2 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.4 159.98 18.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.729 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.86 31.86 2.54 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.331 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.31 31.6 5.01 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.127 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.18 157.96 42.04 Favored Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.844 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.83 163.27 39.71 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.63 2.22 . . . . 0.0 112.645 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.1 mt -66.15 -12.98 59.36 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.832 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 61.8 m -51.29 -33.81 30.39 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.524 0.202 . . . . 0.0 111.26 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -56.43 5.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.559 -0.292 . . . . 0.0 110.958 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.81 -46.61 88.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.094 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.426 ' HE2' HG13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -58.9 -48.7 80.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.77 -54.28 44.56 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.79 -34.71 67.91 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.462 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.472 ' CE1' HG13 ' A' ' 85' ' ' VAL . 39.4 t80 -74.65 -54.85 6.64 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.978 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.5 t -59.8 -41.24 90.77 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.295 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -68.51 -37.06 79.72 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.317 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.65 -39.67 44.3 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.521 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -67.11 -64.91 0.76 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.348 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.39 46.96 0.05 OUTLIER Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.063 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 mt -122.25 -161.39 0.93 Allowed 'General case' 0 C--O 1.234 0.253 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.59 166.92 14.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.915 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 68.7 mtp -96.08 24.51 5.54 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.308 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -136.7 12.85 3.18 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.458 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -160.84 78.12 0.6 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.121 0.486 . . . . 0.0 110.334 179.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.426 HG13 ' HE2' ' A' ' 43' ' ' MET . 11.8 mm -141.94 156.86 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.037 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -156.89 116.28 3.42 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.944 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -95.8 123.6 39.44 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.721 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -106.53 117.86 35.15 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.253 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -121.6 101.98 7.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.345 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.9 38.75 29.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 76.84 25.35 64.9 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.102 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -125.51 91.11 49.39 Favored Pre-proline 0 C--O 1.233 0.19 0 CA-C-N 116.859 0.329 . . . . 0.0 110.737 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 115.82 2.63 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.01 2.474 . . . . 0.0 112.32 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 18.1 pt -117.51 140.92 38.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.341 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -90.44 172.73 8.52 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.752 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.79 -20.11 65.88 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.393 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 21.7 p -85.93 28.06 0.83 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.34 168.02 16.0 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.658 0.266 . . . . 0.0 111.149 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.01 -57.85 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.253 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -47.16 -50.28 11.35 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.624 2.216 . . . . 0.0 113.009 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.96 -45.41 85.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.792 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -60.87 -31.73 71.19 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.189 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 tt -75.96 -37.22 58.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.807 0.337 . . . . 0.0 110.347 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.79 -33.87 70.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.03 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 16.1 mtt -64.6 169.56 4.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.396 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -111.71 -54.68 2.59 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.989 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -175.01 -48.46 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.432 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -84.92 93.31 8.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.997 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -141.14 138.25 33.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.903 0.383 . . . . 0.0 111.366 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.87 142.23 39.78 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.22 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.34 167.84 24.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.665 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -133.62 108.49 8.6 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.566 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.472 HG13 ' CE1' ' A' ' 46' ' ' TYR . 13.0 p -82.15 121.92 36.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.042 0.449 . . . . 0.0 111.203 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -123.14 167.45 13.67 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.319 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 . . . . . 0 CA--C 1.533 0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.733 -179.816 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.746 0.308 . . . . 0.0 110.638 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 m80 -135.83 158.79 43.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.049 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.5 pt -96.63 124.63 49.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.272 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -89.17 91.01 8.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.465 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -107.43 124.23 49.56 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.282 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.7 mttt -90.6 116.37 28.44 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.687 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.5 t -101.03 112.34 33.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.102 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.84 124.05 44.72 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.183 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.08 139.2 20.27 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.511 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -58.61 -30.64 67.39 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.11 -32.26 67.95 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.56 0.219 . . . . 0.0 111.536 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 125.25 45.03 0.26 Allowed Glycine 0 C--N 1.334 0.422 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.461 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.7 m -140.41 160.67 39.47 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.623 0.249 . . . . 0.0 110.89 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -140.76 114.14 5.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 120.818 0.342 . . . . 0.0 111.158 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 t -113.67 140.59 33.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.259 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -90.15 113.46 25.22 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.902 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.37 160.53 25.22 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 pttm -154.08 148.56 26.17 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.388 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 24.7 pt -146.91 178.04 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.321 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.43 148.38 25.01 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.419 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -82.95 55.64 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.962 0.41 . . . . 0.0 111.055 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m170 -156.93 31.29 0.3 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.955 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.43 150.78 25.89 Favored Pre-proline 0 N--CA 1.463 0.218 0 CA-C-O 120.625 0.25 . . . . 0.0 111.32 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.04 174.22 10.07 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.082 2.522 . . . . 0.0 112.794 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.5 mt -61.21 -24.77 66.58 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.7 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 -36.46 64.89 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.527 0.203 . . . . 0.0 110.763 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -46.63 84.78 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.541 179.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.48 -51.71 53.86 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.433 ' HG3' ' CE1' ' A' ' 59' ' ' PHE . 5.4 ttp -60.28 -35.97 76.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.624 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -62.89 -58.89 5.83 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.585 0.231 . . . . 0.0 110.777 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.23 88.88 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.431 ' CE2' HG12 ' A' ' 85' ' ' VAL . 77.1 t80 -66.36 -37.43 85.3 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.419 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -80.66 -31.38 36.43 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.0 -55.95 4.75 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.95 -33.19 62.07 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.599 0.238 . . . . 0.0 111.372 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 3.7 tt0 -74.62 -54.82 6.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.274 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.25 -6.26 3.05 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.907 -0.663 . . . . 0.0 113.063 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.5 mt -71.45 -167.72 0.27 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.923 0.392 . . . . 0.0 110.753 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.7 m -116.1 159.53 21.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.56 29.73 2.2 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.49 6.67 4.12 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -160.79 77.7 0.59 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 110.427 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 5.8 mm -147.21 155.99 10.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.726 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -159.59 154.91 25.36 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.213 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.433 ' CE1' ' HG3' ' A' ' 43' ' ' MET . 3.4 m-85 -120.48 155.49 33.46 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.974 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.57 119.42 10.58 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.433 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 71.8 t80 -105.6 98.89 8.52 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.239 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 54.95 39.08 31.43 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 111.162 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.17 22.75 43.56 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.102 -0.571 . . . . 0.0 113.161 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 3.3 mt-30 -115.01 92.85 32.54 Favored Pre-proline 0 C--O 1.233 0.196 0 CA-C-N 116.991 0.396 . . . . 0.0 110.659 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.98 113.48 1.35 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.887 2.391 . . . . 0.0 111.99 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.5 pt -116.7 143.93 25.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.953 0.406 . . . . 0.0 111.461 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -92.7 170.35 9.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.076 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.51 -3.19 32.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.688 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 20.9 p -96.21 18.13 14.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -72.92 160.09 32.68 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.08 -55.49 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.54 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.25 -50.23 14.58 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 122.394 2.063 . . . . 0.0 112.958 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.82 86.73 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.936 0.398 . . . . 0.0 110.755 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -27.11 68.68 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.4 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.4 -34.37 41.92 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.559 0.218 . . . . 0.0 110.565 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -65.4 -47.89 74.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.878 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.93 114.21 27.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.73 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.73 69.68 0.87 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.869 0.366 . . . . 0.0 111.794 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -172.63 -69.38 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.963 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -143.07 92.2 2.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.6 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -139.64 146.4 39.68 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.996 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 71.2 p -119.41 147.67 44.11 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.628 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.2 167.06 27.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.813 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -116.14 97.74 6.23 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.489 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.431 HG12 ' CE2' ' A' ' 46' ' ' TYR . 11.0 p -81.38 114.28 22.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 121.269 0.557 . . . . 0.0 111.504 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -98.8 131.44 44.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.667 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 . . . . . 0 CA--C 1.534 0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 179.636 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.825 0.345 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -153.89 125.53 7.63 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.755 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.3 pt -80.95 129.87 36.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 111.234 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -89.74 113.42 24.94 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.289 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.8 mp -122.83 133.2 54.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.257 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.406 ' HB2' HG21 ' A' ' 82' ' ' THR . 0.0 OUTLIER -101.62 112.93 25.65 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.45 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.3 t -90.5 124.4 43.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.07 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.7 115.48 30.32 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.74 149.82 32.04 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.691 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -54.56 -33.5 60.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.416 0.287 . . . . 0.0 111.552 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.45 32.3 2.04 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.75 53.67 15.02 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.966 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -107.29 101.18 10.58 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.545 0.212 . . . . 0.0 110.891 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -97.63 109.25 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 120.735 0.302 . . . . 0.0 111.344 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 t -139.78 151.99 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.51 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -112.47 147.55 36.29 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.316 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -142.62 137.94 30.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.106 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -110.11 116.21 31.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.869 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.7 pt -133.95 178.45 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.485 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.99 156.48 16.3 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.821 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.48 39.62 1.03 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.39 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -147.17 33.39 0.9 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.74 0.305 . . . . 0.0 111.133 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -142.07 155.41 65.33 Favored Pre-proline 0 C--O 1.232 0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.828 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.429 ' HA ' ' O ' ' A' ' 70' ' ' ASP . 54.8 Cg_endo -69.13 165.97 28.42 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.526 2.151 . . . . 0.0 112.243 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.21 -24.39 58.99 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.429 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 24.7 p -53.39 -32.89 51.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.362 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.57 -58.96 5.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.824 -0.171 . . . . 0.0 110.694 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.63 -39.6 91.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.636 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.6 -43.1 85.76 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.352 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -63.51 -38.67 92.01 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.767 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.19 -34.2 61.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.579 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.452 ' CE1' HG13 ' A' ' 85' ' ' VAL . 53.5 t80 -80.86 -37.11 30.48 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 t -79.39 -41.08 28.56 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -72.67 -45.05 60.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.733 -0.212 . . . . 0.0 111.519 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -62.22 -35.65 79.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.299 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 0.419 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 1.9 tt0 -75.47 -66.86 0.72 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.078 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.16 46.21 0.11 Allowed Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.188 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 13.7 mt -112.2 -154.38 0.54 Allowed 'General case' 0 C--O 1.233 0.198 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.6 166.1 10.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.946 0.403 . . . . 0.0 111.284 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.64 -36.75 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.221 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.9 28.53 2.69 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.69 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.428 ' C ' HG12 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -160.67 77.56 0.6 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.104 0.478 . . . . 0.0 110.28 178.854 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.428 HG12 ' C ' ' A' ' 56' ' ' GLN . 10.0 mm -152.02 158.64 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.511 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -156.64 129.95 8.05 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.957 0.408 . . . . 0.0 111.21 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -106.4 136.99 45.19 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.655 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -113.47 121.32 43.94 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.256 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -113.61 89.07 2.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.99 39.09 31.48 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.05 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.88 23.19 39.47 Favored Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.081 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -119.82 92.68 46.85 Favored Pre-proline 0 C--O 1.233 0.216 0 CA-C-N 116.976 0.388 . . . . 0.0 110.603 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.09 106.82 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.957 2.438 . . . . 0.0 112.25 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.3 pt -111.47 133.41 57.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.374 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -87.68 177.04 7.15 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.429 ' O ' ' HB3' ' A' ' 40' ' ' SER . 1.2 pm0 -83.49 23.74 0.91 Allowed 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.9 p -126.6 13.97 7.55 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 122.508 -0.12 . . . . 0.0 111.284 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 1.0 OUTLIER -73.44 175.78 6.67 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.649 0.261 . . . . 0.0 111.297 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.43 -55.19 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.351 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -49.6 -50.18 13.79 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 122.39 2.06 . . . . 0.0 113.16 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.01 -44.86 87.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.67 0.271 . . . . 0.0 110.86 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -39.51 75.47 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 tt -81.88 -33.22 30.64 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.002 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.51 -29.88 62.37 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.361 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.3 mtt -62.77 170.96 2.31 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.249 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -117.34 -51.49 2.52 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.253 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.07 -56.36 0.02 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 120.657 0.265 . . . . 0.0 111.032 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -83.1 107.68 15.84 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.66 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.44 157.6 43.21 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.266 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' THR . . . . . 0.406 HG21 ' HB2' ' A' ' 20' ' ' LYS . 21.9 p -146.09 149.04 33.3 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.377 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.2 pp -144.26 160.57 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.967 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.61 106.8 14.95 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.452 HG13 ' CE1' ' A' ' 46' ' ' TYR . 9.6 p -79.91 114.99 21.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.126 0.489 . . . . 0.0 110.996 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -110.7 169.38 8.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.973 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 . . . . . 0 N--CA 1.465 0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.348 -179.882 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 120.76 0.314 . . . . 0.0 111.05 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -141.33 164.71 29.52 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.039 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.3 pt -105.71 124.55 60.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.417 . . . . 0.0 111.202 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -85.57 122.73 30.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mp -119.44 134.17 55.35 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.366 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -104.91 94.01 5.03 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.456 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.4 t -83.45 112.11 20.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.156 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.24 112.42 25.44 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.053 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.95 128.57 8.58 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.398 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -57.1 -36.0 70.11 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.509 0.195 . . . . 0.0 111.197 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -62.31 -30.54 71.22 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.132 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.53 57.47 0.19 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.581 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -149.76 107.57 3.69 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.709 0.29 . . . . 0.0 111.041 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.2 p -107.99 123.39 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.231 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.1 t -139.96 138.72 37.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.111 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -92.55 130.67 38.14 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.9 158.93 22.25 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.13 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 mtpm? -132.35 94.8 3.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.955 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.2 pt -115.27 179.43 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.25 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.9 166.55 11.73 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.838 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.0 33.2 1.36 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.148 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -145.3 28.71 1.19 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.12 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.6 p -135.58 131.25 19.23 Favored Pre-proline 0 C--O 1.231 0.131 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -56.77 164.68 5.66 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.654 2.236 . . . . 0.0 112.509 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.8 mt -55.54 -23.47 26.81 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.307 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.4 p -52.44 -42.57 64.26 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.04 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -49.41 77.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 110.772 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.58 -48.59 71.85 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.635 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -50.87 71.73 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.243 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -57.47 -56.01 27.35 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.814 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.07 87.76 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -62.79 -51.64 66.31 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.224 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 97.1 p -63.31 -44.05 96.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -65.37 -37.17 86.2 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.955 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -74.25 -41.1 61.83 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.267 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -67.12 0.68 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.285 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 147.53 45.97 0.03 OUTLIER Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.202 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.62 -163.42 1.28 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.743 0.306 . . . . 0.0 110.644 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 m -138.39 174.57 10.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.004 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.0 ttp -96.32 30.3 2.56 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.007 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -115.97 -5.58 11.99 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.71 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -160.23 78.02 0.65 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.219 0.533 . . . . 0.0 110.156 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 15.5 mm -142.31 157.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.76 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 -153.6 117.07 4.64 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.023 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -98.95 143.31 29.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.343 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -133.75 134.57 43.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.344 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -117.6 104.98 11.57 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.401 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.58 37.05 25.44 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.012 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 82.6 25.37 50.67 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 121.02 -0.61 . . . . 0.0 113.042 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -119.77 101.43 48.12 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.803 0.302 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.32 122.06 10.54 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.99 2.46 . . . . 0.0 112.74 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 15.0 pt -138.24 154.95 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.228 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 36.9 m-20 -95.06 178.79 5.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.593 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.87 28.85 0.57 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.429 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 41.8 p -120.38 6.24 10.66 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -62.02 163.14 8.25 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.863 0.363 . . . . 0.0 111.462 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -166.04 -56.72 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.212 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.27 -42.17 40.82 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 122.509 2.14 . . . . 0.0 112.728 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.76 -41.3 65.25 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.582 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -58.19 -37.57 75.02 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.22 -31.29 49.26 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.737 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -58.97 -34.48 71.85 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 17.7 mmt -66.62 173.67 3.29 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.324 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -126.19 -52.35 1.52 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.22 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -148.94 -58.09 0.21 Allowed 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.307 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -80.69 121.68 26.18 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.102 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -151.89 109.24 3.58 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.905 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -100.16 137.16 38.99 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -142.82 162.43 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.337 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -129.36 112.75 14.16 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.983 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.7 p -82.66 101.38 7.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.236 0.541 . . . . 0.0 110.778 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -89.82 164.46 14.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.123 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 mm-40 . . . . . 0 C--N 1.332 -0.18 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.969 179.972 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.463 0.184 0 CA-C-O 120.816 0.341 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -156.31 109.94 2.71 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.661 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 21.3 pt -81.95 130.1 36.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 111.31 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -92.31 132.16 36.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.456 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.9 mp -137.94 132.07 31.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.082 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.66 100.47 11.17 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.487 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.72 117.76 29.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.323 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.89 115.97 26.01 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . 0.423 ' HA2' HG12 ' A' ' 85' ' ' VAL . . . -81.17 143.72 24.18 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.824 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -60.23 -27.65 67.38 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.62 39.1 1.03 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.71 93.44 0.04 OUTLIER Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.588 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 62.1 p -168.44 161.68 11.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.802 0.334 . . . . 0.0 111.538 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.3 p -152.27 109.65 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.14 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.7 t -137.62 135.28 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.222 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -104.71 139.62 39.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.118 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -128.72 153.12 47.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.196 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -129.46 124.14 33.31 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.904 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.3 pt -140.47 177.02 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.61 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 152.6 34.82 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.198 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -88.32 55.53 3.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 111.16 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.03 40.89 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.934 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.2 t -149.33 142.59 16.09 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.032 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.37 167.78 22.93 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.795 2.33 . . . . 0.0 112.613 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.4 mt -66.51 -12.83 59.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.851 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.3 t -53.97 -36.23 62.65 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.605 0.24 . . . . 0.0 111.285 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -39.09 24.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.374 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 20.3 tp -68.23 -40.9 81.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.76 0.314 . . . . 0.0 110.547 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.472 ' HG3' ' CD1' ' A' ' 59' ' ' PHE . 2.0 ttm -67.14 -34.39 77.49 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.19 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -69.93 -47.8 60.98 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.635 0.255 . . . . 0.0 110.828 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.89 97.86 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.263 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -59.99 -44.52 94.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -38.82 88.34 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.119 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.96 -38.83 61.61 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.603 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.03 -46.6 73.93 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -68.35 -64.6 0.83 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.528 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 146.77 47.0 0.03 OUTLIER Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.267 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.6 mt -127.33 -161.0 1.04 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.96 157.89 28.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.769 0.318 . . . . 0.0 110.954 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.8 mtm -97.62 29.51 3.3 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -127.24 4.74 6.36 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.628 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.69 77.75 0.6 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.147 0.499 . . . . 0.0 110.314 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 11.4 mm -147.12 158.96 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.663 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.7 ptp85 -154.92 145.45 22.21 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.239 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.472 ' CD1' ' HG3' ' A' ' 43' ' ' MET . 2.8 m-85 -117.28 164.78 14.3 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.006 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -148.96 119.77 7.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -91.43 94.77 9.64 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.453 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 56.23 39.73 30.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 85.92 21.37 53.17 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.336 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -108.79 114.87 58.17 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.97 0.385 . . . . 0.0 110.373 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.96 96.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.825 2.35 . . . . 0.0 112.329 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 10.7 pt -114.32 133.75 59.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.272 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -90.66 176.25 6.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.935 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -15.88 63.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.509 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 6.6 p -89.42 32.74 0.84 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.563 0.22 . . . . 0.0 111.543 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.25 155.7 37.99 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-O 120.484 0.183 . . . . 0.0 110.793 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -166.0 -57.15 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.376 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.434 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -46.67 -53.66 5.85 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.48 2.12 . . . . 0.0 113.152 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.34 96.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.757 0.313 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.42 -32.07 70.99 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.137 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.99 -33.2 51.46 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.688 0.28 . . . . 0.0 110.537 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -41.34 85.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.766 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -177.3 1.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.227 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -148.35 -59.21 0.24 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.415 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -136.85 23.34 3.09 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -166.14 93.71 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.788 0.328 . . . . 0.0 111.346 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -121.34 109.22 14.64 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.67 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.2 p -91.81 125.4 36.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.398 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.49 146.31 19.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.389 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -109.25 107.3 17.48 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.91 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.423 HG12 ' HA2' ' A' ' 23' ' ' GLY . 9.0 p -80.79 112.84 19.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 121.243 0.544 . . . . 0.0 111.159 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -96.47 158.86 15.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.954 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.189 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.731 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.602 0.239 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -139.36 129.66 25.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.134 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.8 pt -80.29 126.51 39.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.118 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -85.94 106.21 16.97 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.348 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.23 125.23 50.75 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.416 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -93.17 90.27 6.78 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.138 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 18.8 t -81.52 100.16 5.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.152 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.27 111.93 24.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.18 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.24 146.31 27.6 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.455 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.04 55.76 1.86 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 111.064 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -178.14 41.17 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.276 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.72 73.79 0.61 Allowed Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.073 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.4 p -166.53 106.22 0.64 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.761 0.281 . . . . 0.0 111.43 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -122.52 108.48 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.944 0.402 . . . . 0.0 111.302 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.1 t -121.01 149.93 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.316 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.96 113.85 26.91 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.159 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.78 150.32 24.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.05 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 mttp -130.74 124.62 31.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.41 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 pt -145.85 -180.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.395 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.13 152.43 34.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.114 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.07 59.49 2.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -168.62 39.84 0.03 OUTLIER 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.677 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 t -151.27 145.01 17.56 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.021 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.34 163.92 24.86 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.99 2.46 . . . . 0.0 112.509 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.3 mt -56.61 -27.45 58.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.046 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.3 p -51.66 -36.35 45.91 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -58.48 -63.46 1.27 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.556 0.217 . . . . 0.0 110.927 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 pp -65.53 -29.42 70.06 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.867 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.5 mmt -59.21 -49.06 79.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.607 0.241 . . . . 0.0 110.618 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -66.57 -39.1 88.32 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.876 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.33 -45.77 68.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.506 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -61.86 -47.04 86.8 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.3 p -62.08 -37.73 86.12 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.748 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.01 -38.9 56.76 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.412 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.65 64.69 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -73.45 -70.19 0.38 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.714 0.292 . . . . 0.0 111.514 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 156.05 46.09 0.02 OUTLIER Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.068 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 mt -119.43 -159.92 0.79 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -128.32 161.36 29.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.85 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.08 27.81 3.47 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.121 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -131.09 8.49 4.75 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.21 77.71 0.64 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.251 0.548 . . . . 0.0 110.08 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 10.8 mm -144.8 158.39 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.636 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 26.2 ttt85 -149.53 141.71 24.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -119.29 160.7 21.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.894 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -146.17 109.99 4.89 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.464 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -89.27 101.91 14.58 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.118 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 t0 53.13 40.61 31.51 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.979 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 99.39 -35.15 4.89 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.961 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.44 112.77 14.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.658 0.229 . . . . 0.0 111.269 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.2 144.45 37.31 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.74 2.293 . . . . 0.0 112.873 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.447 HG22 HD13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -144.94 173.87 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 179.593 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -109.16 178.52 4.43 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.456 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.82 -12.78 61.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.431 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.8 p -89.79 28.32 1.37 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -76.15 169.04 18.94 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.647 0.26 . . . . 0.0 111.183 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.3 -54.82 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.367 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.89 -53.31 5.86 Favored 'Trans proline' 0 C--N 1.358 1.033 0 C-N-CA 122.669 2.246 . . . . 0.0 113.242 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.484 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . . . -61.3 -35.45 77.38 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.12 0.486 . . . . 0.0 110.647 179.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.49 -26.21 60.8 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.477 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.94 -36.61 19.76 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.621 0.248 . . . . 0.0 110.976 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . 0.484 ' HG2' ' HA ' ' A' ' 73' ' ' ALA . 11.5 pt-20 -66.23 -34.53 78.22 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.991 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.28 178.18 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.822 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -136.48 -64.54 0.59 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -134.24 -48.17 0.78 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.318 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -92.76 114.37 26.91 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.691 0.281 . . . . 0.0 111.418 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -138.8 137.83 37.01 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -123.33 130.01 52.13 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.48 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.2 pp -147.84 152.43 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.145 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.23 111.54 22.67 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.122 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.7 p -82.62 111.8 19.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.253 0.549 . . . . 0.0 111.369 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -97.97 152.27 19.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.015 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 CA--C 1.532 0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.059 179.913 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.811 0.339 . . . . 0.0 111.346 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -152.27 138.44 18.31 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.882 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 25.4 pt -80.91 130.53 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -106.31 111.91 24.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.424 ' CD1' ' HB3' ' A' ' 81' ' ' ASP . 0.4 OUTLIER -124.48 136.4 53.98 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.785 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.4 mttp -97.25 97.4 9.13 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 24.3 t -82.5 108.49 15.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.55 123.56 38.06 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.96 153.27 32.43 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.458 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -28.0 53.55 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -93.59 29.79 1.92 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.43 72.6 0.63 Allowed Glycine 0 C--N 1.337 0.588 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.098 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 m -150.5 92.97 1.91 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.756 0.312 . . . . 0.0 111.245 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.5 p -91.35 113.98 27.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.933 0.397 . . . . 0.0 111.054 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -116.61 138.65 46.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.159 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -86.24 143.93 27.69 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.129 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -138.0 149.3 45.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -135.51 115.7 13.38 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.161 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.2 pt -147.16 -179.83 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.834 0.349 . . . . 0.0 111.559 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.13 151.43 25.73 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.848 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.16 29.16 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.797 0.332 . . . . 0.0 111.517 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -122.44 37.48 4.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.7 t -154.64 142.63 14.19 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.631 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.06 168.83 11.55 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.656 2.237 . . . . 0.0 112.34 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.1 mt -55.0 -24.65 25.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.617 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.5 t -51.72 -39.61 58.72 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -60.16 -54.95 39.84 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.602 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 tp -65.99 -34.15 77.44 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.84 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -61.19 2.8 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.957 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -59.52 -40.74 88.11 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -44.38 89.15 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.667 0.27 . . . . 0.0 111.373 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -65.68 -39.0 90.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.489 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.7 m -79.09 -48.27 14.65 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.358 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -58.69 -37.63 76.48 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.102 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -68.85 -45.05 72.09 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.31 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -66.89 0.58 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.481 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.87 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.038 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.6 mt -120.6 -159.32 0.79 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.7 125.85 48.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.79 0.329 . . . . 0.0 110.91 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.5 -21.27 64.07 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.44 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -90.73 17.98 7.0 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.49 77.9 0.62 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 121.289 0.566 . . . . 0.0 110.438 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 13.5 mm -148.17 158.67 7.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.721 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.7 ttt85 -150.19 142.42 24.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.054 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -117.82 130.77 56.48 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.419 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.1 mmm-85 -116.59 102.31 9.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.784 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -90.44 105.1 17.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.726 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 45.18 43.37 7.78 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.914 0.486 . . . . 0.0 111.906 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . 0.432 ' O ' ' HD3' ' A' ' 65' ' ' PRO . . . 82.86 2.17 90.64 Favored Glycine 0 CA--C 1.526 0.724 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.318 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -99.47 104.55 27.9 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 117.21 0.505 . . . . 0.0 110.842 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.432 ' HD3' ' O ' ' A' ' 63' ' ' GLY . 52.9 Cg_exo -56.02 121.72 10.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.999 2.466 . . . . 0.0 112.366 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.6 pt -131.67 150.32 33.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.603 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.59 165.86 11.34 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.264 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -57.85 -26.1 61.61 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.412 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.87 -14.48 53.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.784 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -53.32 150.63 6.12 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.033 0.444 . . . . 0.0 111.655 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -163.35 -56.27 0.01 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.151 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.52 -52.34 9.23 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 122.46 2.107 . . . . 0.0 112.71 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.99 79.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.992 0.425 . . . . 0.0 110.509 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -69.33 -21.62 63.83 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.432 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.07 -36.95 47.63 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -70.02 -36.38 75.04 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 8.1 mmt -106.76 97.02 6.86 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.328 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.96 67.91 1.37 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.408 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -173.29 -64.07 0.02 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.977 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -135.2 83.22 2.01 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.477 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.424 ' HB3' ' CD1' ' A' ' 19' ' ' LEU . 11.8 t70 -127.07 135.17 50.41 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.878 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 30.2 p -115.98 144.32 44.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.405 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 2.4 pt -141.05 165.13 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.604 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -115.57 104.65 11.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.748 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 13.3 p -80.17 115.5 22.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.168 0.509 . . . . 0.0 111.418 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -109.14 154.2 22.66 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.066 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 . . . . . 0 C--O 1.233 0.189 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.841 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 CA--C 1.531 0.235 0 CA-C-O 120.588 0.232 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.451 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 47.2 m80 -142.88 160.57 40.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.729 0.3 . . . . 0.0 111.21 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 33' ' ' ILE . 6.8 pt -108.14 122.06 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 121.1 0.476 . . . . 0.0 110.98 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -80.33 102.04 9.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.339 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mp -103.57 138.17 40.62 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.873 0.368 . . . . 0.0 111.571 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -96.61 100.04 11.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.237 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 22.4 t -83.39 93.8 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.59 125.23 39.11 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.286 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.77 161.2 17.77 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.593 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -92.32 43.11 1.12 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.944 0.402 . . . . 0.0 110.852 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.92 34.38 0.21 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.4 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.12 56.68 7.65 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.713 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 p -140.83 98.28 3.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.723 0.297 . . . . 0.0 111.185 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.8 m -115.07 92.65 2.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.944 0.402 . . . . 0.0 110.928 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.84 145.69 28.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.321 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -118.2 116.9 27.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -114.72 170.6 8.2 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.451 ' HG2' ' HB2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -110.41 151.99 26.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.419 ' O ' HG12 ' A' ' 17' ' ' ILE . 6.2 tp -158.64 149.0 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.247 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.7 144.84 26.34 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.794 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ptp85 -81.92 57.67 3.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.97 0.414 . . . . 0.0 111.021 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.95 23.73 0.66 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.461 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -162.17 148.93 11.02 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 120.512 0.196 . . . . 0.0 110.764 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.08 161.18 5.28 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.886 2.39 . . . . 0.0 112.59 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.405 ' HG ' ' HB2' ' A' ' 74' ' ' GLN . 11.0 mt -61.28 -17.22 52.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.875 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.05 -37.58 54.12 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.478 0.18 . . . . 0.0 111.082 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -43.01 88.02 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.893 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.8 -47.42 46.62 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.6 tmm? -59.65 -44.51 93.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.252 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -59.5 -49.71 76.71 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.746 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.33 -34.6 78.34 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.491 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -72.5 -53.32 12.4 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.503 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -60.21 -43.72 95.72 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.147 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.27 -42.88 99.38 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.706 0.289 . . . . 0.0 110.827 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.437 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -78.48 -71.99 0.4 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.672 0.273 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.24 45.58 0.02 OUTLIER Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.118 -0.563 . . . . 0.0 112.151 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.4 mt -127.24 -164.94 1.41 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.695 0.283 . . . . 0.0 110.516 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -143.72 176.45 9.23 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.979 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -93.59 28.13 2.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.266 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -118.31 -3.67 10.98 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.48 77.92 0.63 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.192 0.52 . . . . 0.0 110.206 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 11.6 mm -144.98 157.86 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.921 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -141.2 121.98 14.38 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -111.8 127.47 55.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -127.49 103.31 7.28 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.423 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -81.12 101.38 9.59 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.01 35.04 24.85 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.099 -179.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 103.71 -38.14 3.39 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 121.004 -0.617 . . . . 0.0 113.132 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.03 110.61 3.41 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.671 0.235 . . . . 0.0 111.202 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.17 129.5 16.21 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.086 2.524 . . . . 0.0 112.787 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 pp -145.79 163.07 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.494 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -103.86 177.32 4.88 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.854 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -64.73 -17.79 64.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.584 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.3 p -88.81 33.39 0.78 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.46 177.46 8.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.658 0.266 . . . . 0.0 111.312 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -169.89 -54.25 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -47.63 -57.28 2.42 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 122.409 2.073 . . . . 0.0 112.802 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.95 -41.87 97.13 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.78 0.324 . . . . 0.0 110.692 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.405 ' HB2' ' HG ' ' A' ' 39' ' ' LEU . 20.3 tm0? -57.27 -41.42 79.7 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.9 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.3 -32.44 38.05 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.733 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -29.3 60.65 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.923 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.16 173.92 2.25 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.966 0.412 . . . . 0.0 111.283 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -135.2 -49.54 0.74 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.412 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -169.41 -41.72 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.246 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -108.35 106.87 17.21 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.717 0.294 . . . . 0.0 111.02 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -152.94 161.9 41.98 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.199 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.7 t -140.43 156.8 46.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.323 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -143.72 157.99 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.158 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -115.81 92.88 4.04 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.517 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.3 m -83.95 111.3 19.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 111.592 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -99.24 156.4 16.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.103 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 . . . . . 0 N--CA 1.464 0.247 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.145 -179.94 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.785 0.326 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -124.47 116.8 23.1 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.569 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 32' ' ' LYS . 8.1 pt -86.48 117.0 30.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 111.136 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -90.02 92.56 9.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.309 0.576 . . . . 0.0 111.211 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.24 126.71 38.49 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.417 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -84.18 128.45 34.57 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.808 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.8 t -109.94 114.38 46.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.796 0.332 . . . . 0.0 111.334 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -103.0 120.81 41.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.985 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.33 144.7 26.01 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.691 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.2 pm0 -54.98 -33.07 62.19 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -70.0 -25.84 63.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.87 -5.53 6.49 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 121.098 -0.573 . . . . 0.0 113.059 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.1 p -66.85 154.24 41.42 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.536 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -141.13 108.53 2.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.23 146.13 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.168 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -104.32 148.66 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.215 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -148.66 151.08 34.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.083 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 1.6 ptmm? -136.0 134.72 38.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.089 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.7 pt -145.35 178.11 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.365 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.03 139.7 32.34 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.62 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.39 54.74 2.68 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.853 0.359 . . . . 0.0 111.109 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -158.97 32.87 0.21 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -151.92 157.19 34.39 Favored Pre-proline 0 N--CA 1.466 0.358 0 CA-C-O 120.632 0.253 . . . . 0.0 111.142 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.32 163.98 9.46 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.932 2.421 . . . . 0.0 112.775 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.453 HD11 HD11 ' A' ' 66' ' ' ILE . 7.8 mt -62.46 -23.32 66.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.699 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -52.93 -32.1 43.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.831 -0.168 . . . . 0.0 111.335 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -53.23 60.26 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.652 0.263 . . . . 0.0 110.867 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.18 -35.76 61.52 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.897 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -52.0 65.2 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.365 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -60.31 -52.84 63.56 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.76 -34.52 62.68 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.248 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -71.49 -54.59 10.09 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.022 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.86 -37.07 75.69 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.107 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -49.73 34.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.238 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.577 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -65.29 -69.76 0.27 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.344 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.08 45.66 0.07 OUTLIER Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.048 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 mt -114.41 -157.89 0.65 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.2 m -126.05 156.04 40.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.846 0.355 . . . . 0.0 111.063 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.57 28.78 2.18 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.174 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -129.31 3.27 5.15 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -157.68 77.52 0.83 Allowed 'General case' 0 CA--C 1.521 -0.153 0 CA-C-O 121.068 0.461 . . . . 0.0 109.903 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 7.4 mm -145.3 154.95 13.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.772 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.85 143.83 33.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.715 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -118.2 129.69 55.65 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.414 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 21.3 mtt-85 -124.07 100.12 6.57 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.243 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -89.82 109.38 20.38 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.699 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 t70 56.9 37.15 28.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.134 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.25 25.55 59.16 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.923 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.53 125.02 26.97 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.875 0.337 . . . . 0.0 110.851 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.0 127.27 14.93 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.885 2.39 . . . . 0.0 112.738 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.453 HD11 HD11 ' A' ' 39' ' ' LEU . 3.7 pt -146.49 161.55 9.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.379 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -107.9 174.14 6.01 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.977 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.93 1.14 32.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.655 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.2 p -92.38 0.87 57.48 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -64.69 173.64 2.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.812 0.339 . . . . 0.0 111.328 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.75 -56.53 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.357 -179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -49.46 -44.37 35.04 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.438 2.092 . . . . 0.0 112.808 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.57 -41.54 68.9 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.707 0.289 . . . . 0.0 110.799 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -38.05 89.64 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.72 -33.4 46.76 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.719 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -68.79 -21.3 64.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.243 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.0 mtt -61.85 177.52 0.43 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.983 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -116.09 -63.5 1.44 Allowed 'General case' 0 C--O 1.233 0.203 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -170.86 -54.44 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.167 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -86.81 108.6 18.8 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.173 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -151.56 164.28 37.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.208 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 6.2 t -144.14 149.53 36.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.927 0.394 . . . . 0.0 111.5 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -140.0 175.07 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.629 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.52 102.63 6.95 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.415 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.8 p -79.97 121.64 33.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 111.184 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -115.37 143.13 45.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.797 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 C--N 1.332 -0.195 0 CA-C-O 120.746 0.308 . . . . 0.0 111.242 179.995 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.257 0 CA-C-O 120.623 0.249 . . . . 0.0 111.036 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 7.4 m80 -149.99 148.19 28.77 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.12 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.9 pt -98.75 123.89 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 111.061 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -83.76 102.02 12.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.455 ' HG ' ' HB3' ' A' ' 81' ' ' ASP . 8.0 mp -109.78 130.04 55.56 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.12 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -96.66 93.56 6.81 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.514 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.5 t -82.78 122.37 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.127 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.81 118.22 36.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.7 138.15 14.45 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.605 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -56.69 -43.56 80.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.559 0.218 . . . . 0.0 111.332 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.68 -28.02 66.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.526 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.66 54.18 0.22 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.275 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.6 p -134.89 103.81 5.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.9 95.89 4.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.05 137.16 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.197 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -94.19 87.26 5.2 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -91.37 142.24 27.9 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -114.64 138.72 50.33 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.214 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.417 HG12 ' CD1' ' A' ' 42' ' ' LEU . 1.7 pp -144.32 -179.74 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.471 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.98 148.65 26.78 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.256 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.95 28.44 1.57 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.799 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -126.31 29.4 5.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.695 0.283 . . . . 0.0 111.015 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.65 151.71 29.06 Favored Pre-proline 0 N--CA 1.463 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.63 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.71 156.8 64.57 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.559 2.173 . . . . 0.0 112.242 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.2 mt -57.91 -22.46 48.62 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.155 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 43' ' ' MET . 41.8 t -49.76 -36.16 24.92 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.725 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -46.55 61.95 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.538 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.417 ' CD1' HG12 ' A' ' 33' ' ' ILE . 6.9 tt -62.6 -52.64 62.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.696 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -58.59 -35.43 72.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.076 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.86 6.76 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.008 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -43.04 95.22 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.586 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -60.15 -48.34 82.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.338 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.3 m -74.41 -34.81 63.37 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.234 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.03 -50.15 51.28 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.108 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -56.09 -36.45 68.15 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.011 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.81 -55.48 8.44 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.466 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.5 -18.43 0.89 Allowed Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.492 -179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.41 -178.73 0.2 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.945 0.402 . . . . 0.0 110.894 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -107.12 173.77 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.285 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.3 ptt? -104.35 26.35 9.03 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.419 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.62 13.38 2.74 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -160.66 77.88 0.61 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.221 0.534 . . . . 0.0 110.225 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 9.9 mm -149.12 160.88 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.418 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . 0.5 ' HD2' ' HB2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -156.77 139.6 15.21 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.612 0.244 . . . . 0.0 111.469 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.415 ' CE2' ' HB ' ' A' ' 85' ' ' VAL . 15.1 m-85 -117.47 160.83 20.57 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.776 0.322 . . . . 0.0 111.378 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -137.35 127.19 25.61 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.138 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.424 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 24.4 t80 -106.16 91.76 3.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.457 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 58.18 37.04 26.25 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.261 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 89.32 23.04 35.55 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.021 -0.609 . . . . 0.0 113.02 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 0.0 OUTLIER -114.81 103.95 54.49 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.756 0.278 . . . . 0.0 110.484 179.802 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.7 93.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.807 2.338 . . . . 0.0 112.138 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.7 pt -103.01 135.71 39.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.097 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -79.93 157.73 26.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.829 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.33 51.7 0.72 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.821 0.343 . . . . 0.0 110.978 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.1 t -166.56 25.36 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.717 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -77.03 -175.16 3.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.635 0.255 . . . . 0.0 110.922 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.82 -58.05 0.01 OUTLIER Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.271 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -45.7 -50.74 9.1 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.591 2.194 . . . . 0.0 113.065 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.62 -49.46 66.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.7 -29.31 69.26 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.261 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -33.71 47.42 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.749 0.309 . . . . 0.0 110.414 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.53 -50.26 74.43 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.74 148.25 26.46 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.537 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -164.81 61.29 0.13 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.036 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -179.27 -60.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.45 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -142.22 96.74 3.0 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.753 0.311 . . . . 0.0 110.859 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.455 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 9.8 t70 -127.71 114.32 17.17 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.736 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.29 131.37 36.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.882 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -129.91 166.73 26.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.1 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.502 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 2.6 m-20 -133.84 105.87 7.01 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.663 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.415 ' HB ' ' CE2' ' A' ' 59' ' ' PHE . 9.8 p -92.83 112.99 27.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.143 0.497 . . . . 0.0 111.324 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.502 ' CE1' ' HB3' ' A' ' 84' ' ' ASP . 92.6 m-85 -105.37 166.53 10.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.774 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 . . . . . 0 C--O 1.233 0.187 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.192 179.756 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 t70 . . . . . 0 CA--C 1.531 0.236 0 CA-C-O 120.696 0.284 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.435 ' CG ' ' HG2' ' A' ' 32' ' ' LYS . 2.4 m170 -161.56 119.83 2.35 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.714 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.1 pt -80.96 130.06 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 111.063 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -81.5 116.72 21.42 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.041 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.9 tt -131.52 135.95 47.48 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.091 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -104.25 106.04 16.4 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.293 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 23.4 t -82.42 124.44 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.14 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.83 177.67 4.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.13 148.95 20.87 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.787 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -52.37 -38.51 58.99 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 111.433 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.45 33.27 2.51 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.588 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.77 83.72 0.2 Allowed Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.785 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.59 68.18 1.31 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.726 0.298 . . . . 0.0 111.493 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.6 t -84.54 107.8 16.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.988 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -124.56 148.98 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.433 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -93.07 110.88 22.37 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.844 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -112.75 165.66 12.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.435 ' HG2' ' CG ' ' A' ' 16' ' ' HIS . 6.9 tttt -130.36 143.62 50.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.01 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.7 tt -154.91 148.44 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.08 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -77.77 176.56 8.93 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.044 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -112.07 49.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.895 0.378 . . . . 0.0 111.453 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -157.59 33.24 0.27 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.237 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.03 143.88 10.56 Favored Pre-proline 0 N--CA 1.466 0.344 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.981 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.33 164.29 7.12 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.809 2.339 . . . . 0.0 112.65 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.447 ' CD1' ' HB3' ' A' ' 70' ' ' ASP . 12.6 mt -60.24 -14.78 19.61 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 p -51.98 -33.14 36.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.467 0.175 . . . . 0.0 111.16 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -57.06 -58.63 7.36 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.671 0.272 . . . . 0.0 110.543 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 tp -61.76 -38.11 86.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.72 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.53 -55.13 32.37 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.988 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -61.41 -43.92 98.04 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.234 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.31 -42.0 94.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.565 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -78.13 -42.53 31.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.448 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.5 p -65.47 -43.01 91.61 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.473 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.58 -34.89 62.98 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.902 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.42 -57.09 12.64 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.579 0.228 . . . . 0.0 111.464 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.86 -47.8 11.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.226 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.33 57.09 0.63 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.718 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -91.15 -78.92 0.38 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.607 0.241 . . . . 0.0 110.4 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -172.06 157.97 4.5 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.698 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -37.34 7.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.692 0.282 . . . . 0.0 110.523 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -101.57 27.29 6.47 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.4 ' C ' HG12 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.62 77.83 0.61 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.084 0.468 . . . . 0.0 110.518 179.076 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.4 HG12 ' C ' ' A' ' 56' ' ' GLN . 10.8 mm -152.59 157.58 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.466 179.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.02 123.31 3.98 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.166 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -93.63 151.9 19.36 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.767 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.03 127.09 35.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.246 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -103.44 91.87 4.24 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.326 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.5 39.56 30.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.127 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.83 21.12 29.28 Favored Glycine 0 CA--C 1.522 0.518 0 C-N-CA 121.07 -0.586 . . . . 0.0 113.032 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -118.46 94.8 47.9 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 116.855 0.327 . . . . 0.0 110.436 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -52.96 105.88 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.972 2.448 . . . . 0.0 112.47 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.7 pt -113.03 160.29 12.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.325 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -103.68 164.4 11.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.096 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -68.13 -15.06 63.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.39 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 14.9 p -91.29 30.49 1.26 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.447 ' HB3' ' CD1' ' A' ' 39' ' ' LEU . 3.0 t70 -75.08 155.97 36.58 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 111.35 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.68 -55.27 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.422 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -52.41 -53.75 6.36 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.356 2.037 . . . . 0.0 112.759 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.84 -37.42 86.75 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.868 0.366 . . . . 0.0 110.493 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.05 -20.11 65.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.452 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -81.58 -35.19 30.47 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.92 -40.2 91.22 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.976 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.16 122.9 47.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.579 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.83 31.29 0.95 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.523 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -148.62 -51.29 0.16 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.28 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.13 99.45 4.13 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.652 0.263 . . . . 0.0 110.905 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -140.33 133.14 29.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 24.7 p -125.47 136.48 53.42 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.545 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -138.2 161.6 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.35 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -125.63 118.72 26.27 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.636 179.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 13.6 p -82.7 121.34 35.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.232 0.539 . . . . 0.0 111.148 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -107.46 164.35 12.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.78 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 . . . . . 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.239 -179.944 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.235 0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.453 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -147.21 175.18 10.94 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.26 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.3 pt -104.77 128.66 58.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -82.21 119.68 24.39 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.235 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 mt -123.86 116.95 23.77 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.75 0.309 . . . . 0.0 111.362 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -96.54 93.33 6.72 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.483 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.424 ' HB ' ' CE2' ' A' ' 46' ' ' TYR . 21.9 t -94.96 122.42 46.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.003 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -93.68 123.45 37.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.268 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -83.8 148.55 24.81 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.831 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.95 -37.83 72.1 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.49 0.186 . . . . 0.0 111.238 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.21 -28.37 67.93 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.469 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.6 31.96 2.63 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.205 -0.521 . . . . 0.0 112.592 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.0 m -110.86 144.86 39.24 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.756 0.312 . . . . 0.0 110.852 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.8 p -112.02 117.13 54.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.178 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.15 133.03 69.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.934 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -117.82 106.55 13.13 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.007 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -97.86 155.56 17.0 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.4 mtmm -131.95 113.09 13.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.992 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 45.4 pt -129.29 178.54 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.412 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -80.66 147.37 30.69 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.941 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -89.02 54.72 3.09 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.232 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.6 m170 -159.84 35.27 0.18 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.094 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.5 145.15 16.64 Favored Pre-proline 0 N--CA 1.465 0.308 0 CA-C-N 116.704 -0.225 . . . . 0.0 110.962 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -56.12 158.69 14.09 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.902 2.402 . . . . 0.0 112.801 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.6 mt -57.62 -23.74 52.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.805 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 t -47.77 -35.02 9.27 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.99 0.181 . . . . 0.0 111.342 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmt -60.08 -57.63 12.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.958 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.4 tt -71.11 -36.83 72.31 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.128 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -49.79 75.99 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.239 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -62.6 -48.47 79.29 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.601 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.06 92.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.485 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.524 ' CE1' HG12 ' A' ' 85' ' ' VAL . 21.5 t80 -69.87 -45.62 67.29 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.02 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 t -68.35 -47.53 67.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.444 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -59.66 -40.66 88.46 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.99 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -66.65 -39.42 88.21 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.057 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -66.1 0.65 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.293 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.63 46.06 0.1 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.292 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 15.0 mt -119.78 -154.64 0.58 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -127.49 166.0 18.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.795 0.331 . . . . 0.0 111.077 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -95.88 25.98 4.37 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.263 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . 0.472 ' O ' ' HG3' ' A' ' 56' ' ' GLN . 20.2 mtt180 -134.75 9.8 3.63 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -157.96 77.63 0.82 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.109 0.481 . . . . 0.0 109.738 178.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 8.4 mm -144.66 155.22 14.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.814 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -144.79 116.77 8.3 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.167 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.55 101.64 13.13 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.128 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -85.19 143.24 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.072 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . 0.421 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 54.0 t80 -137.21 86.25 2.19 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.656 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.67 37.61 20.53 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.001 0.429 . . . . 0.0 111.115 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.48 36.19 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.143 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . 0.421 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 1.7 mm100 -115.94 98.47 51.18 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.996 0.398 . . . . 0.0 110.84 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -68.51 107.3 1.59 Allowed 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.685 2.257 . . . . 0.0 112.265 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.9 pt -122.84 144.82 30.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.503 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -86.95 178.21 7.02 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.165 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.51 36.48 0.31 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.881 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.2 p -136.71 17.38 3.08 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.25 162.88 21.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.006 0.431 . . . . 0.0 111.785 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -163.13 -54.95 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.551 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -50.45 -52.22 9.43 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.441 2.094 . . . . 0.0 113.247 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.19 96.75 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.802 0.334 . . . . 0.0 110.956 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.93 -33.96 71.18 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.23 -34.56 59.22 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.593 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.85 -36.35 72.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 4.8 mmt -70.09 179.25 2.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.242 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -132.03 -58.14 0.96 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.484 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -145.82 -66.91 0.3 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.373 0.13 . . . . 0.0 111.317 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.0 119.85 20.52 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.94 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -146.72 143.26 28.58 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.274 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 132.07 55.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.11 167.79 21.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.919 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.45 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 2.7 m-20 -142.47 110.47 5.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.256 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.524 HG12 ' CE1' ' A' ' 46' ' ' TYR . 13.9 p -92.45 113.86 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.022 0.439 . . . . 0.0 111.11 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 22.6 m-85 -130.8 170.48 14.33 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.883 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 . . . . . 0 N--CA 1.464 0.259 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.898 179.8 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 120.847 0.356 . . . . 0.0 111.525 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . 0.437 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 29.3 m80 -155.42 107.68 2.67 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.609 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 33' ' ' ILE . 6.8 pt -79.76 128.07 38.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.724 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -84.05 119.09 24.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.195 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.28 137.26 54.91 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.859 0.362 . . . . 0.0 111.498 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.73 97.26 7.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.365 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.5 t -85.51 118.46 32.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.262 -179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.49 113.58 27.02 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.0 156.12 39.56 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.569 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -92.72 29.76 1.7 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -133.38 26.05 4.13 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.257 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.98 61.74 4.71 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.604 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -162.21 114.15 1.67 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.797 0.332 . . . . 0.0 111.409 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.16 130.19 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 t -147.36 153.38 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.43 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -119.87 137.05 54.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.702 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -122.96 154.09 38.86 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -104.83 113.14 26.54 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.738 179.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.439 ' O ' HG12 ' A' ' 17' ' ' ILE . 8.9 tp -124.49 153.81 31.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.346 -179.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.91 153.54 18.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.872 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.78 58.1 3.76 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.371 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -164.62 32.63 0.07 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.534 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 6.1 p -157.62 153.22 22.46 Favored Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.885 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.57 155.09 22.46 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.735 2.29 . . . . 0.0 112.622 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.4 -20.02 62.57 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.979 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.84 -34.22 26.94 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.519 0.199 . . . . 0.0 110.957 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.1 mmmt -54.19 -42.95 70.29 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.908 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.57 -45.54 30.01 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.746 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.1 ttp -57.08 -36.8 71.0 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.053 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.9 mmtm -77.97 -54.0 6.79 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.051 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.59 -32.34 62.98 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.414 ' CZ ' HG11 ' A' ' 85' ' ' VAL . 56.4 t80 -79.47 -52.69 7.71 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.485 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.9 p -66.31 -37.02 84.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.299 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.08 -47.27 68.73 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.062 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 mtt180 -59.87 -49.09 79.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.376 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -64.39 -69.15 0.3 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.28 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.2 38.24 0.13 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.943 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -107.99 -153.54 0.51 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.743 0.272 . . . . 0.0 110.563 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.9 p -95.96 119.68 34.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.932 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -4.69 33.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.802 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -120.01 23.45 11.01 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.502 0.191 . . . . 0.0 111.216 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.76 77.78 0.6 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.199 0.523 . . . . 0.0 110.452 179.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 15.4 mm -150.86 160.11 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.149 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.14 150.65 30.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.447 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -116.37 161.06 19.62 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.76 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -139.59 114.79 9.71 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.438 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -108.46 101.42 10.6 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.306 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 53.18 46.95 25.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.076 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 74.33 19.88 79.74 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.001 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.21 86.65 33.17 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.83 0.315 . . . . 0.0 110.84 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.38 150.96 31.64 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.037 2.491 . . . . 0.0 112.667 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.5 pt -141.01 171.57 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.634 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -119.19 171.13 8.5 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -30.82 63.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.887 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 42.4 p -78.92 8.22 5.91 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.47 175.89 1.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.869 0.366 . . . . 0.0 111.457 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.82 -55.74 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.522 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -46.91 -51.99 8.39 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.346 2.031 . . . . 0.0 112.919 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.9 91.48 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.828 0.347 . . . . 0.0 110.64 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -58.71 -34.5 71.38 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.192 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 tt -79.48 -33.24 42.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -62.76 -26.11 68.54 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.237 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.34 160.23 5.42 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 111.492 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -125.02 -76.98 0.59 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.879 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.57 26.62 0.23 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -174.86 102.87 0.09 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.524 0.202 . . . . 0.0 111.259 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -146.9 130.4 16.79 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.875 0.369 . . . . 0.0 111.54 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.92 144.33 31.36 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.367 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 3.3 pt -150.35 168.07 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.575 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -127.1 106.92 9.59 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.295 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.414 HG11 ' CZ ' ' A' ' 46' ' ' TYR . 13.8 p -83.06 119.13 31.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.052 0.453 . . . . 0.0 111.242 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -102.67 125.41 49.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.36 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 . . . . . 0 C--O 1.233 0.218 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.175 -179.674 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.674 0.273 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -150.23 130.44 13.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.931 179.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 33' ' ' ILE . 6.6 pt -86.63 127.14 40.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.709 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -81.35 94.37 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.299 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -93.01 132.14 37.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.205 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -113.56 104.75 12.56 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.492 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 36.5 t -87.92 128.6 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.184 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -127.24 147.12 50.22 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.19 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -108.78 158.71 14.52 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.58 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -63.74 -45.6 89.14 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.594 0.235 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.96 -28.2 67.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.303 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.9 50.63 0.16 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.366 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -98.7 151.76 20.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.702 0.287 . . . . 0.0 111.118 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.3 p -152.05 111.62 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.358 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.7 m -137.25 156.87 34.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.402 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -127.35 128.56 46.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -137.65 151.5 48.34 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.23 125.2 50.31 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.459 ' O ' HG12 ' A' ' 17' ' ' ILE . 8.9 tp -136.62 153.1 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.187 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.02 148.24 22.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.755 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.74 53.99 2.55 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.006 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -150.58 29.32 0.69 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.323 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.6 153.06 25.67 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.972 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.32 162.02 42.27 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.639 2.226 . . . . 0.0 112.287 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.31 -19.54 64.69 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.94 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -48.71 -36.13 15.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.565 0.221 . . . . 0.0 111.23 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.18 -62.24 2.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.124 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.6 tp -62.82 -33.86 76.1 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.883 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.403 ' HG2' ' CD1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -55.68 -61.97 2.0 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.685 179.548 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -59.5 -37.54 78.55 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.137 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.508 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -73.47 -45.54 53.5 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.439 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.7 m -61.78 -50.01 74.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.409 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.51 72.12 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.997 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.16 68.5 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.892 179.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.11 -52.11 15.46 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.084 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.73 -11.85 3.69 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.71 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.7 mt -74.71 -166.0 0.41 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.751 0.276 . . . . 0.0 110.631 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.18 169.17 9.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.092 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.5 29.62 3.21 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.113 179.396 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.22 3.05 5.18 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.48 77.99 0.63 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.082 0.468 . . . . 0.0 110.275 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 9.9 mm -141.97 157.78 20.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.996 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.63 133.48 36.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.933 0.397 . . . . 0.0 111.454 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.403 ' CD1' ' HG2' ' A' ' 43' ' ' MET . 2.4 m-85 -123.63 109.84 14.25 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.054 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -109.45 139.71 44.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.757 0.313 . . . . 0.0 111.4 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -114.41 102.24 9.9 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.109 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 52.18 35.12 15.87 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.077 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.71 24.93 19.35 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.022 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.3 104.67 54.58 Favored Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.878 0.339 . . . . 0.0 110.962 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.84 109.04 2.23 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.754 2.302 . . . . 0.0 112.848 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.8 pt -131.71 150.17 33.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.139 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -89.63 174.85 7.52 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.984 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 40' ' ' SER . 2.0 pt-20 -73.58 51.73 0.37 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.341 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.8 p -151.7 19.33 0.71 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.491 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.75 173.02 5.59 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.84 0.352 . . . . 0.0 111.805 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.11 -56.85 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.606 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.13 -51.68 9.01 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 122.548 2.165 . . . . 0.0 113.044 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.55 91.34 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.931 0.396 . . . . 0.0 110.593 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -61.5 -38.73 88.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.012 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.18 -34.84 37.18 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.695 0.283 . . . . 0.0 110.642 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -59.2 -29.72 67.69 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.926 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.419 ' HG2' ' HB2' ' A' ' 81' ' ' ASP . 0.3 OUTLIER -66.77 -177.81 0.65 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.405 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.46 -53.91 0.25 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.275 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -146.12 -53.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -87.82 128.33 35.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.842 0.354 . . . . 0.0 110.868 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.419 ' HB2' ' HG2' ' A' ' 77' ' ' MET . 42.4 t0 -149.78 126.3 10.9 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.907 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.5 p -125.6 131.58 52.68 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.14 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -136.52 164.18 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.725 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -126.2 106.36 9.49 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.332 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.1 m -84.83 118.48 31.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.027 0.442 . . . . 0.0 111.181 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.29 173.58 6.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.513 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.058 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.3 t70 . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.738 0.304 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -133.46 139.25 46.59 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.8 pt -80.54 126.9 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 121.048 0.451 . . . . 0.0 111.539 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -87.57 105.27 17.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.021 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.41 ' HG ' ' HB3' ' A' ' 81' ' ' ASP . 1.5 mp -111.62 124.94 53.36 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.03 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.79 102.43 14.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.45 179.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.4 t -82.4 123.16 38.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.42 102.95 9.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.098 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.76 153.67 31.55 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.468 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -59.91 -33.6 72.07 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -61.29 -31.65 71.49 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.443 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.15 83.4 0.97 Allowed Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.548 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.7 t -157.93 152.06 24.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.674 0.273 . . . . 0.0 111.247 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.3 t -141.28 93.11 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -112.19 137.15 46.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.067 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -99.65 87.29 3.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.949 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.32 132.64 35.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.018 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.8 mtmm -111.97 96.51 6.09 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.1 pt -107.0 179.02 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.223 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.62 149.39 22.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.823 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -85.93 51.49 2.22 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.856 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -154.96 34.13 0.39 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.906 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.17 153.31 29.36 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.785 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.7 163.84 37.59 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.63 2.22 . . . . 0.0 112.405 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.6 mt -59.58 -24.68 63.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.52 -33.73 46.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.638 0.256 . . . . 0.0 111.287 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -57.62 7.38 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.276 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.64 -43.57 96.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.116 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -50.18 74.46 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.415 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.62 -53.25 58.68 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.69 65.87 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.722 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -79.63 -53.67 6.61 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.045 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.0 t -58.83 -36.35 74.4 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.12 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -72.93 -41.99 63.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.421 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -43.01 93.5 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.498 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -71.83 -76.27 0.11 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.267 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 152.18 39.86 0.03 OUTLIER Glycine 0 C--N 1.334 0.451 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.158 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -96.78 -166.78 1.45 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.256 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.64 159.34 23.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.949 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.93 25.81 3.95 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.358 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 -139.61 14.7 2.53 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.458 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -160.8 77.66 0.59 Allowed 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.269 0.557 . . . . 0.0 110.076 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 9.4 mm -145.47 157.2 13.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.795 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -157.37 130.23 7.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.82 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.418 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -103.43 148.5 25.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.576 179.468 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -145.43 127.15 15.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.194 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -100.14 98.74 9.41 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.246 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.72 37.7 28.99 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.081 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.47 24.95 31.98 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.114 -0.565 . . . . 0.0 113.069 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -117.03 108.79 43.6 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.98 0.39 . . . . 0.0 110.659 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -52.1 115.8 2.39 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.044 2.496 . . . . 0.0 112.679 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.418 HG13 ' HB3' ' A' ' 59' ' ' PHE . 10.6 pt -139.16 148.0 24.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.267 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -94.9 170.45 9.42 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.734 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.11 23.77 0.84 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.539 179.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 p -116.46 11.76 14.97 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 122.457 -0.152 . . . . 0.0 111.111 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -65.79 168.64 7.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.898 0.38 . . . . 0.0 111.188 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.39 -55.22 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.341 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.92 -48.05 21.04 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.53 2.153 . . . . 0.0 112.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.87 89.07 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.627 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.25 -33.38 69.32 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.905 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.33 -32.49 49.2 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.725 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -58.66 -39.78 81.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.734 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.26 175.85 2.5 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.201 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -123.47 -52.44 1.82 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.573 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -159.73 -57.13 0.06 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.875 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.07 117.06 16.49 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.145 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.41 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 27.4 t70 -158.92 153.15 23.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 32.6 p -137.7 145.65 42.81 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.399 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -145.25 154.37 13.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.528 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -118.42 121.19 39.73 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.078 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 13.8 p -94.12 111.56 25.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 121.19 0.519 . . . . 0.0 110.849 178.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -95.88 146.26 24.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.112 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 C--O 1.233 0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.038 179.828 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.234 0.252 0 CA-C-O 120.583 0.23 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.29 123.9 1.16 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.324 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 33' ' ' ILE . 22.6 pt -80.65 129.64 37.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -98.81 104.65 16.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.399 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.75 139.3 35.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.466 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.3 105.46 14.12 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.354 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . 0.403 HG11 ' CZ ' ' A' ' 46' ' ' TYR . 22.0 t -90.32 129.7 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.307 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -115.98 113.7 23.61 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.372 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.86 146.18 28.02 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.01 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -56.15 -51.83 66.57 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.503 0.192 . . . . 0.0 111.428 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -63.42 -23.72 67.53 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.407 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.13 88.94 1.03 Allowed Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.579 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.4 p -153.76 127.38 8.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.705 0.288 . . . . 0.0 111.252 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.86 97.11 5.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.874 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.43 135.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.24 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -110.09 115.86 30.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.082 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -104.75 165.04 11.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.113 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.9 mtpp -135.23 111.59 9.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.45 ' O ' HG12 ' A' ' 17' ' ' ILE . 27.1 pt -129.14 173.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.371 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 158.99 19.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.809 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . 0.431 ' HD3' ' HA ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -90.76 52.56 2.21 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.831 0.348 . . . . 0.0 111.265 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -160.59 35.48 0.16 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.88 148.26 17.68 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 120.485 0.183 . . . . 0.0 111.142 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HA ' ' O ' ' A' ' 70' ' ' ASP . 35.6 Cg_exo -62.08 165.03 15.41 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.977 2.451 . . . . 0.0 112.878 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.8 mt -62.77 -17.87 61.74 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.885 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.9 p -50.94 -34.59 29.29 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -54.44 45.51 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.47 -41.12 89.5 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.346 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.448 ' HE2' ' HB3' ' A' ' 68' ' ' GLU . 7.4 mmm -59.3 -53.72 55.0 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.521 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -55.12 -54.0 48.78 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.095 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.3 81.28 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.409 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.41 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 71.6 t80 -69.6 -37.15 76.77 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.414 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -76.94 -34.36 57.64 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.668 0.271 . . . . 0.0 111.03 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -78.16 -37.14 46.58 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.389 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -60.17 -36.31 77.3 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.773 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.93 -70.62 0.62 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.396 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.33 46.27 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.944 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -112.02 -160.03 0.7 Allowed 'General case' 0 C--O 1.233 0.227 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 t -130.47 163.33 27.22 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.9 0.381 . . . . 0.0 111.191 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.6 ttp -93.11 26.75 2.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.289 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -135.49 14.36 3.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.474 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -160.85 77.93 0.59 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.267 0.556 . . . . 0.0 110.541 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 8.3 mm -148.46 158.78 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.747 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -142.28 134.24 27.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.155 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -121.83 124.97 45.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.302 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -124.4 120.82 33.19 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.055 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -100.55 95.29 6.61 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.455 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.49 41.65 32.07 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.119 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.46 25.66 32.56 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.969 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -114.98 94.5 38.54 Favored Pre-proline 0 C--O 1.232 0.177 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -56.16 93.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.901 2.401 . . . . 0.0 112.458 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 27.1 pt -114.34 166.11 8.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.191 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -110.14 175.23 5.51 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.777 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.448 ' HB3' ' HE2' ' A' ' 43' ' ' MET . 1.4 pm0 -65.48 -14.9 62.0 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.654 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 80.5 p -91.08 29.39 1.4 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.43 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 3.0 t70 -73.59 167.48 21.26 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 120.407 0.146 . . . . 0.0 111.114 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.486 ' N ' ' HD2' ' A' ' 72' ' ' PRO . 17.2 m -169.0 -58.59 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 71' ' ' THR . 5.3 Cg_endo -47.24 -51.22 9.82 Favored 'Trans proline' 0 C--N 1.358 1.04 0 C-N-CA 122.943 2.428 . . . . 0.0 112.773 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.22 -41.16 92.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.053 0.454 . . . . 0.0 110.261 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -67.94 -33.14 74.11 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.092 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.431 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -75.68 -38.94 58.27 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 110.426 179.779 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.74 -40.66 88.81 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.059 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 30.9 mmt -70.61 176.35 4.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.322 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -129.71 -47.17 1.15 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.481 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -149.16 -64.54 0.23 Allowed 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 120.523 0.201 . . . . 0.0 111.219 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.62 106.73 2.28 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.006 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -145.76 117.28 8.04 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.832 0.349 . . . . 0.0 111.111 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.22 146.26 41.61 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.467 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 2.2 pp -146.88 161.33 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.586 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -115.76 100.01 7.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.738 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.3 p -79.85 113.59 19.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.164 0.506 . . . . 0.0 110.874 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -104.71 125.59 50.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.112 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.812 0.339 . . . . 0.0 111.177 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 C--O 1.234 0.264 0 CA-C-O 120.655 0.264 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -160.93 143.55 12.69 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.672 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 33' ' ' ILE . 8.5 pt -92.45 129.6 42.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-O 121.152 0.501 . . . . 0.0 111.174 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -82.36 119.6 24.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.286 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.93 124.74 33.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.079 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -107.93 108.87 20.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.261 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.9 t -81.07 113.1 19.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.036 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.4 105.26 16.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.051 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.47 146.27 27.24 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.384 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -24.52 47.73 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.73 40.71 1.05 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.738 0.304 . . . . 0.0 111.455 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.29 39.04 89.62 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.061 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 t -102.05 114.56 28.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.778 0.289 . . . . 0.0 110.97 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.33 98.95 6.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.983 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -126.79 134.6 65.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -84.39 149.48 25.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -154.31 132.91 12.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.016 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.69 149.65 21.02 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.744 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . 0.409 ' O ' HG12 ' A' ' 17' ' ' ILE . 7.8 tp -157.12 148.52 10.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.563 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.4 pttt -76.96 165.77 24.23 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.947 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -101.23 48.88 0.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.126 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.05 32.83 0.34 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.198 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.45 149.25 22.33 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.94 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.4 ' HA ' HG21 ' A' ' 71' ' ' THR . 56.0 Cg_endo -70.16 170.31 17.36 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.786 2.324 . . . . 0.0 112.722 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.402 ' CD1' ' HB2' ' A' ' 70' ' ' ASP . 6.2 mt -58.14 -22.34 50.7 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.544 179.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 t -49.9 -39.2 39.06 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.638 0.256 . . . . 0.0 110.758 178.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -46.46 87.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.173 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 tp -70.66 -47.52 59.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.732 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.41 ' HE2' ' HG2' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -57.99 -43.7 86.73 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.122 179.884 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -60.68 -50.76 72.19 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.949 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.65 -45.72 74.48 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.69 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.443 ' CE2' HG12 ' A' ' 85' ' ' VAL . 81.7 t80 -61.97 -45.41 93.77 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.248 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -69.53 -37.79 77.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -72.74 -37.63 67.66 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.164 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -63.77 -33.8 76.47 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.506 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -81.34 -75.13 0.3 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.612 0.244 . . . . 0.0 111.312 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.49 45.8 0.02 OUTLIER Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.9 mt -114.27 -160.31 0.73 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.713 0.292 . . . . 0.0 110.254 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.9 -179.49 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.905 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 mtm -100.04 30.61 3.67 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.093 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.46 0.26 8.24 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.32 77.75 0.63 Allowed 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 121.251 0.548 . . . . 0.0 110.242 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 8.1 mm -144.28 156.7 15.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.668 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -158.65 126.84 5.22 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.972 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.63 144.14 42.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.283 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.7 mtt180 -131.66 135.98 47.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.109 -179.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -123.85 113.63 18.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.532 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 t0 56.25 37.05 28.47 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.66 22.67 63.84 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 121.043 -0.599 . . . . 0.0 113.11 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -119.21 127.41 26.5 Favored Pre-proline 0 C--O 1.231 0.128 0 CA-C-N 116.775 0.287 . . . . 0.0 110.871 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.25 110.07 2.56 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.759 2.306 . . . . 0.0 112.34 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.4 pt -116.61 176.61 2.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.132 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -133.28 179.41 6.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.155 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.41 ' HG2' ' HE2' ' A' ' 43' ' ' MET . 0.0 OUTLIER -79.87 40.08 0.45 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.474 179.643 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -141.14 16.59 2.26 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.149 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.402 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -72.94 168.8 18.23 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 120.762 0.315 . . . . 0.0 111.453 -179.912 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.4 HG21 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -167.38 -57.34 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.421 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -47.76 -51.42 9.82 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.433 2.089 . . . . 0.0 113.095 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.39 98.78 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.835 0.35 . . . . 0.0 110.73 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -29.34 69.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.267 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.98 -31.8 39.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 110.709 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.85 -40.49 95.54 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.28 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.49 149.27 25.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.94 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.81 51.34 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.844 0.354 . . . . 0.0 111.647 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -170.79 -54.4 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.131 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -142.07 95.03 2.74 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -127.98 135.14 49.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.146 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -117.23 133.45 55.98 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.73 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -123.96 165.01 21.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.859 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . 0.461 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -129.43 104.04 7.26 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.767 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . 0.443 HG12 ' CE2' ' A' ' 46' ' ' TYR . 14.6 p -86.46 117.48 31.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.132 0.492 . . . . 0.0 111.136 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . 0.461 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 79.6 m-85 -108.43 150.88 26.8 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.454 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.332 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.021 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.636 0.255 . . . . 0.0 110.941 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.99 124.1 16.43 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.904 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.4 pt -80.23 126.51 39.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-O 120.958 0.409 . . . . 0.0 111.221 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -92.62 93.45 8.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.513 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.04 122.1 40.76 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.806 0.336 . . . . 0.0 111.006 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 103.56 13.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.577 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.2 t -88.69 110.52 21.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.205 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -116.36 111.81 20.61 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.9 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.0 149.63 22.33 Favored Glycine 0 C--N 1.333 0.393 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.545 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.08 -31.97 61.59 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -64.18 -28.2 69.59 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.411 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 114.12 48.3 0.57 Allowed Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.617 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -125.69 113.27 17.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.594 0.235 . . . . 0.0 110.998 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 m -112.29 125.71 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.228 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.51 168.2 23.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -122.61 95.66 4.72 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.04 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -92.85 137.5 32.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.01 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 35.3 mtpt -126.85 111.87 14.68 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.994 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.4 178.88 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.416 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 155.36 35.08 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.06 30.16 2.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.424 179.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -136.29 35.23 2.76 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.709 0.29 . . . . 0.0 110.808 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.6 t -145.93 138.22 13.59 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.743 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.41 156.51 8.17 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.694 2.263 . . . . 0.0 112.572 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.427 ' CD1' ' HB2' ' A' ' 70' ' ' ASP . 12.7 mt -54.03 -22.51 10.79 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.944 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 t -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.572 0.225 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.15 -53.66 55.6 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.655 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.9 tt -67.08 -41.37 86.5 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.791 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.411 ' HG2' ' HB3' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -56.0 -58.12 9.25 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.133 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -56.64 -42.2 78.5 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.83 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.58 -35.25 77.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.32 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -77.14 -52.14 9.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.601 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 p -60.93 -39.22 88.62 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.573 0.225 . . . . 0.0 111.195 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.16 -40.96 77.86 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.035 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -72.67 -40.67 66.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -73.66 -66.47 0.7 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.389 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.28 46.73 0.05 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.081 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -123.08 -159.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.86 163.65 21.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.913 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 5.8 mtm -97.97 27.81 4.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -132.59 8.45 4.22 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.5 77.97 0.62 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-O 121.228 0.537 . . . . 0.0 110.233 179.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 11.7 mm -143.69 158.16 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.586 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -142.12 123.38 14.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.145 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -107.13 136.04 47.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.655 179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.4 mtm-85 -135.42 140.3 44.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.367 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -120.23 101.63 7.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.273 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.45 34.76 24.83 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.22 -179.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 102.26 -27.94 18.13 Favored Glycine 0 CA--C 1.522 0.485 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.983 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -68.51 113.44 15.61 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.906 0.353 . . . . 0.0 111.007 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -75.13 118.9 5.39 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.592 2.195 . . . . 0.0 112.366 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.3 pt -124.32 174.39 8.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.316 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -112.76 178.12 4.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.282 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.411 ' HB3' ' HG2' ' A' ' 43' ' ' MET . 0.5 OUTLIER -84.24 16.69 2.86 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.673 179.567 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.15 15.72 7.27 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.575 0.226 . . . . 0.0 111.098 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . 0.427 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . 0.4 OUTLIER -72.8 118.29 15.55 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.753 0.311 . . . . 0.0 110.832 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.422 ' HB ' ' HD3' ' A' ' 72' ' ' PRO . 0.7 OUTLIER -112.0 -50.46 0.05 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.063 -179.737 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . 0.422 ' HD3' ' HB ' ' A' ' 71' ' ' THR . 74.3 Cg_exo -50.38 -58.45 1.68 Allowed 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 122.216 1.944 . . . . 0.0 112.513 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.1 -37.95 89.14 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.9 0.381 . . . . 0.0 110.038 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.6 tm0? -54.39 -45.24 72.83 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.547 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tt -76.32 -31.93 58.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.58 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.28 -27.97 57.11 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.11 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 29.9 mmt -60.13 168.55 1.89 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.723 0.297 . . . . 0.0 110.92 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.19 -62.01 1.31 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.138 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -156.41 -60.96 0.1 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.453 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.85 111.71 22.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.995 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -140.14 146.71 39.17 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.239 -179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.78 137.92 51.85 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.283 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -152.33 158.71 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -131.17 120.02 22.71 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.649 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.4 p -85.68 120.95 36.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 121.048 0.451 . . . . 0.0 111.083 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -108.14 158.37 17.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.217 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.178 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.058 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 120.775 0.321 . . . . 0.0 110.967 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m80 -146.76 158.97 44.04 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.154 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.8 pt -100.92 124.78 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.773 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -90.69 111.1 22.31 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.113 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . 0.429 ' CD2' HG13 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -109.65 125.38 52.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.465 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.3 mttp -95.91 104.68 16.63 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.366 179.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.6 t -89.31 120.11 37.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.158 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -118.08 92.14 3.75 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.03 166.03 49.7 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -84.75 48.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.73 0.3 . . . . 0.0 111.19 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -148.58 32.5 0.79 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.071 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.98 30.58 66.86 Favored Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.541 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.25 135.47 54.02 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.702 0.287 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.6 m -144.23 103.71 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.194 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.3 t -125.13 141.52 44.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.185 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.85 102.75 12.56 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.99 0.424 . . . . 0.0 110.954 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.15 143.27 31.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.787 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -119.95 136.18 54.62 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.844 0.354 . . . . 0.0 111.27 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.3 pt -135.12 179.55 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.022 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.7 159.46 26.65 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.69 43.59 1.1 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 110.932 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -151.3 35.46 0.58 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -148.44 141.91 15.82 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.752 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.19 173.59 5.96 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.728 2.285 . . . . 0.0 112.525 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.2 mt -56.1 -24.18 38.7 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.382 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.4 t -50.4 -40.52 50.2 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.342 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -58.72 -58.6 7.86 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.022 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -59.44 -42.93 93.08 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.818 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' MET . . . . . 0.447 ' HG2' ' CE1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -60.59 -54.7 42.28 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.141 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -60.7 -50.52 73.17 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.007 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.94 81.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.382 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -69.61 -53.17 20.08 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -44.58 92.21 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.135 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.99 -45.59 92.22 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.851 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.77 78.55 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.126 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -74.9 -75.81 0.16 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.224 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.77 46.63 0.02 OUTLIER Glycine 0 C--N 1.334 0.45 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.196 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 mt -124.9 -163.26 1.16 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.625 0.25 . . . . 0.0 110.416 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.5 m -115.96 170.97 8.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.032 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ptm -102.38 22.89 12.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.432 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.67 15.72 2.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.62 78.03 0.62 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.168 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 14.6 mm -146.44 157.98 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.604 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -142.93 109.0 5.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.328 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.447 ' CE1' ' HG2' ' A' ' 43' ' ' MET . 9.3 m-85 -105.23 151.17 24.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.342 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 56.2 mtt180 -146.21 136.87 24.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.882 0.372 . . . . 0.0 111.294 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -96.58 94.81 7.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.155 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.03 35.78 20.38 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 112.9 -30.21 7.58 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.946 -0.645 . . . . 0.0 113.253 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -75.56 112.98 22.04 Favored Pre-proline 0 CA--C 1.533 0.312 0 CA-C-N 116.859 0.33 . . . . 0.0 111.431 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -59.96 137.62 77.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.914 2.409 . . . . 0.0 112.988 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 17.8 pt -147.56 158.68 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.996 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -137.44 176.18 8.94 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.302 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.85 81.35 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.316 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.0 t -177.66 -28.09 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.018 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -51.89 167.15 0.12 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.933 0.397 . . . . 0.0 111.733 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -162.17 -55.99 0.01 OUTLIER Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.263 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -45.19 -48.29 11.47 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.385 2.057 . . . . 0.0 112.806 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.36 87.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.056 0.455 . . . . 0.0 110.063 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . 0.413 ' HG2' ' HE3' ' A' ' 77' ' ' MET . 13.9 tm0? -58.25 -34.61 70.65 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.819 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -32.4 61.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.472 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -43.62 84.45 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.836 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' MET . . . . . 0.413 ' HE3' ' HG2' ' A' ' 74' ' ' GLN . 3.8 ptt? -74.77 150.8 39.25 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.843 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.68 -43.9 0.48 Allowed 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.94 -67.74 0.93 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -179.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -94.46 127.59 40.47 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.869 0.366 . . . . 0.0 111.312 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -157.76 143.86 17.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.591 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 57.8 p -137.36 149.06 46.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.915 0.388 . . . . 0.0 111.477 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.429 HG13 ' CD2' ' A' ' 19' ' ' LEU . 1.1 pp -154.6 152.76 9.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.619 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -109.79 133.11 53.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.127 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 8.4 p -107.95 103.6 15.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.273 0.559 . . . . 0.0 111.239 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -103.38 169.07 8.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.653 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.162 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.877 0.37 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -144.77 152.02 39.73 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.2 pt -98.86 124.32 52.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.119 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -84.41 122.4 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.056 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -119.56 117.28 27.94 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.258 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 95.27 10.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.325 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t -83.88 122.1 37.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.3 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.68 119.29 37.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.227 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -83.6 136.38 14.91 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.752 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.23 -35.81 81.58 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -58.4 -32.68 68.86 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.292 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.89 45.67 0.2 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 121.193 -0.527 . . . . 0.0 112.389 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.52 160.8 38.66 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.662 0.268 . . . . 0.0 110.969 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.0 t -142.03 101.57 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.59 147.17 11.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.075 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -114.86 122.77 47.34 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.221 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -129.99 146.36 51.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.92 144.42 51.0 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.37 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.8 pt -145.11 178.96 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.367 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.49 148.25 26.06 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.629 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.8 56.65 4.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.884 0.373 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -165.05 35.41 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.4 ' HB ' ' HD3' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -155.95 146.85 16.38 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-O 120.629 0.252 . . . . 0.0 111.307 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.4 161.63 7.09 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.051 2.5 . . . . 0.0 113.102 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.5 mt -59.74 -22.31 61.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.739 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.08 -31.36 18.68 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.245 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . 0.4 ' HD3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -56.79 -61.63 2.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.902 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tt -66.78 -45.26 79.01 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.5 mmm -53.86 -41.55 67.62 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.328 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -66.09 -57.9 6.67 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.949 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 49' ' ' ARG . . . -59.55 -34.24 72.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.927 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -60.34 -60.81 3.22 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.231 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.52 -28.3 69.86 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.271 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.43 -56.6 4.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -57.13 -41.32 78.83 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.467 -179.636 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.16 -72.41 0.25 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.137 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.06 41.81 0.09 OUTLIER Glycine 0 C--N 1.335 0.492 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.779 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -103.74 -152.5 0.45 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 110.559 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.83 122.44 47.67 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.747 0.308 . . . . 0.0 110.929 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.2 tpt -63.34 -26.43 68.76 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.487 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.3 25.9 7.75 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.7 78.04 0.61 Allowed 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.126 0.488 . . . . 0.0 110.467 179.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 20.2 mm -146.88 159.14 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.847 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 ttm-85 -141.0 135.34 31.04 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.732 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' PHE . . . . . 0.405 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -120.96 143.03 49.22 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -135.04 119.33 17.78 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.378 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -107.15 103.52 12.94 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.268 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.74 38.2 29.34 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.91 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.94 28.52 49.97 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.159 -0.543 . . . . 0.0 112.966 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -124.72 107.1 29.11 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-N 116.849 0.324 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.06 129.34 32.82 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.082 2.521 . . . . 0.0 112.855 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . 0.405 HG13 ' HB3' ' A' ' 59' ' ' PHE . 11.0 pt -146.95 145.83 19.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.467 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -99.31 173.72 6.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.712 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.78 47.9 0.44 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.672 0.273 . . . . 0.0 111.608 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.5 p -148.35 18.01 1.06 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.572 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.41 176.7 6.53 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.23 -56.7 0.01 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.365 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -48.37 -48.63 16.46 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.562 2.175 . . . . 0.0 112.887 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.15 -42.14 76.36 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.759 0.314 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.73 -37.99 74.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.684 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.69 -31.99 57.61 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.518 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.48 -30.93 67.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.831 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.5 mtt -62.47 170.78 2.24 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.407 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -137.92 -52.97 0.63 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.425 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -156.61 -61.71 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -96.82 120.47 37.21 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.755 0.312 . . . . 0.0 111.172 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 159.28 43.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.266 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -122.91 151.1 42.1 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.458 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' ILE . . . . . 0.404 HG21 HD11 ' A' ' 83' ' ' ILE . 1.2 mt -144.51 168.07 10.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.923 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -137.86 97.2 3.37 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.677 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 13.4 p -82.08 119.8 32.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.033 0.444 . . . . 0.0 111.138 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -99.34 129.13 45.52 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.983 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 . . . . . 0 C--O 1.233 0.203 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.935 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 m120 . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 120.597 0.237 . . . . 0.0 111.493 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -94.0 116.27 28.69 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.767 0.318 . . . . 0.0 110.818 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -142.22 146.14 34.88 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.5 pt -93.27 125.63 45.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.055 0.455 . . . . 0.0 111.208 -179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -94.18 89.37 5.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.836 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.25 123.68 34.24 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.25 -179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.85 93.18 4.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.261 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 31.9 t -85.52 125.34 40.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.17 -179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.73 117.07 33.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.953 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.67 149.75 27.42 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.634 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -19.59 54.15 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.06 31.84 0.96 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.24 41.07 94.69 Favored Glycine 0 C--N 1.338 0.655 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.846 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.2 t -115.67 127.32 55.09 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.607 0.242 . . . . 0.0 111.094 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.3 m -117.09 115.29 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.118 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.2 t -136.95 134.23 48.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.248 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -105.56 154.64 20.1 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.159 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -135.78 146.18 47.33 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -119.02 111.94 18.94 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.144 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.1 pt -145.86 178.87 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.2 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.4 159.98 18.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.729 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.86 31.86 2.54 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.331 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.31 31.6 5.01 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.127 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.18 157.96 42.04 Favored Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.844 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -70.83 163.27 39.71 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.63 2.22 . . . . 0.0 112.645 -179.793 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.1 mt -66.15 -12.98 59.36 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.832 179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 61.8 m -51.29 -33.81 30.39 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.524 0.202 . . . . 0.0 111.26 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -56.43 5.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.559 -0.292 . . . . 0.0 110.958 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.81 -46.61 88.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.094 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.426 ' HE2' HG13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -58.9 -48.7 80.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 -179.985 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.77 -54.28 44.56 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.79 -34.71 67.91 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.462 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.472 ' CE1' HG13 ' A' ' 85' ' ' VAL . 39.4 t80 -74.65 -54.85 6.64 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.978 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.5 t -59.8 -41.24 90.77 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.295 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -68.51 -37.06 79.72 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.317 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.65 -39.67 44.3 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.521 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -67.11 -64.91 0.76 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.348 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.39 46.96 0.05 OUTLIER Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.063 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.6 mt -122.25 -161.39 0.93 Allowed 'General case' 0 C--O 1.234 0.253 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -123.59 166.92 14.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.915 179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 68.7 mtp -96.08 24.51 5.54 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.308 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -136.7 12.85 3.18 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.458 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -160.84 78.12 0.6 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.121 0.486 . . . . 0.0 110.334 179.157 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.426 HG13 ' HE2' ' A' ' 43' ' ' MET . 11.8 mm -141.94 156.86 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.037 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -156.89 116.28 3.42 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.944 179.617 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -95.8 123.6 39.44 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.721 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -106.53 117.86 35.15 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.253 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -121.6 101.98 7.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.345 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.9 38.75 29.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 76.84 25.35 64.9 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.102 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -125.51 91.11 49.39 Favored Pre-proline 0 C--O 1.233 0.19 0 CA-C-N 116.859 0.329 . . . . 0.0 110.737 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 115.82 2.63 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.01 2.474 . . . . 0.0 112.32 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 18.1 pt -117.51 140.92 38.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.341 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -90.44 172.73 8.52 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.752 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.79 -20.11 65.88 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.393 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 21.7 p -85.93 28.06 0.83 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -84.34 168.02 16.0 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.658 0.266 . . . . 0.0 111.149 179.814 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.01 -57.85 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.253 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -47.16 -50.28 11.35 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.624 2.216 . . . . 0.0 113.009 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.96 -45.41 85.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.792 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -60.87 -31.73 71.19 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.189 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 tt -75.96 -37.22 58.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.807 0.337 . . . . 0.0 110.347 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.79 -33.87 70.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.03 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 16.1 mtt -64.6 169.56 4.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.396 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -111.71 -54.68 2.59 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.989 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -175.01 -48.46 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.432 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -84.92 93.31 8.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.997 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -141.14 138.25 33.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.903 0.383 . . . . 0.0 111.366 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.87 142.23 39.78 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.22 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -135.34 167.84 24.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.665 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -133.62 108.49 8.6 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.566 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.472 HG13 ' CE1' ' A' ' 46' ' ' TYR . 13.0 p -82.15 121.92 36.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.042 0.449 . . . . 0.0 111.203 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -123.14 167.45 13.67 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.319 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -126.09 99.08 5.75 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.733 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -138.3 119.79 14.93 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.568 0.223 . . . . 0.0 111.537 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.9 -53.09 2.51 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.919 179.344 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 63.5 m 69.58 96.14 0.07 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.073 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -101.33 121.21 7.15 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.825 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.547 -1.14 . . . . 0.0 112.825 179.806 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.1 m-20 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.752 0.31 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.2 107.46 7.24 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.638 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 m80 -135.83 158.79 43.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.049 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.5 pt -96.63 124.63 49.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.272 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -89.17 91.01 8.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.465 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 2.0 mp -107.43 124.23 49.56 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.282 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.7 mttt -90.6 116.37 28.44 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.687 179.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.5 t -101.03 112.34 33.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.102 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.84 124.05 44.72 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.183 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.08 139.2 20.27 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.511 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -58.61 -30.64 67.39 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.11 -32.26 67.95 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.56 0.219 . . . . 0.0 111.536 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 125.25 45.03 0.26 Allowed Glycine 0 C--N 1.334 0.422 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.461 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.7 m -140.41 160.67 39.47 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.623 0.249 . . . . 0.0 110.89 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -140.76 114.14 5.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 120.818 0.342 . . . . 0.0 111.158 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 t -113.67 140.59 33.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.259 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -90.15 113.46 25.22 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.902 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.37 160.53 25.22 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 pttm -154.08 148.56 26.17 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.388 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 24.7 pt -146.91 178.04 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.321 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.43 148.38 25.01 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.419 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -82.95 55.64 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.962 0.41 . . . . 0.0 111.055 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m170 -156.93 31.29 0.3 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.955 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.43 150.78 25.89 Favored Pre-proline 0 N--CA 1.463 0.218 0 CA-C-O 120.625 0.25 . . . . 0.0 111.32 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.04 174.22 10.07 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.082 2.522 . . . . 0.0 112.794 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.5 mt -61.21 -24.77 66.58 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.7 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 -36.46 64.89 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.527 0.203 . . . . 0.0 110.763 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -46.63 84.78 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.541 179.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.4 tt -66.48 -51.71 53.86 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 179.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.433 ' HG3' ' CE1' ' A' ' 59' ' ' PHE . 5.4 ttp -60.28 -35.97 76.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.624 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -62.89 -58.89 5.83 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.585 0.231 . . . . 0.0 110.777 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.23 88.88 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.431 ' CE2' HG12 ' A' ' 85' ' ' VAL . 77.1 t80 -66.36 -37.43 85.3 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.419 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -80.66 -31.38 36.43 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.0 -55.95 4.75 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.95 -33.19 62.07 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.599 0.238 . . . . 0.0 111.372 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.429 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 3.7 tt0 -74.62 -54.82 6.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.274 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.25 -6.26 3.05 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.907 -0.663 . . . . 0.0 113.063 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.5 mt -71.45 -167.72 0.27 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.923 0.392 . . . . 0.0 110.753 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.7 m -116.1 159.53 21.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.56 29.73 2.2 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.49 6.67 4.12 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -160.79 77.7 0.59 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 110.427 179.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 5.8 mm -147.21 155.99 10.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.726 179.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -159.59 154.91 25.36 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.213 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.433 ' CE1' ' HG3' ' A' ' 43' ' ' MET . 3.4 m-85 -120.48 155.49 33.46 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.974 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.57 119.42 10.58 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.433 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 71.8 t80 -105.6 98.89 8.52 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.239 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 54.95 39.08 31.43 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 111.162 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.17 22.75 43.56 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.102 -0.571 . . . . 0.0 113.161 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.433 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 3.3 mt-30 -115.01 92.85 32.54 Favored Pre-proline 0 C--O 1.233 0.196 0 CA-C-N 116.991 0.396 . . . . 0.0 110.659 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.98 113.48 1.35 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.887 2.391 . . . . 0.0 111.99 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 21.5 pt -116.7 143.93 25.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.953 0.406 . . . . 0.0 111.461 -179.717 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -92.7 170.35 9.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.076 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.51 -3.19 32.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.688 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 20.9 p -96.21 18.13 14.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 11.2 t0 -72.92 160.09 32.68 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.08 -55.49 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.54 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.25 -50.23 14.58 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 122.394 2.063 . . . . 0.0 112.958 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.82 86.73 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.936 0.398 . . . . 0.0 110.755 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -27.11 68.68 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.4 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.4 -34.37 41.92 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.559 0.218 . . . . 0.0 110.565 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -65.4 -47.89 74.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.878 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.93 114.21 27.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.73 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -152.73 69.68 0.87 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.869 0.366 . . . . 0.0 111.794 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -172.63 -69.38 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.963 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -143.07 92.2 2.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.6 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -139.64 146.4 39.68 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.996 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 71.2 p -119.41 147.67 44.11 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.628 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.2 167.06 27.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.813 179.549 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -116.14 97.74 6.23 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.489 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.431 HG12 ' CE2' ' A' ' 46' ' ' TYR . 11.0 p -81.38 114.28 22.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 121.269 0.557 . . . . 0.0 111.504 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -98.8 131.44 44.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.667 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 -98.88 33.25 2.38 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 68.44 153.62 0.1 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.533 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.83 144.75 45.38 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.965 -179.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.83 84.07 2.04 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.062 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.81 -156.87 49.88 Favored Glycine 0 CA--C 1.52 0.381 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.929 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.56 -1.133 . . . . 0.0 112.556 179.946 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 120.633 0.254 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -152.92 92.9 1.69 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.075 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -153.89 125.53 7.63 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.755 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.3 pt -80.95 129.87 36.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 111.234 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -89.74 113.42 24.94 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.289 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.8 mp -122.83 133.2 54.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.257 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.406 ' HB2' HG21 ' A' ' 82' ' ' THR . 0.0 OUTLIER -101.62 112.93 25.65 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.45 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.3 t -90.5 124.4 43.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.07 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.7 115.48 30.32 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.74 149.82 32.04 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.691 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -54.56 -33.5 60.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.416 0.287 . . . . 0.0 111.552 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.45 32.3 2.04 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.75 53.67 15.02 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.966 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -107.29 101.18 10.58 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.545 0.212 . . . . 0.0 110.891 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -97.63 109.25 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 120.735 0.302 . . . . 0.0 111.344 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 t -139.78 151.99 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.51 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -112.47 147.55 36.29 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.316 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -142.62 137.94 30.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.106 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -110.11 116.21 31.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.869 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.7 pt -133.95 178.45 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.485 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.99 156.48 16.3 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.821 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.48 39.62 1.03 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.39 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -147.17 33.39 0.9 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.74 0.305 . . . . 0.0 111.133 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -142.07 155.41 65.33 Favored Pre-proline 0 C--O 1.232 0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.828 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.429 ' HA ' ' O ' ' A' ' 70' ' ' ASP . 54.8 Cg_endo -69.13 165.97 28.42 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.526 2.151 . . . . 0.0 112.243 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.4 mt -58.21 -24.39 58.99 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.429 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 24.7 p -53.39 -32.89 51.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.362 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.57 -58.96 5.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.824 -0.171 . . . . 0.0 110.694 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.63 -39.6 91.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.636 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.6 -43.1 85.76 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.352 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -63.51 -38.67 92.01 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.767 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.19 -34.2 61.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.579 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.452 ' CE1' HG13 ' A' ' 85' ' ' VAL . 53.5 t80 -80.86 -37.11 30.48 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 t -79.39 -41.08 28.56 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -72.67 -45.05 60.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.733 -0.212 . . . . 0.0 111.519 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -62.22 -35.65 79.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.299 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.419 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 1.9 tt0 -75.47 -66.86 0.72 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.078 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.16 46.21 0.11 Allowed Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.188 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 13.7 mt -112.2 -154.38 0.54 Allowed 'General case' 0 C--O 1.233 0.198 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.6 166.1 10.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.946 0.403 . . . . 0.0 111.284 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.64 -36.75 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.221 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.9 28.53 2.69 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.69 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.428 ' C ' HG12 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -160.67 77.56 0.6 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.104 0.478 . . . . 0.0 110.28 178.854 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.428 HG12 ' C ' ' A' ' 56' ' ' GLN . 10.0 mm -152.02 158.64 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.511 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -156.64 129.95 8.05 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.957 0.408 . . . . 0.0 111.21 179.307 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -106.4 136.99 45.19 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.655 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -113.47 121.32 43.94 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.256 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -113.61 89.07 2.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.99 39.09 31.48 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.05 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.88 23.19 39.47 Favored Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.081 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -119.82 92.68 46.85 Favored Pre-proline 0 C--O 1.233 0.216 0 CA-C-N 116.976 0.388 . . . . 0.0 110.603 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.09 106.82 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.957 2.438 . . . . 0.0 112.25 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.3 pt -111.47 133.41 57.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.374 -179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -87.68 177.04 7.15 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.429 ' O ' ' HB3' ' A' ' 40' ' ' SER . 1.2 pm0 -83.49 23.74 0.91 Allowed 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.9 p -126.6 13.97 7.55 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 122.508 -0.12 . . . . 0.0 111.284 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.429 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 1.0 OUTLIER -73.44 175.78 6.67 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.649 0.261 . . . . 0.0 111.297 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.43 -55.19 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.351 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -49.6 -50.18 13.79 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 122.39 2.06 . . . . 0.0 113.16 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.01 -44.86 87.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.67 0.271 . . . . 0.0 110.86 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -39.51 75.47 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 tt -81.88 -33.22 30.64 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.002 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.51 -29.88 62.37 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.361 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.3 mtt -62.77 170.96 2.31 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.249 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -117.34 -51.49 2.52 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.253 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.07 -56.36 0.02 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 120.657 0.265 . . . . 0.0 111.032 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -83.1 107.68 15.84 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.66 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.44 157.6 43.21 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.266 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' THR . . . . . 0.406 HG21 ' HB2' ' A' ' 20' ' ' LYS . 21.9 p -146.09 149.04 33.3 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.377 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.2 pp -144.26 160.57 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.967 179.36 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.61 106.8 14.95 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.452 HG13 ' CE1' ' A' ' 46' ' ' TYR . 9.6 p -79.91 114.99 21.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.126 0.489 . . . . 0.0 110.996 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -110.7 169.38 8.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.973 -179.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -130.02 156.7 44.05 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.348 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -129.18 139.23 51.98 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.212 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -133.69 125.43 28.61 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.802 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -60.08 2.41 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.528 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.62 -42.34 1.6 Allowed Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.727 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.468 -1.184 . . . . 0.0 112.743 179.918 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 120.495 0.188 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 63.14 97.77 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.05 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -141.33 164.71 29.52 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.039 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 16.3 pt -105.71 124.55 60.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.417 . . . . 0.0 111.202 179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -85.57 122.73 30.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mp -119.44 134.17 55.35 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.366 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 11.6 mmtt -104.91 94.01 5.03 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.456 179.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 16.4 t -83.45 112.11 20.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.156 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.24 112.42 25.44 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.053 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.95 128.57 8.58 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.398 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -57.1 -36.0 70.11 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.509 0.195 . . . . 0.0 111.197 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -62.31 -30.54 71.22 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.132 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.53 57.47 0.19 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.581 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -149.76 107.57 3.69 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.709 0.29 . . . . 0.0 111.041 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.2 p -107.99 123.39 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.231 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.1 t -139.96 138.72 37.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.111 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -92.55 130.67 38.14 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.9 158.93 22.25 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.13 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 mtpm? -132.35 94.8 3.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.955 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.2 pt -115.27 179.43 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.25 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.9 166.55 11.73 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.838 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.0 33.2 1.36 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.148 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -145.3 28.71 1.19 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.12 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.6 p -135.58 131.25 19.23 Favored Pre-proline 0 C--O 1.231 0.131 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 40.5 Cg_exo -56.77 164.68 5.66 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.654 2.236 . . . . 0.0 112.509 -179.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 9.8 mt -55.54 -23.47 26.81 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.307 179.581 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.4 p -52.44 -42.57 64.26 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.04 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -49.41 77.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 110.772 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -65.58 -48.59 71.85 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.635 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -50.87 71.73 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.243 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -57.47 -56.01 27.35 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.814 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.07 87.76 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -62.79 -51.64 66.31 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.224 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 97.1 p -63.31 -44.05 96.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -65.37 -37.17 86.2 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.955 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -74.25 -41.1 61.83 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.267 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -67.12 0.68 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.285 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 147.53 45.97 0.03 OUTLIER Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.202 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -128.62 -163.42 1.28 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.743 0.306 . . . . 0.0 110.644 -179.9 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 m -138.39 174.57 10.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.004 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.0 ttp -96.32 30.3 2.56 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.007 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -115.97 -5.58 11.99 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.71 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -160.23 78.02 0.65 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.219 0.533 . . . . 0.0 110.156 179.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 15.5 mm -142.31 157.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.76 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.7 tpt180 -153.6 117.07 4.64 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.023 179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -98.95 143.31 29.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.343 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -133.75 134.57 43.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.344 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -117.6 104.98 11.57 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.401 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.58 37.05 25.44 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.012 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 82.6 25.37 50.67 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 121.02 -0.61 . . . . 0.0 113.042 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -119.77 101.43 48.12 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.803 0.302 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.32 122.06 10.54 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.99 2.46 . . . . 0.0 112.74 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 15.0 pt -138.24 154.95 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.228 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 36.9 m-20 -95.06 178.79 5.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.593 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.87 28.85 0.57 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.429 179.267 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 41.8 p -120.38 6.24 10.66 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -62.02 163.14 8.25 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.863 0.363 . . . . 0.0 111.462 -179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -166.04 -56.72 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.212 179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.27 -42.17 40.82 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 122.509 2.14 . . . . 0.0 112.728 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.76 -41.3 65.25 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.582 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -58.19 -37.57 75.02 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.22 -31.29 49.26 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.737 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -58.97 -34.48 71.85 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 17.7 mmt -66.62 173.67 3.29 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.324 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -126.19 -52.35 1.52 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.22 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -148.94 -58.09 0.21 Allowed 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.307 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -80.69 121.68 26.18 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.102 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -151.89 109.24 3.58 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.905 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -100.16 137.16 38.99 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -142.82 162.43 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.337 179.939 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -129.36 112.75 14.16 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.983 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 7.7 p -82.66 101.38 7.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.236 0.541 . . . . 0.0 110.778 179.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -89.82 164.46 14.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.123 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 mm-40 -121.15 128.45 52.52 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.969 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -67.59 -51.99 43.81 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.346 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 56.88 67.94 0.92 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.35 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -146.63 -60.34 0.3 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.049 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 87.62 -134.19 12.3 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 120.959 -0.638 . . . . 0.0 112.45 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.438 -1.201 . . . . 0.0 112.51 179.964 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 m120 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 120.693 0.282 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.84 87.34 4.06 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.3 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.7 m80 -156.31 109.94 2.71 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.661 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 21.3 pt -81.95 130.1 36.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 111.31 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -92.31 132.16 36.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.456 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.9 mp -137.94 132.07 31.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.082 179.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.66 100.47 11.17 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.487 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.72 117.76 29.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.323 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.89 115.97 26.01 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . 0.423 ' HA2' HG12 ' A' ' 85' ' ' VAL . . . -81.17 143.72 24.18 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.824 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -60.23 -27.65 67.38 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.62 39.1 1.03 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.71 93.44 0.04 OUTLIER Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.588 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 62.1 p -168.44 161.68 11.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.802 0.334 . . . . 0.0 111.538 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.3 p -152.27 109.65 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.14 179.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.7 t -137.62 135.28 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.222 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -104.71 139.62 39.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.118 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -128.72 153.12 47.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.196 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -129.46 124.14 33.31 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.904 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.3 pt -140.47 177.02 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.61 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 152.6 34.82 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.198 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -88.32 55.53 3.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 111.16 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.03 40.89 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.934 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.2 t -149.33 142.59 16.09 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.032 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.4 Cg_endo -69.37 167.78 22.93 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.795 2.33 . . . . 0.0 112.613 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.4 mt -66.51 -12.83 59.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.851 179.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.3 t -53.97 -36.23 62.65 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.605 0.24 . . . . 0.0 111.285 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -39.09 24.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.374 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 20.3 tp -68.23 -40.9 81.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.76 0.314 . . . . 0.0 110.547 179.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.472 ' HG3' ' CD1' ' A' ' 59' ' ' PHE . 2.0 ttm -67.14 -34.39 77.49 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.19 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -69.93 -47.8 60.98 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.635 0.255 . . . . 0.0 110.828 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.89 97.86 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.263 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -59.99 -44.52 94.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.593 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -38.82 88.34 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.119 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.96 -38.83 61.61 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.603 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.03 -46.6 73.93 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -68.35 -64.6 0.83 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.528 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 146.77 47.0 0.03 OUTLIER Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.267 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.6 mt -127.33 -161.0 1.04 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.96 157.89 28.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.769 0.318 . . . . 0.0 110.954 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.8 mtm -97.62 29.51 3.3 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -127.24 4.74 6.36 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.628 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.69 77.75 0.6 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.147 0.499 . . . . 0.0 110.314 179.634 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 11.4 mm -147.12 158.96 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.663 179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.7 ptp85 -154.92 145.45 22.21 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.239 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.472 ' CD1' ' HG3' ' A' ' 43' ' ' MET . 2.8 m-85 -117.28 164.78 14.3 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.006 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -148.96 119.77 7.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -91.43 94.77 9.64 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.453 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 56.23 39.73 30.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 85.92 21.37 53.17 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.336 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -108.79 114.87 58.17 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.97 0.385 . . . . 0.0 110.373 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.96 96.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.825 2.35 . . . . 0.0 112.329 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 10.7 pt -114.32 133.75 59.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.272 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -90.66 176.25 6.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.935 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -15.88 63.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.509 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 6.6 p -89.42 32.74 0.84 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.563 0.22 . . . . 0.0 111.543 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.25 155.7 37.99 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-O 120.484 0.183 . . . . 0.0 110.793 179.752 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -166.0 -57.15 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.376 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.434 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -46.67 -53.66 5.85 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.48 2.12 . . . . 0.0 113.152 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.34 96.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.757 0.313 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.42 -32.07 70.99 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.137 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.99 -33.2 51.46 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.688 0.28 . . . . 0.0 110.537 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -41.34 85.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.766 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -177.3 1.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.227 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -148.35 -59.21 0.24 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.415 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -136.85 23.34 3.09 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -166.14 93.71 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.788 0.328 . . . . 0.0 111.346 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 39.7 t0 -121.34 109.22 14.64 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.67 179.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.2 p -91.81 125.4 36.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.398 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -145.49 146.31 19.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.389 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -109.25 107.3 17.48 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.91 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.423 HG12 ' HA2' ' A' ' 23' ' ' GLY . 9.0 p -80.79 112.84 19.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 121.243 0.544 . . . . 0.0 111.159 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -96.47 158.86 15.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.954 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.19 151.69 46.79 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.731 -179.348 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -117.45 157.45 26.21 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.999 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 60.27 31.62 20.51 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.114 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.84 -53.07 0.39 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.709 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -131.26 97.77 0.37 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.329 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.181 0 CA-C-O 118.723 -1.043 . . . . 0.0 112.91 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.76 0.314 . . . . 0.0 111.532 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.97 164.22 14.08 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.613 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -139.36 129.66 25.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.134 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.8 pt -80.29 126.51 39.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.118 179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -85.94 106.21 16.97 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.348 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.23 125.23 50.75 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.416 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -93.17 90.27 6.78 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.138 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 18.8 t -81.52 100.16 5.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.152 -179.552 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.27 111.93 24.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.18 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.24 146.31 27.6 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.455 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.04 55.76 1.86 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 111.064 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -178.14 41.17 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.276 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.72 73.79 0.61 Allowed Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.073 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.4 p -166.53 106.22 0.64 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.761 0.281 . . . . 0.0 111.43 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -122.52 108.48 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.944 0.402 . . . . 0.0 111.302 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.1 t -121.01 149.93 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.316 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.96 113.85 26.91 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.159 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.78 150.32 24.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.05 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 mttp -130.74 124.62 31.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.41 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 pt -145.85 -180.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.395 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.13 152.43 34.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.114 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.07 59.49 2.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -168.62 39.84 0.03 OUTLIER 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.677 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 t -151.27 145.01 17.56 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.021 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.34 163.92 24.86 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.99 2.46 . . . . 0.0 112.509 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 12.3 mt -56.61 -27.45 58.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.046 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.3 p -51.66 -36.35 45.91 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -58.48 -63.46 1.27 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.556 0.217 . . . . 0.0 110.927 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.5 pp -65.53 -29.42 70.06 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.867 179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.5 mmt -59.21 -49.06 79.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.607 0.241 . . . . 0.0 110.618 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -66.57 -39.1 88.32 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.876 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.33 -45.77 68.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.506 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -61.86 -47.04 86.8 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 42.3 p -62.08 -37.73 86.12 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.748 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.01 -38.9 56.76 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.412 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.65 64.69 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -73.45 -70.19 0.38 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.714 0.292 . . . . 0.0 111.514 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 156.05 46.09 0.02 OUTLIER Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.068 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.5 mt -119.43 -159.92 0.79 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -128.32 161.36 29.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.85 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.08 27.81 3.47 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.121 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -131.09 8.49 4.75 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.21 77.71 0.64 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.251 0.548 . . . . 0.0 110.08 178.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 10.8 mm -144.8 158.39 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.636 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 26.2 ttt85 -149.53 141.71 24.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 179.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -119.29 160.7 21.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.894 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -146.17 109.99 4.89 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.464 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -89.27 101.91 14.58 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.118 179.083 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 t0 53.13 40.61 31.51 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.979 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 99.39 -35.15 4.89 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.961 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.44 112.77 14.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.658 0.229 . . . . 0.0 111.269 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.2 144.45 37.31 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.74 2.293 . . . . 0.0 112.873 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.447 HG22 HD13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -144.94 173.87 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 179.593 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -109.16 178.52 4.43 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.456 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.82 -12.78 61.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.431 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.8 p -89.79 28.32 1.37 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -76.15 169.04 18.94 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.647 0.26 . . . . 0.0 111.183 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.3 -54.82 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.367 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.89 -53.31 5.86 Favored 'Trans proline' 0 C--N 1.358 1.033 0 C-N-CA 122.669 2.246 . . . . 0.0 113.242 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.484 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . . . -61.3 -35.45 77.38 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.12 0.486 . . . . 0.0 110.647 179.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.49 -26.21 60.8 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.477 179.567 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -85.94 -36.61 19.76 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.621 0.248 . . . . 0.0 110.976 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . 0.484 ' HG2' ' HA ' ' A' ' 73' ' ' ALA . 11.5 pt-20 -66.23 -34.53 78.22 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.991 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -69.28 178.18 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.822 179.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 17.5 tt0 -136.48 -64.54 0.59 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.699 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -134.24 -48.17 0.78 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.318 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -92.76 114.37 26.91 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.691 0.281 . . . . 0.0 111.418 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -138.8 137.83 37.01 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -123.33 130.01 52.13 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.48 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.2 pp -147.84 152.43 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.145 179.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.23 111.54 22.67 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.122 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.7 p -82.62 111.8 19.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.253 0.549 . . . . 0.0 111.369 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -97.97 152.27 19.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.015 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -128.73 121.85 29.37 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.059 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.63 156.94 37.2 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.589 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.91 177.82 4.5 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.442 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 19.3 m 75.76 -64.78 0.35 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.474 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.01 108.5 2.71 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.779 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.519 -1.156 . . . . 0.0 112.516 179.58 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 120.695 0.283 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -116.3 105.87 13.03 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.346 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -152.27 138.44 18.31 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.882 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 25.4 pt -80.91 130.53 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -106.31 111.91 24.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.424 ' CD1' ' HB3' ' A' ' 81' ' ' ASP . 0.4 OUTLIER -124.48 136.4 53.98 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.785 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.4 mttp -97.25 97.4 9.13 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 24.3 t -82.5 108.49 15.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 -179.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.55 123.56 38.06 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.96 153.27 32.43 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.458 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -28.0 53.55 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -93.59 29.79 1.92 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.43 72.6 0.63 Allowed Glycine 0 C--N 1.337 0.588 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.098 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 m -150.5 92.97 1.91 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.756 0.312 . . . . 0.0 111.245 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.5 p -91.35 113.98 27.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.933 0.397 . . . . 0.0 111.054 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -116.61 138.65 46.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.159 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -86.24 143.93 27.69 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.129 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -138.0 149.3 45.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -135.51 115.7 13.38 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.161 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 1.2 pt -147.16 -179.83 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.834 0.349 . . . . 0.0 111.559 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.13 151.43 25.73 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.848 179.783 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.16 29.16 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.797 0.332 . . . . 0.0 111.517 179.668 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -122.44 37.48 4.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.7 t -154.64 142.63 14.19 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.631 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -64.06 168.83 11.55 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.656 2.237 . . . . 0.0 112.34 179.9 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 13.1 mt -55.0 -24.65 25.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.617 -179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.5 t -51.72 -39.61 58.72 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -60.16 -54.95 39.84 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.602 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 tp -65.99 -34.15 77.44 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.84 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.87 -61.19 2.8 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.957 179.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -59.52 -40.74 88.11 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -44.38 89.15 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.667 0.27 . . . . 0.0 111.373 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -65.68 -39.0 90.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.489 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 17.7 m -79.09 -48.27 14.65 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.358 -179.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -58.69 -37.63 76.48 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.102 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -68.85 -45.05 72.09 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.31 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -66.89 0.58 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.481 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.87 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.038 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.6 mt -120.6 -159.32 0.79 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.7 125.85 48.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.79 0.329 . . . . 0.0 110.91 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.5 -21.27 64.07 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.44 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -90.73 17.98 7.0 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.49 77.9 0.62 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 121.289 0.566 . . . . 0.0 110.438 178.531 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 13.5 mm -148.17 158.67 7.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.721 179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 17.7 ttt85 -150.19 142.42 24.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.054 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -117.82 130.77 56.48 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.419 179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.1 mmm-85 -116.59 102.31 9.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.784 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -90.44 105.1 17.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.726 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 45.18 43.37 7.78 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.914 0.486 . . . . 0.0 111.906 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . 0.432 ' O ' ' HD3' ' A' ' 65' ' ' PRO . . . 82.86 2.17 90.64 Favored Glycine 0 CA--C 1.526 0.724 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.318 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -99.47 104.55 27.9 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 117.21 0.505 . . . . 0.0 110.842 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.432 ' HD3' ' O ' ' A' ' 63' ' ' GLY . 52.9 Cg_exo -56.02 121.72 10.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.999 2.466 . . . . 0.0 112.366 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 24.6 pt -131.67 150.32 33.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.603 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.59 165.86 11.34 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.264 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -57.85 -26.1 61.61 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.412 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.87 -14.48 53.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.784 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -53.32 150.63 6.12 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.033 0.444 . . . . 0.0 111.655 -179.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -163.35 -56.27 0.01 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.151 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.52 -52.34 9.23 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 122.46 2.107 . . . . 0.0 112.71 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.99 79.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.992 0.425 . . . . 0.0 110.509 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -69.33 -21.62 63.83 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.432 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.07 -36.95 47.63 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -70.02 -36.38 75.04 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 8.1 mmt -106.76 97.02 6.86 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.328 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -139.96 67.91 1.37 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.408 -179.462 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -173.29 -64.07 0.02 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.977 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -135.2 83.22 2.01 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.477 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.424 ' HB3' ' CD1' ' A' ' 19' ' ' LEU . 11.8 t70 -127.07 135.17 50.41 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.878 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 30.2 p -115.98 144.32 44.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.405 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 2.4 pt -141.05 165.13 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.604 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -115.57 104.65 11.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.748 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 13.3 p -80.17 115.5 22.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.168 0.509 . . . . 0.0 111.418 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -109.14 154.2 22.66 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.066 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -142.56 157.17 44.99 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -67.18 -33.31 75.12 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.956 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -102.66 179.98 4.14 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.934 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.9 p -115.6 37.59 3.54 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.162 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 126.74 -151.04 18.03 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.555 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.664 179.884 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.3 m-20 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 120.816 0.341 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -139.02 176.41 8.71 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.148 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.451 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 47.2 m80 -142.88 160.57 40.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.729 0.3 . . . . 0.0 111.21 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.419 HG12 ' O ' ' A' ' 33' ' ' ILE . 6.8 pt -108.14 122.06 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 121.1 0.476 . . . . 0.0 110.98 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -80.33 102.04 9.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.339 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mp -103.57 138.17 40.62 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.873 0.368 . . . . 0.0 111.571 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -96.61 100.04 11.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.237 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 22.4 t -83.39 93.8 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.59 125.23 39.11 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.286 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.77 161.2 17.77 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.593 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -92.32 43.11 1.12 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.944 0.402 . . . . 0.0 110.852 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.92 34.38 0.21 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.4 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.12 56.68 7.65 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.713 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 p -140.83 98.28 3.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.723 0.297 . . . . 0.0 111.185 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.8 m -115.07 92.65 2.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.944 0.402 . . . . 0.0 110.928 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.84 145.69 28.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.321 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -118.2 116.9 27.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -114.72 170.6 8.2 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.451 ' HG2' ' HB2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -110.41 151.99 26.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.419 ' O ' HG12 ' A' ' 17' ' ' ILE . 6.2 tp -158.64 149.0 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.247 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.7 144.84 26.34 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.794 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ptp85 -81.92 57.67 3.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.97 0.414 . . . . 0.0 111.021 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.95 23.73 0.66 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.461 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -162.17 148.93 11.02 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 120.512 0.196 . . . . 0.0 110.764 179.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -54.08 161.18 5.28 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.886 2.39 . . . . 0.0 112.59 179.828 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.405 ' HG ' ' HB2' ' A' ' 74' ' ' GLN . 11.0 mt -61.28 -17.22 52.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.875 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.05 -37.58 54.12 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.478 0.18 . . . . 0.0 111.082 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -43.01 88.02 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.893 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.8 -47.42 46.62 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.6 tmm? -59.65 -44.51 93.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.252 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -59.5 -49.71 76.71 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.746 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.33 -34.6 78.34 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.491 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -72.5 -53.32 12.4 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.503 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -60.21 -43.72 95.72 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.147 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.27 -42.88 99.38 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.706 0.289 . . . . 0.0 110.827 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.437 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -78.48 -71.99 0.4 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.672 0.273 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.24 45.58 0.02 OUTLIER Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.118 -0.563 . . . . 0.0 112.151 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.4 mt -127.24 -164.94 1.41 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.695 0.283 . . . . 0.0 110.516 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -143.72 176.45 9.23 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.979 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -93.59 28.13 2.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.266 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -118.31 -3.67 10.98 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.48 77.92 0.63 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.192 0.52 . . . . 0.0 110.206 179.456 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 11.6 mm -144.98 157.86 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.921 179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 5.6 tpt180 -141.2 121.98 14.38 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -111.8 127.47 55.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -127.49 103.31 7.28 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.423 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 61.3 t80 -81.12 101.38 9.59 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.01 35.04 24.85 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.099 -179.19 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 103.71 -38.14 3.39 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 121.004 -0.617 . . . . 0.0 113.132 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.03 110.61 3.41 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.671 0.235 . . . . 0.0 111.202 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.17 129.5 16.21 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.086 2.524 . . . . 0.0 112.787 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 pp -145.79 163.07 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.494 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -103.86 177.32 4.88 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.854 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -64.73 -17.79 64.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.584 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.3 p -88.81 33.39 0.78 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -83.46 177.46 8.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.658 0.266 . . . . 0.0 111.312 179.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -169.89 -54.25 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 82.9 Cg_exo -47.63 -57.28 2.42 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 122.409 2.073 . . . . 0.0 112.802 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.95 -41.87 97.13 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.78 0.324 . . . . 0.0 110.692 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.405 ' HB2' ' HG ' ' A' ' 39' ' ' LEU . 20.3 tm0? -57.27 -41.42 79.7 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.9 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.3 -32.44 38.05 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.733 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -29.3 60.65 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.923 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.16 173.92 2.25 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.966 0.412 . . . . 0.0 111.283 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 14.5 pt-20 -135.2 -49.54 0.74 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.412 179.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -169.41 -41.72 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.246 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -108.35 106.87 17.21 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.717 0.294 . . . . 0.0 111.02 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -152.94 161.9 41.98 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.199 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.7 t -140.43 156.8 46.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.323 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -143.72 157.99 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.158 179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -115.81 92.88 4.04 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.517 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 34.3 m -83.95 111.3 19.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 111.592 -179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -99.24 156.4 16.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.103 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -132.04 148.43 52.5 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.145 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -95.67 173.56 7.42 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.91 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.96 38.42 3.94 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.476 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.63 94.08 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.432 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -100.92 -154.46 26.85 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.048 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.195 0 CA-C-O 118.671 -1.072 . . . . 0.0 113.119 -179.933 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 120.685 0.278 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -151.04 145.18 25.34 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.927 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -124.47 116.8 23.1 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.569 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 32' ' ' LYS . 8.1 pt -86.48 117.0 30.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 111.136 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -90.02 92.56 9.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.309 0.576 . . . . 0.0 111.211 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.24 126.71 38.49 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.417 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -84.18 128.45 34.57 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.808 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.8 t -109.94 114.38 46.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.796 0.332 . . . . 0.0 111.334 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -103.0 120.81 41.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.985 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.33 144.7 26.01 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.691 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.2 pm0 -54.98 -33.07 62.19 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -70.0 -25.84 63.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.87 -5.53 6.49 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 121.098 -0.573 . . . . 0.0 113.059 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.1 p -66.85 154.24 41.42 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.536 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -141.13 108.53 2.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.23 146.13 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.168 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -104.32 148.66 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.215 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -148.66 151.08 34.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.083 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 1.6 ptmm? -136.0 134.72 38.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.089 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.7 pt -145.35 178.11 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.365 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.03 139.7 32.34 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.62 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.39 54.74 2.68 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.853 0.359 . . . . 0.0 111.109 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -158.97 32.87 0.21 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -151.92 157.19 34.39 Favored Pre-proline 0 N--CA 1.466 0.358 0 CA-C-O 120.632 0.253 . . . . 0.0 111.142 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -58.32 163.98 9.46 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.932 2.421 . . . . 0.0 112.775 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.453 HD11 HD11 ' A' ' 66' ' ' ILE . 7.8 mt -62.46 -23.32 66.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.699 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -52.93 -32.1 43.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.831 -0.168 . . . . 0.0 111.335 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -53.23 60.26 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.652 0.263 . . . . 0.0 110.867 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -75.18 -35.76 61.52 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.897 179.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.51 -52.0 65.2 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.365 -179.873 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -60.31 -52.84 63.56 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.76 -34.52 62.68 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.248 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -71.49 -54.59 10.09 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.022 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.86 -37.07 75.69 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.107 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -49.73 34.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.238 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.577 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -65.29 -69.76 0.27 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.344 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.08 45.66 0.07 OUTLIER Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.048 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 mt -114.41 -157.89 0.65 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.2 m -126.05 156.04 40.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.846 0.355 . . . . 0.0 111.063 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.57 28.78 2.18 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.174 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -129.31 3.27 5.15 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -157.68 77.52 0.83 Allowed 'General case' 0 CA--C 1.521 -0.153 0 CA-C-O 121.068 0.461 . . . . 0.0 109.903 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 7.4 mm -145.3 154.95 13.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.772 179.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.85 143.83 33.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.715 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -118.2 129.69 55.65 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.414 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 21.3 mtt-85 -124.07 100.12 6.57 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.243 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 37.4 t80 -89.82 109.38 20.38 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.699 179.767 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 t70 56.9 37.15 28.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.134 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.25 25.55 59.16 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.923 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.53 125.02 26.97 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.875 0.337 . . . . 0.0 110.851 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.0 127.27 14.93 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.885 2.39 . . . . 0.0 112.738 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.453 HD11 HD11 ' A' ' 39' ' ' LEU . 3.7 pt -146.49 161.55 9.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.379 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -107.9 174.14 6.01 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.977 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.93 1.14 32.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.655 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.2 p -92.38 0.87 57.48 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -64.69 173.64 2.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.812 0.339 . . . . 0.0 111.328 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.75 -56.53 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.357 -179.661 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -49.46 -44.37 35.04 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.438 2.092 . . . . 0.0 112.808 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -71.57 -41.54 68.9 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.707 0.289 . . . . 0.0 110.799 179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -38.05 89.64 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.72 -33.4 46.76 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.719 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -68.79 -21.3 64.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.243 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.0 mtt -61.85 177.52 0.43 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.983 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -116.09 -63.5 1.44 Allowed 'General case' 0 C--O 1.233 0.203 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -170.86 -54.44 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.167 -179.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -86.81 108.6 18.8 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.173 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -151.56 164.28 37.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.208 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 6.2 t -144.14 149.53 36.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.927 0.394 . . . . 0.0 111.5 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -140.0 175.07 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.629 -179.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.52 102.63 6.95 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.415 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.8 p -79.97 121.64 33.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 111.184 -179.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -115.37 143.13 45.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.797 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -136.51 129.92 31.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.746 0.308 . . . . 0.0 111.242 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.36 172.02 3.85 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.124 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.3 -52.54 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.914 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.1 p -84.57 65.56 9.07 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.776 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 128.15 133.35 3.7 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 121.074 -0.584 . . . . 0.0 112.44 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.969 0 CA-C-O 118.351 -1.249 . . . . 0.0 112.729 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 120.747 0.308 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.45 179.2 5.94 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.036 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 7.4 m80 -149.99 148.19 28.77 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.12 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.9 pt -98.75 123.89 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 111.061 179.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -83.76 102.02 12.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.455 ' HG ' ' HB3' ' A' ' 81' ' ' ASP . 8.0 mp -109.78 130.04 55.56 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.12 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -96.66 93.56 6.81 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.514 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.5 t -82.78 122.37 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.127 -179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.81 118.22 36.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.7 138.15 14.45 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.605 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -56.69 -43.56 80.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.559 0.218 . . . . 0.0 111.332 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.68 -28.02 66.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.526 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.66 54.18 0.22 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.275 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.6 p -134.89 103.81 5.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.9 95.89 4.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.05 137.16 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.197 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -94.19 87.26 5.2 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -91.37 142.24 27.9 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 1.5 pttt -114.64 138.72 50.33 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.214 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.417 HG12 ' CD1' ' A' ' 42' ' ' LEU . 1.7 pp -144.32 -179.74 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.471 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.98 148.65 26.78 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.256 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.95 28.44 1.57 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.799 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -126.31 29.4 5.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.695 0.283 . . . . 0.0 111.015 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.65 151.71 29.06 Favored Pre-proline 0 N--CA 1.463 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.63 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -67.71 156.8 64.57 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.559 2.173 . . . . 0.0 112.242 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.2 mt -57.91 -22.46 48.62 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.155 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.414 ' O ' ' HG3' ' A' ' 43' ' ' MET . 41.8 t -49.76 -36.16 24.92 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.725 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -46.55 61.95 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.538 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.417 ' CD1' HG12 ' A' ' 33' ' ' ILE . 6.9 tt -62.6 -52.64 62.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.696 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.414 ' HG3' ' O ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -58.59 -35.43 72.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.076 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.86 6.76 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.008 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -43.04 95.22 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.586 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 78.7 t80 -60.15 -48.34 82.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.338 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.3 m -74.41 -34.81 63.37 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.234 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.03 -50.15 51.28 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.108 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -56.09 -36.45 68.15 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.011 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.81 -55.48 8.44 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.466 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.5 -18.43 0.89 Allowed Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.492 -179.304 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -62.41 -178.73 0.2 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.945 0.402 . . . . 0.0 110.894 179.604 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -107.12 173.77 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.285 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.3 ptt? -104.35 26.35 9.03 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.419 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.62 13.38 2.74 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -160.66 77.88 0.61 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.221 0.534 . . . . 0.0 110.225 179.352 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 9.9 mm -149.12 160.88 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.418 179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . 0.5 ' HD2' ' HB2' ' A' ' 86' ' ' PHE . 0.1 OUTLIER -156.77 139.6 15.21 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.612 0.244 . . . . 0.0 111.469 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.415 ' CE2' ' HB ' ' A' ' 85' ' ' VAL . 15.1 m-85 -117.47 160.83 20.57 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.776 0.322 . . . . 0.0 111.378 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -137.35 127.19 25.61 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.138 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.424 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 24.4 t80 -106.16 91.76 3.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.457 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 58.18 37.04 26.25 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.261 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 89.32 23.04 35.55 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.021 -0.609 . . . . 0.0 113.02 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.424 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 0.0 OUTLIER -114.81 103.95 54.49 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.756 0.278 . . . . 0.0 110.484 179.802 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.7 93.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.807 2.338 . . . . 0.0 112.138 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.7 pt -103.01 135.71 39.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.097 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -79.93 157.73 26.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.829 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.33 51.7 0.72 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.821 0.343 . . . . 0.0 110.978 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.1 t -166.56 25.36 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.717 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -77.03 -175.16 3.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.635 0.255 . . . . 0.0 110.922 179.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.82 -58.05 0.01 OUTLIER Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.271 -179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -45.7 -50.74 9.1 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.591 2.194 . . . . 0.0 113.065 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.62 -49.46 66.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.7 -29.31 69.26 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.261 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -33.71 47.42 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.749 0.309 . . . . 0.0 110.414 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.53 -50.26 74.43 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.74 148.25 26.46 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.537 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.8 tt0 -164.81 61.29 0.13 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.036 -179.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -179.27 -60.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.45 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -142.22 96.74 3.0 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.753 0.311 . . . . 0.0 110.859 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.455 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 9.8 t70 -127.71 114.32 17.17 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.736 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.29 131.37 36.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.882 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -129.91 166.73 26.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.1 179.98 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.502 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 2.6 m-20 -133.84 105.87 7.01 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.663 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.415 ' HB ' ' CE2' ' A' ' 59' ' ' PHE . 9.8 p -92.83 112.99 27.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.143 0.497 . . . . 0.0 111.324 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.502 ' CE1' ' HB3' ' A' ' 84' ' ' ASP . 92.6 m-85 -105.37 166.53 10.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.774 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -167.29 156.16 10.0 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.192 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 63.07 93.85 0.05 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.233 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -127.97 -176.9 3.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.916 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.8 26.77 15.77 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.733 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.1 78.03 0.21 Allowed Glycine 0 C--N 1.337 0.624 0 C-N-CA 121.192 -0.528 . . . . 0.0 113.049 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.45 -1.194 . . . . 0.0 112.688 179.742 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 120.582 0.23 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -157.02 86.39 0.97 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.382 -179.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.435 ' CG ' ' HG2' ' A' ' 32' ' ' LYS . 2.4 m170 -161.56 119.83 2.35 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.714 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 13.1 pt -80.96 130.06 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 111.063 179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -81.5 116.72 21.42 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.041 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 7.9 tt -131.52 135.95 47.48 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.091 -179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -104.25 106.04 16.4 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.293 179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 23.4 t -82.42 124.44 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.14 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.83 177.67 4.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.13 148.95 20.87 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.787 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -52.37 -38.51 58.99 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 111.433 179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.45 33.27 2.51 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.588 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.77 83.72 0.2 Allowed Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.785 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.59 68.18 1.31 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.726 0.298 . . . . 0.0 111.493 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.6 t -84.54 107.8 16.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.988 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -124.56 148.98 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.433 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -93.07 110.88 22.37 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.844 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -112.75 165.66 12.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.435 ' HG2' ' CG ' ' A' ' 16' ' ' HIS . 6.9 tttt -130.36 143.62 50.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.01 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.7 tt -154.91 148.44 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.08 -179.764 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -77.77 176.56 8.93 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.044 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -112.07 49.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.895 0.378 . . . . 0.0 111.453 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -157.59 33.24 0.27 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.237 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.03 143.88 10.56 Favored Pre-proline 0 N--CA 1.466 0.344 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.981 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.33 164.29 7.12 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.809 2.339 . . . . 0.0 112.65 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.447 ' CD1' ' HB3' ' A' ' 70' ' ' ASP . 12.6 mt -60.24 -14.78 19.61 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 p -51.98 -33.14 36.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.467 0.175 . . . . 0.0 111.16 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -57.06 -58.63 7.36 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.671 0.272 . . . . 0.0 110.543 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 tp -61.76 -38.11 86.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.72 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.53 -55.13 32.37 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.988 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -61.41 -43.92 98.04 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.234 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.31 -42.0 94.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.565 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -78.13 -42.53 31.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.448 -179.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.5 p -65.47 -43.01 91.61 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.473 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.58 -34.89 62.98 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.902 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.42 -57.09 12.64 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.579 0.228 . . . . 0.0 111.464 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.86 -47.8 11.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.226 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.33 57.09 0.63 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.718 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -91.15 -78.92 0.38 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.607 0.241 . . . . 0.0 110.4 179.63 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -172.06 157.97 4.5 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.698 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -37.34 7.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.692 0.282 . . . . 0.0 110.523 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -101.57 27.29 6.47 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.4 ' C ' HG12 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.62 77.83 0.61 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.084 0.468 . . . . 0.0 110.518 179.076 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.4 HG12 ' C ' ' A' ' 56' ' ' GLN . 10.8 mm -152.59 157.58 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.466 179.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -159.02 123.31 3.98 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.166 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -93.63 151.9 19.36 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.767 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.03 127.09 35.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.246 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -103.44 91.87 4.24 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.326 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.5 39.56 30.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.127 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.83 21.12 29.28 Favored Glycine 0 CA--C 1.522 0.518 0 C-N-CA 121.07 -0.586 . . . . 0.0 113.032 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -118.46 94.8 47.9 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 116.855 0.327 . . . . 0.0 110.436 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -52.96 105.88 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.972 2.448 . . . . 0.0 112.47 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.7 pt -113.03 160.29 12.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.325 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -103.68 164.4 11.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.096 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -68.13 -15.06 63.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.39 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 14.9 p -91.29 30.49 1.26 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.447 ' HB3' ' CD1' ' A' ' 39' ' ' LEU . 3.0 t70 -75.08 155.97 36.58 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 111.35 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -160.68 -55.27 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.422 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 54.8 Cg_exo -52.41 -53.75 6.36 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.356 2.037 . . . . 0.0 112.759 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.84 -37.42 86.75 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.868 0.366 . . . . 0.0 110.493 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.05 -20.11 65.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.452 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -81.58 -35.19 30.47 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.92 -40.2 91.22 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.976 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.16 122.9 47.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.579 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.83 31.29 0.95 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.523 -179.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -148.62 -51.29 0.16 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.28 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.13 99.45 4.13 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.652 0.263 . . . . 0.0 110.905 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -140.33 133.14 29.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 24.7 p -125.47 136.48 53.42 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.545 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -138.2 161.6 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.35 179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -125.63 118.72 26.27 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.636 179.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 13.6 p -82.7 121.34 35.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.232 0.539 . . . . 0.0 111.148 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 9.4 m-85 -107.46 164.35 12.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.78 -179.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -129.11 126.25 38.93 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.239 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.86 178.87 0.2 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.45 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -138.85 99.89 3.91 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.15 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 23.6 m -63.99 -38.0 89.46 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.926 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -167.08 -50.94 0.03 OUTLIER Glycine 0 C--N 1.333 0.387 0 C-N-CA 121.172 -0.537 . . . . 0.0 112.307 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.14 0 CA-C-O 118.654 -1.081 . . . . 0.0 112.758 -179.81 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.3 m120 . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.47 148.96 25.3 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.453 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -147.21 175.18 10.94 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.26 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.3 pt -104.77 128.66 58.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -82.21 119.68 24.39 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.235 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.4 mt -123.86 116.95 23.77 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.75 0.309 . . . . 0.0 111.362 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -96.54 93.33 6.72 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.483 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.424 ' HB ' ' CE2' ' A' ' 46' ' ' TYR . 21.9 t -94.96 122.42 46.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.003 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -93.68 123.45 37.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.268 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -83.8 148.55 24.81 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.831 -179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.95 -37.83 72.1 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.49 0.186 . . . . 0.0 111.238 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.21 -28.37 67.93 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.469 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.6 31.96 2.63 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.205 -0.521 . . . . 0.0 112.592 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.0 m -110.86 144.86 39.24 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.756 0.312 . . . . 0.0 110.852 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.8 p -112.02 117.13 54.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.178 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.15 133.03 69.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.934 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -117.82 106.55 13.13 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.007 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -97.86 155.56 17.0 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.4 mtmm -131.95 113.09 13.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.992 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 45.4 pt -129.29 178.54 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.412 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -80.66 147.37 30.69 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.941 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -89.02 54.72 3.09 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.232 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.6 m170 -159.84 35.27 0.18 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.094 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.5 145.15 16.64 Favored Pre-proline 0 N--CA 1.465 0.308 0 CA-C-N 116.704 -0.225 . . . . 0.0 110.962 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -56.12 158.69 14.09 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.902 2.402 . . . . 0.0 112.801 -179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.6 mt -57.62 -23.74 52.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.805 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 t -47.77 -35.02 9.27 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.99 0.181 . . . . 0.0 111.342 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmt -60.08 -57.63 12.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.958 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.4 tt -71.11 -36.83 72.31 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.128 179.685 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -49.79 75.99 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.239 -179.855 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -62.6 -48.47 79.29 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.601 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.06 92.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.485 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.524 ' CE1' HG12 ' A' ' 85' ' ' VAL . 21.5 t80 -69.87 -45.62 67.29 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.02 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 t -68.35 -47.53 67.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.444 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -59.66 -40.66 88.46 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.99 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -66.65 -39.42 88.21 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.057 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -66.1 0.65 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.293 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.63 46.06 0.1 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.292 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 15.0 mt -119.78 -154.64 0.58 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -127.49 166.0 18.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.795 0.331 . . . . 0.0 111.077 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -95.88 25.98 4.37 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.263 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . 0.472 ' O ' ' HG3' ' A' ' 56' ' ' GLN . 20.2 mtt180 -134.75 9.8 3.63 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . 0.472 ' HG3' ' O ' ' A' ' 55' ' ' ARG . 0.0 OUTLIER -157.96 77.63 0.82 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.109 0.481 . . . . 0.0 109.738 178.938 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 8.4 mm -144.66 155.22 14.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.814 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -144.79 116.77 8.3 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.167 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.55 101.64 13.13 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.128 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -85.19 143.24 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.072 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . 0.421 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 54.0 t80 -137.21 86.25 2.19 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.656 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.67 37.61 20.53 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.001 0.429 . . . . 0.0 111.115 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.48 36.19 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.143 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . 0.421 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 1.7 mm100 -115.94 98.47 51.18 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.996 0.398 . . . . 0.0 110.84 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -68.51 107.3 1.59 Allowed 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.685 2.257 . . . . 0.0 112.265 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.9 pt -122.84 144.82 30.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.503 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -86.95 178.21 7.02 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.165 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.51 36.48 0.31 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.881 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.2 p -136.71 17.38 3.08 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -67.25 162.88 21.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.006 0.431 . . . . 0.0 111.785 -179.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -163.13 -54.95 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.551 179.836 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 76.4 Cg_exo -50.45 -52.22 9.43 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.441 2.094 . . . . 0.0 113.247 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.19 96.75 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.802 0.334 . . . . 0.0 110.956 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.93 -33.96 71.18 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.23 -34.56 59.22 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.593 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.85 -36.35 72.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 4.8 mmt -70.09 179.25 2.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.242 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -132.03 -58.14 0.96 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.484 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -145.82 -66.91 0.3 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.373 0.13 . . . . 0.0 111.317 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.0 119.85 20.52 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.94 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -146.72 143.26 28.58 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.274 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 132.07 55.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -138.11 167.79 21.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.919 179.778 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.45 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 2.7 m-20 -142.47 110.47 5.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.256 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.524 HG12 ' CE1' ' A' ' 46' ' ' TYR . 13.9 p -92.45 113.86 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.022 0.439 . . . . 0.0 111.11 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.45 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 22.6 m-85 -130.8 170.48 14.33 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.883 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -85.89 151.51 23.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.898 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -74.14 0.08 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.255 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -116.85 -33.37 4.8 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.252 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.7 t 42.86 82.29 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.238 0.615 . . . . 0.0 111.755 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.82 42.32 0.62 Allowed Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.633 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.477 -1.179 . . . . 0.0 112.514 -179.983 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m120 . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 120.57 0.224 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 59.19 59.83 2.58 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.525 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . 0.437 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 29.3 m80 -155.42 107.68 2.67 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.609 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.439 HG12 ' O ' ' A' ' 33' ' ' ILE . 6.8 pt -79.76 128.07 38.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.724 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -84.05 119.09 24.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.195 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -122.28 137.26 54.91 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.859 0.362 . . . . 0.0 111.498 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -101.73 97.26 7.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.365 179.472 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.5 t -85.51 118.46 32.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.262 -179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.49 113.58 27.02 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.0 156.12 39.56 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.569 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -92.72 29.76 1.7 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -133.38 26.05 4.13 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.257 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.98 61.74 4.71 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.604 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -162.21 114.15 1.67 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.797 0.332 . . . . 0.0 111.409 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.16 130.19 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 t -147.36 153.38 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.43 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -119.87 137.05 54.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.702 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -122.96 154.09 38.86 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.437 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -104.83 113.14 26.54 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.738 179.837 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.439 ' O ' HG12 ' A' ' 17' ' ' ILE . 8.9 tp -124.49 153.81 31.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.346 -179.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.91 153.54 18.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.872 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.78 58.1 3.76 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.371 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -164.62 32.63 0.07 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.534 179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 6.1 p -157.62 153.22 22.46 Favored Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.885 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.57 155.09 22.46 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.735 2.29 . . . . 0.0 112.622 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -61.4 -20.02 62.57 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.979 -179.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.84 -34.22 26.94 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.519 0.199 . . . . 0.0 110.957 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.1 mmmt -54.19 -42.95 70.29 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.908 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.57 -45.54 30.01 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.746 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.1 ttp -57.08 -36.8 71.0 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.053 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 27.9 mmtm -77.97 -54.0 6.79 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.051 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.59 -32.34 62.98 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.414 ' CZ ' HG11 ' A' ' 85' ' ' VAL . 56.4 t80 -79.47 -52.69 7.71 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.485 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.9 p -66.31 -37.02 84.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.299 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.08 -47.27 68.73 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.062 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 mtt180 -59.87 -49.09 79.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.376 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -64.39 -69.15 0.3 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.28 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.2 38.24 0.13 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.943 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -107.99 -153.54 0.51 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.743 0.272 . . . . 0.0 110.563 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.9 p -95.96 119.68 34.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.932 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -72.86 -4.69 33.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.802 179.557 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -120.01 23.45 11.01 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.502 0.191 . . . . 0.0 111.216 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.76 77.78 0.6 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.199 0.523 . . . . 0.0 110.452 179.173 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 15.4 mm -150.86 160.11 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.149 179.504 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.14 150.65 30.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.447 179.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 64.8 m-85 -116.37 161.06 19.62 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.76 179.629 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -139.59 114.79 9.71 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.438 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -108.46 101.42 10.6 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.306 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 53.18 46.95 25.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.076 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 74.33 19.88 79.74 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.001 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.21 86.65 33.17 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.83 0.315 . . . . 0.0 110.84 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.38 150.96 31.64 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.037 2.491 . . . . 0.0 112.667 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.5 pt -141.01 171.57 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.634 -179.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -119.19 171.13 8.5 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -30.82 63.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.887 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 42.4 p -78.92 8.22 5.91 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.47 175.89 1.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.869 0.366 . . . . 0.0 111.457 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.82 -55.74 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.522 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -46.91 -51.99 8.39 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.346 2.031 . . . . 0.0 112.919 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.9 91.48 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.828 0.347 . . . . 0.0 110.64 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 15.9 tp60 -58.71 -34.5 71.38 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.192 179.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 tt -79.48 -33.24 42.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -62.76 -26.11 68.54 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.237 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.34 160.23 5.42 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 111.492 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.5 tt0 -125.02 -76.98 0.59 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.879 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.57 26.62 0.23 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -174.86 102.87 0.09 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.524 0.202 . . . . 0.0 111.259 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -146.9 130.4 16.79 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.875 0.369 . . . . 0.0 111.54 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -102.92 144.33 31.36 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.367 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 3.3 pt -150.35 168.07 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.575 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -127.1 106.92 9.59 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.295 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.414 HG11 ' CZ ' ' A' ' 46' ' ' TYR . 13.8 p -83.06 119.13 31.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.052 0.453 . . . . 0.0 111.242 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -102.67 125.41 49.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.36 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -137.09 97.92 3.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.175 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 60.85 98.08 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.473 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -157.58 -54.47 0.07 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.098 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.46 94.44 2.51 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.641 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -145.72 -149.24 4.96 Favored Glycine 0 C--N 1.334 0.421 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.759 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.497 179.921 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 120.62 0.248 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -93.41 73.84 4.49 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.56 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -150.23 130.44 13.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.931 179.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 33' ' ' ILE . 6.6 pt -86.63 127.14 40.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.709 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -81.35 94.37 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.299 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -93.01 132.14 37.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.205 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -113.56 104.75 12.56 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.492 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 36.5 t -87.92 128.6 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.184 -179.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -127.24 147.12 50.22 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.19 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -108.78 158.71 14.52 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.58 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -63.74 -45.6 89.14 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.594 0.235 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.96 -28.2 67.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.303 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.9 50.63 0.16 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.366 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -98.7 151.76 20.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.702 0.287 . . . . 0.0 111.118 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.3 p -152.05 111.62 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.358 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 14.7 m -137.25 156.87 34.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.402 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -127.35 128.56 46.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -137.65 151.5 48.34 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -104.23 125.2 50.31 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.844 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.459 ' O ' HG12 ' A' ' 17' ' ' ILE . 8.9 tp -136.62 153.1 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.187 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.02 148.24 22.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.755 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.74 53.99 2.55 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.006 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -150.58 29.32 0.69 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.323 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.6 153.06 25.67 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.972 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.32 162.02 42.27 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.639 2.226 . . . . 0.0 112.287 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.3 mt -63.31 -19.54 64.69 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.94 -179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.449 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -48.71 -36.13 15.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.565 0.221 . . . . 0.0 111.23 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.18 -62.24 2.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.124 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 12.6 tp -62.82 -33.86 76.1 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.883 179.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.403 ' HG2' ' CD1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -55.68 -61.97 2.0 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.685 179.548 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -59.5 -37.54 78.55 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.137 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.508 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -73.47 -45.54 53.5 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.439 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.7 m -61.78 -50.01 74.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.409 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.51 72.12 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.997 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.16 68.5 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.892 179.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.11 -52.11 15.46 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.084 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.73 -11.85 3.69 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.71 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.7 mt -74.71 -166.0 0.41 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.751 0.276 . . . . 0.0 110.631 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.18 169.17 9.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.092 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.5 29.62 3.21 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.113 179.396 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.22 3.05 5.18 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.48 77.99 0.63 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.082 0.468 . . . . 0.0 110.275 179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 9.9 mm -141.97 157.78 20.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.996 179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -136.63 133.48 36.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.933 0.397 . . . . 0.0 111.454 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.403 ' CD1' ' HG2' ' A' ' 43' ' ' MET . 2.4 m-85 -123.63 109.84 14.25 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.054 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -109.45 139.71 44.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.757 0.313 . . . . 0.0 111.4 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 43.9 t80 -114.41 102.24 9.9 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.109 179.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 52.18 35.12 15.87 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.077 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.71 24.93 19.35 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.022 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.3 104.67 54.58 Favored Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.878 0.339 . . . . 0.0 110.962 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.84 109.04 2.23 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.754 2.302 . . . . 0.0 112.848 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.8 pt -131.71 150.17 33.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.139 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -89.63 174.85 7.52 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.984 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 40' ' ' SER . 2.0 pt-20 -73.58 51.73 0.37 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.341 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.8 p -151.7 19.33 0.71 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.491 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -68.75 173.02 5.59 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.84 0.352 . . . . 0.0 111.805 -179.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.11 -56.85 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.606 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.13 -51.68 9.01 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 122.548 2.165 . . . . 0.0 113.044 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.55 91.34 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.931 0.396 . . . . 0.0 110.593 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -61.5 -38.73 88.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.012 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.18 -34.84 37.18 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.695 0.283 . . . . 0.0 110.642 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -59.2 -29.72 67.69 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.926 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.419 ' HG2' ' HB2' ' A' ' 81' ' ' ASP . 0.3 OUTLIER -66.77 -177.81 0.65 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.405 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.46 -53.91 0.25 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.275 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -146.12 -53.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -87.82 128.33 35.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.842 0.354 . . . . 0.0 110.868 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.419 ' HB2' ' HG2' ' A' ' 77' ' ' MET . 42.4 t0 -149.78 126.3 10.9 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.907 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.5 p -125.6 131.58 52.68 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.14 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -136.52 164.18 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.725 179.805 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -126.2 106.36 9.49 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.332 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 33.1 m -84.83 118.48 31.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.027 0.442 . . . . 0.0 111.181 -179.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.29 173.58 6.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.513 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -133.49 165.34 25.11 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.058 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.78 130.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.175 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.52 -68.24 0.94 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.194 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.5 m 60.65 97.43 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.779 0.323 . . . . 0.0 111.116 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -75.29 -137.73 0.59 Allowed Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.825 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.475 -1.181 . . . . 0.0 112.443 -179.712 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 120.74 0.305 . . . . 0.0 111.629 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -70.0 149.86 47.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.175 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -133.46 139.25 46.59 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.8 pt -80.54 126.9 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 121.048 0.451 . . . . 0.0 111.539 -179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -87.57 105.27 17.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.021 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.41 ' HG ' ' HB3' ' A' ' 81' ' ' ASP . 1.5 mp -111.62 124.94 53.36 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.03 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -96.79 102.43 14.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.45 179.649 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 13.4 t -82.4 123.16 38.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.622 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.42 102.95 9.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.098 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.76 153.67 31.55 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.468 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -59.91 -33.6 72.07 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -61.29 -31.65 71.49 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.443 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.15 83.4 0.97 Allowed Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.548 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.7 t -157.93 152.06 24.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.674 0.273 . . . . 0.0 111.247 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.3 t -141.28 93.11 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -112.19 137.15 46.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.067 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -99.65 87.29 3.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.949 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.32 132.64 35.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.018 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 13.8 mtmm -111.97 96.51 6.09 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.1 pt -107.0 179.02 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.223 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.62 149.39 22.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.823 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -85.93 51.49 2.22 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.856 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -154.96 34.13 0.39 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.906 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.17 153.31 29.36 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.785 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.7 Cg_endo -70.7 163.84 37.59 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.63 2.22 . . . . 0.0 112.405 179.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.6 mt -59.58 -24.68 63.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 179.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.52 -33.73 46.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.638 0.256 . . . . 0.0 111.287 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -57.62 7.38 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.276 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.6 tt -63.64 -43.57 96.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.116 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.2 -50.18 74.46 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.415 -179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.62 -53.25 58.68 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.69 65.87 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.722 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -79.63 -53.67 6.61 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.045 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.0 t -58.83 -36.35 74.4 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.12 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -72.93 -41.99 63.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.421 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -43.01 93.5 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.498 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -71.83 -76.27 0.11 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.267 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 152.18 39.86 0.03 OUTLIER Glycine 0 C--N 1.334 0.451 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.158 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -96.78 -166.78 1.45 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.256 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.64 159.34 23.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.949 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.93 25.81 3.95 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.358 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 -139.61 14.7 2.53 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.458 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 2.5 pt20 -160.8 77.66 0.59 Allowed 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.269 0.557 . . . . 0.0 110.076 179.124 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 9.4 mm -145.47 157.2 13.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.795 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -157.37 130.23 7.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.82 179.819 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.418 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -103.43 148.5 25.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.576 179.468 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -145.43 127.15 15.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.194 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -100.14 98.74 9.41 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.246 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.72 37.7 28.99 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.081 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.47 24.95 31.98 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.114 -0.565 . . . . 0.0 113.069 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -117.03 108.79 43.6 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.98 0.39 . . . . 0.0 110.659 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -52.1 115.8 2.39 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.044 2.496 . . . . 0.0 112.679 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.418 HG13 ' HB3' ' A' ' 59' ' ' PHE . 10.6 pt -139.16 148.0 24.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.267 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -94.9 170.45 9.42 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.734 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -83.11 23.77 0.84 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.539 179.225 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 p -116.46 11.76 14.97 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 122.457 -0.152 . . . . 0.0 111.111 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -65.79 168.64 7.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.898 0.38 . . . . 0.0 111.188 -179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.39 -55.22 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.341 -179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.92 -48.05 21.04 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.53 2.153 . . . . 0.0 112.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.87 89.07 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.627 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.25 -33.38 69.32 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.905 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.33 -32.49 49.2 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.725 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -58.66 -39.78 81.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.734 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.26 175.85 2.5 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.201 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -123.47 -52.44 1.82 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.573 -179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -159.73 -57.13 0.06 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.875 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.07 117.06 16.49 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.145 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.41 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 27.4 t70 -158.92 153.15 23.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 32.6 p -137.7 145.65 42.81 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.399 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -145.25 154.37 13.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.528 179.587 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -118.42 121.19 39.73 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.078 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 13.8 p -94.12 111.56 25.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 121.19 0.519 . . . . 0.0 110.849 178.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -95.88 146.26 24.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.112 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -125.06 107.78 11.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.038 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.77 163.77 16.38 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.074 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -140.07 -70.42 0.39 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.021 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 19.1 m -149.85 102.34 3.13 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.768 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -84.05 111.2 3.42 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.509 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.535 -1.147 . . . . 0.0 112.485 179.961 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.2 m120 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 120.83 0.348 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -109.9 129.0 55.7 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.977 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.29 123.9 1.16 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.324 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.45 HG12 ' O ' ' A' ' 33' ' ' ILE . 22.6 pt -80.65 129.64 37.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -98.81 104.65 16.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.399 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.75 139.3 35.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.466 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -111.3 105.46 14.12 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.354 179.549 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . 0.403 HG11 ' CZ ' ' A' ' 46' ' ' TYR . 22.0 t -90.32 129.7 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.307 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -115.98 113.7 23.61 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.372 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.86 146.18 28.02 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.01 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -56.15 -51.83 66.57 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.503 0.192 . . . . 0.0 111.428 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -63.42 -23.72 67.53 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.407 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.13 88.94 1.03 Allowed Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.579 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.4 p -153.76 127.38 8.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.705 0.288 . . . . 0.0 111.252 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.86 97.11 5.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.874 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.43 135.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.24 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -110.09 115.86 30.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.082 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -104.75 165.04 11.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.113 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.9 mtpp -135.23 111.59 9.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.45 ' O ' HG12 ' A' ' 17' ' ' ILE . 27.1 pt -129.14 173.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.371 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 158.99 19.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.809 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . 0.431 ' HD3' ' HA ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -90.76 52.56 2.21 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.831 0.348 . . . . 0.0 111.265 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -160.59 35.48 0.16 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.88 148.26 17.68 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 120.485 0.183 . . . . 0.0 111.142 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.43 ' HA ' ' O ' ' A' ' 70' ' ' ASP . 35.6 Cg_exo -62.08 165.03 15.41 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.977 2.451 . . . . 0.0 112.878 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 8.8 mt -62.77 -17.87 61.74 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.885 179.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.9 p -50.94 -34.59 29.29 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -54.44 45.51 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.47 -41.12 89.5 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.346 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.448 ' HE2' ' HB3' ' A' ' 68' ' ' GLU . 7.4 mmm -59.3 -53.72 55.0 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.521 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -55.12 -54.0 48.78 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.095 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.3 81.28 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.409 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.41 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 71.6 t80 -69.6 -37.15 76.77 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.414 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -76.94 -34.36 57.64 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.668 0.271 . . . . 0.0 111.03 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -78.16 -37.14 46.58 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.389 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.41 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -60.17 -36.31 77.3 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.773 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.93 -70.62 0.62 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.396 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.33 46.27 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.944 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -112.02 -160.03 0.7 Allowed 'General case' 0 C--O 1.233 0.227 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 t -130.47 163.33 27.22 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.9 0.381 . . . . 0.0 111.191 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.6 ttp -93.11 26.75 2.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.289 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -135.49 14.36 3.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.474 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -160.85 77.93 0.59 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.267 0.556 . . . . 0.0 110.541 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 8.3 mm -148.46 158.78 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.747 179.848 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -142.28 134.24 27.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.155 179.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -121.83 124.97 45.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.302 179.411 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -124.4 120.82 33.19 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.055 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -100.55 95.29 6.61 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.455 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.49 41.65 32.07 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.119 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.46 25.66 32.56 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.969 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -114.98 94.5 38.54 Favored Pre-proline 0 C--O 1.232 0.177 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -56.16 93.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.901 2.401 . . . . 0.0 112.458 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 27.1 pt -114.34 166.11 8.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.191 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -110.14 175.23 5.51 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.777 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.448 ' HB3' ' HE2' ' A' ' 43' ' ' MET . 1.4 pm0 -65.48 -14.9 62.0 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.654 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 80.5 p -91.08 29.39 1.4 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.43 ' O ' ' HA ' ' A' ' 38' ' ' PRO . 3.0 t70 -73.59 167.48 21.26 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 120.407 0.146 . . . . 0.0 111.114 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.486 ' N ' ' HD2' ' A' ' 72' ' ' PRO . 17.2 m -169.0 -58.59 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 71' ' ' THR . 5.3 Cg_endo -47.24 -51.22 9.82 Favored 'Trans proline' 0 C--N 1.358 1.04 0 C-N-CA 122.943 2.428 . . . . 0.0 112.773 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.22 -41.16 92.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.053 0.454 . . . . 0.0 110.261 179.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -67.94 -33.14 74.11 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.092 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.431 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -75.68 -38.94 58.27 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 110.426 179.779 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.74 -40.66 88.81 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.059 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 30.9 mmt -70.61 176.35 4.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.322 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -129.71 -47.17 1.15 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.481 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -149.16 -64.54 0.23 Allowed 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 120.523 0.201 . . . . 0.0 111.219 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.62 106.73 2.28 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.006 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -145.76 117.28 8.04 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.832 0.349 . . . . 0.0 111.111 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.22 146.26 41.61 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.467 -179.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 2.2 pp -146.88 161.33 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.586 179.674 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -115.76 100.01 7.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.738 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 14.3 p -79.85 113.59 19.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.164 0.506 . . . . 0.0 110.874 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -104.71 125.59 50.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.112 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -84.92 121.5 27.84 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.812 0.339 . . . . 0.0 111.177 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.39 112.49 19.98 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.713 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.2 141.2 58.74 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.096 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.4 m -123.76 103.48 8.4 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.762 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -162.99 -53.78 0.02 OUTLIER Glycine 0 CA--C 1.519 0.29 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.497 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.303 -1.276 . . . . 0.0 112.403 179.882 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 120.633 0.254 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -125.65 149.15 48.68 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.968 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 5.7 m170 -160.93 143.55 12.69 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.672 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.409 HG12 ' O ' ' A' ' 33' ' ' ILE . 8.5 pt -92.45 129.6 42.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-O 121.152 0.501 . . . . 0.0 111.174 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -82.36 119.6 24.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.286 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -129.93 124.74 33.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.079 179.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -107.93 108.87 20.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.261 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.9 t -81.07 113.1 19.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.036 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -101.4 105.26 16.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.051 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.47 146.27 27.24 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.384 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -24.52 47.73 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.73 40.71 1.05 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.738 0.304 . . . . 0.0 111.455 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.29 39.04 89.62 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.061 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 t -102.05 114.56 28.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.778 0.289 . . . . 0.0 110.97 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.33 98.95 6.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.983 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -126.79 134.6 65.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -84.39 149.48 25.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -154.31 132.91 12.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.016 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -94.69 149.65 21.02 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.744 179.794 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.409 ' O ' HG12 ' A' ' 17' ' ' ILE . 7.8 tp -157.12 148.52 10.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.563 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.4 pttt -76.96 165.77 24.23 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.947 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -101.23 48.88 0.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.126 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.05 32.83 0.34 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.198 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.45 149.25 22.33 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.94 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.4 ' HA ' HG21 ' A' ' 71' ' ' THR . 56.0 Cg_endo -70.16 170.31 17.36 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.786 2.324 . . . . 0.0 112.722 -179.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.402 ' CD1' ' HB2' ' A' ' 70' ' ' ASP . 6.2 mt -58.14 -22.34 50.7 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.544 179.542 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 t -49.9 -39.2 39.06 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.638 0.256 . . . . 0.0 110.758 178.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -46.46 87.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.173 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 tp -70.66 -47.52 59.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.732 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.41 ' HE2' ' HG2' ' A' ' 68' ' ' GLU . 0.0 OUTLIER -57.99 -43.7 86.73 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.122 179.884 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -60.68 -50.76 72.19 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.949 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.65 -45.72 74.48 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.69 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.443 ' CE2' HG12 ' A' ' 85' ' ' VAL . 81.7 t80 -61.97 -45.41 93.77 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.248 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -69.53 -37.79 77.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -72.74 -37.63 67.66 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.164 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -63.77 -33.8 76.47 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.506 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -81.34 -75.13 0.3 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.612 0.244 . . . . 0.0 111.312 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.49 45.8 0.02 OUTLIER Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.9 mt -114.27 -160.31 0.73 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.713 0.292 . . . . 0.0 110.254 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.9 -179.49 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.905 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 mtm -100.04 30.61 3.67 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.093 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.46 0.26 8.24 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.32 77.75 0.63 Allowed 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 121.251 0.548 . . . . 0.0 110.242 179.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 8.1 mm -144.28 156.7 15.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.668 179.793 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.2 tpt180 -158.65 126.84 5.22 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.972 179.499 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.63 144.14 42.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.283 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.7 mtt180 -131.66 135.98 47.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.109 -179.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -123.85 113.63 18.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.532 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 t0 56.25 37.05 28.47 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.66 22.67 63.84 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 121.043 -0.599 . . . . 0.0 113.11 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -119.21 127.41 26.5 Favored Pre-proline 0 C--O 1.231 0.128 0 CA-C-N 116.775 0.287 . . . . 0.0 110.871 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.25 110.07 2.56 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.759 2.306 . . . . 0.0 112.34 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 31.4 pt -116.61 176.61 2.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.132 179.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -133.28 179.41 6.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.155 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.41 ' HG2' ' HE2' ' A' ' 43' ' ' MET . 0.0 OUTLIER -79.87 40.08 0.45 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.474 179.643 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -141.14 16.59 2.26 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.149 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.402 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . 0.2 OUTLIER -72.94 168.8 18.23 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 120.762 0.315 . . . . 0.0 111.453 -179.912 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.4 HG21 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -167.38 -57.34 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.421 179.897 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -47.76 -51.42 9.82 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.433 2.089 . . . . 0.0 113.095 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.39 98.78 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.835 0.35 . . . . 0.0 110.73 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -29.34 69.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.267 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.98 -31.8 39.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 110.709 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.85 -40.49 95.54 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.28 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.49 149.27 25.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.94 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.81 51.34 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.844 0.354 . . . . 0.0 111.647 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -170.79 -54.4 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.131 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -142.07 95.03 2.74 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -127.98 135.14 49.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.146 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -117.23 133.45 55.98 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.73 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -123.96 165.01 21.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.859 -179.912 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . 0.461 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -129.43 104.04 7.26 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.767 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . 0.443 HG12 ' CE2' ' A' ' 46' ' ' TYR . 14.6 p -86.46 117.48 31.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.132 0.492 . . . . 0.0 111.136 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . 0.461 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 79.6 m-85 -108.43 150.88 26.8 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.454 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -119.66 166.08 13.66 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.021 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 67.49 179.25 0.23 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.299 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -86.24 -62.51 1.5 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.976 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 45.7 p 44.97 78.03 0.07 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.399 0.437 . . . . 0.0 111.713 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -96.76 36.78 3.71 Favored Glycine 0 CA--C 1.522 0.469 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.857 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.369 -1.24 . . . . 0.0 112.832 179.514 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 54.9 t30 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 120.52 0.2 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.42 119.17 28.61 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.941 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.99 124.1 16.43 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.904 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 14.4 pt -80.23 126.51 39.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-O 120.958 0.409 . . . . 0.0 111.221 -179.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -92.62 93.45 8.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.513 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.04 122.1 40.76 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.806 0.336 . . . . 0.0 111.006 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 103.56 13.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.577 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 17.2 t -88.69 110.52 21.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.205 -179.817 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -116.36 111.81 20.61 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.9 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.0 149.63 22.33 Favored Glycine 0 C--N 1.333 0.393 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.545 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.08 -31.97 61.59 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -64.18 -28.2 69.59 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.411 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 114.12 48.3 0.57 Allowed Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.617 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -125.69 113.27 17.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.594 0.235 . . . . 0.0 110.998 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 m -112.29 125.71 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.228 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.51 168.2 23.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -122.61 95.66 4.72 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.04 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -92.85 137.5 32.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.01 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 35.3 mtpt -126.85 111.87 14.68 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.994 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.4 178.88 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.416 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 155.36 35.08 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.06 30.16 2.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.424 179.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -136.29 35.23 2.76 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.709 0.29 . . . . 0.0 110.808 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.6 t -145.93 138.22 13.59 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.743 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.41 156.51 8.17 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.694 2.263 . . . . 0.0 112.572 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.427 ' CD1' ' HB2' ' A' ' 70' ' ' ASP . 12.7 mt -54.03 -22.51 10.79 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.944 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 t -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.572 0.225 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.15 -53.66 55.6 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.655 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.9 tt -67.08 -41.37 86.5 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.791 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.411 ' HG2' ' HB3' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -56.0 -58.12 9.25 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.133 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -56.64 -42.2 78.5 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.83 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.58 -35.25 77.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.32 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 83.1 t80 -77.14 -52.14 9.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.601 -179.761 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 p -60.93 -39.22 88.62 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.573 0.225 . . . . 0.0 111.195 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.16 -40.96 77.86 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.035 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -72.67 -40.67 66.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -73.66 -66.47 0.7 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.389 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.28 46.73 0.05 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.081 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -123.08 -159.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.86 163.65 21.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.913 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 5.8 mtm -97.97 27.81 4.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -132.59 8.45 4.22 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.5 77.97 0.62 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-O 121.228 0.537 . . . . 0.0 110.233 179.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 11.7 mm -143.69 158.16 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.586 179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 4.1 tpt180 -142.12 123.38 14.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.145 179.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -107.13 136.04 47.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.655 179.494 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.4 mtm-85 -135.42 140.3 44.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.367 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -120.23 101.63 7.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.273 179.484 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.45 34.76 24.83 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.22 -179.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 102.26 -27.94 18.13 Favored Glycine 0 CA--C 1.522 0.485 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.983 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -68.51 113.44 15.61 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.906 0.353 . . . . 0.0 111.007 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -75.13 118.9 5.39 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.592 2.195 . . . . 0.0 112.366 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.3 pt -124.32 174.39 8.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.316 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -112.76 178.12 4.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.282 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.411 ' HB3' ' HG2' ' A' ' 43' ' ' MET . 0.5 OUTLIER -84.24 16.69 2.86 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.673 179.567 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.15 15.72 7.27 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.575 0.226 . . . . 0.0 111.098 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . 0.427 ' HB2' ' CD1' ' A' ' 39' ' ' LEU . 0.4 OUTLIER -72.8 118.29 15.55 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.753 0.311 . . . . 0.0 110.832 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.422 ' HB ' ' HD3' ' A' ' 72' ' ' PRO . 0.7 OUTLIER -112.0 -50.46 0.05 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.063 -179.737 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . 0.422 ' HD3' ' HB ' ' A' ' 71' ' ' THR . 74.3 Cg_exo -50.38 -58.45 1.68 Allowed 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 122.216 1.944 . . . . 0.0 112.513 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.1 -37.95 89.14 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.9 0.381 . . . . 0.0 110.038 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.6 tm0? -54.39 -45.24 72.83 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.547 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tt -76.32 -31.93 58.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.58 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.28 -27.97 57.11 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.11 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 29.9 mmt -60.13 168.55 1.89 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.723 0.297 . . . . 0.0 110.92 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.19 -62.01 1.31 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.138 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -156.41 -60.96 0.1 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.453 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.85 111.71 22.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.995 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -140.14 146.71 39.17 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.239 -179.526 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.78 137.92 51.85 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.283 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -152.33 158.71 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -131.17 120.02 22.71 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.649 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.4 p -85.68 120.95 36.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 121.048 0.451 . . . . 0.0 111.083 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -108.14 158.37 17.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.217 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.5 169.45 8.45 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.058 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -96.27 33.1 1.82 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.29 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.7 tp60 -135.52 76.87 1.64 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.657 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.3 m -134.05 -62.65 0.75 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.007 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.62 -104.83 2.56 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.748 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.335 -1.258 . . . . 0.0 112.514 -179.743 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.832 0.348 . . . . 0.0 110.962 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -122.19 90.67 3.35 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.967 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m80 -146.76 158.97 44.04 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.154 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 12.8 pt -100.92 124.78 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.773 179.588 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -90.69 111.1 22.31 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.113 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . 0.429 ' CD2' HG13 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -109.65 125.38 52.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.465 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 8.3 mttp -95.91 104.68 16.63 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.366 179.438 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.6 t -89.31 120.11 37.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.158 -179.714 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -118.08 92.14 3.75 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.03 166.03 49.7 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -84.75 48.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.73 0.3 . . . . 0.0 111.19 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -148.58 32.5 0.79 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.071 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.98 30.58 66.86 Favored Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.541 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.25 135.47 54.02 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.702 0.287 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.6 m -144.23 103.71 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.194 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.3 t -125.13 141.52 44.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.185 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.85 102.75 12.56 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.99 0.424 . . . . 0.0 110.954 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.15 143.27 31.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.787 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -119.95 136.18 54.62 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.844 0.354 . . . . 0.0 111.27 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.3 pt -135.12 179.55 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.022 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.7 159.46 26.65 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.69 43.59 1.1 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 110.932 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -151.3 35.46 0.58 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -148.44 141.91 15.82 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.752 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_endo -65.19 173.59 5.96 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.728 2.285 . . . . 0.0 112.525 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 11.2 mt -56.1 -24.18 38.7 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.382 179.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.4 t -50.4 -40.52 50.2 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.342 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -58.72 -58.6 7.86 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.022 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -59.44 -42.93 93.08 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.818 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' MET . . . . . 0.447 ' HG2' ' CE1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -60.59 -54.7 42.28 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.141 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -60.7 -50.52 73.17 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.007 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.94 81.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.382 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -69.61 -53.17 20.08 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -44.58 92.21 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.135 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.99 -45.59 92.22 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.851 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.77 78.55 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.126 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -74.9 -75.81 0.16 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.224 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.77 46.63 0.02 OUTLIER Glycine 0 C--N 1.334 0.45 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.196 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 mt -124.9 -163.26 1.16 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.625 0.25 . . . . 0.0 110.416 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.5 m -115.96 170.97 8.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.032 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ptm -102.38 22.89 12.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.432 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.67 15.72 2.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.62 78.03 0.62 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.168 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 14.6 mm -146.44 157.98 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.604 179.836 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 2.7 tpt180 -142.93 109.0 5.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.328 179.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.447 ' CE1' ' HG2' ' A' ' 43' ' ' MET . 9.3 m-85 -105.23 151.17 24.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.342 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 56.2 mtt180 -146.21 136.87 24.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.882 0.372 . . . . 0.0 111.294 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 67.0 t80 -96.58 94.81 7.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.155 179.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.03 35.78 20.38 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 112.9 -30.21 7.58 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.946 -0.645 . . . . 0.0 113.253 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -75.56 112.98 22.04 Favored Pre-proline 0 CA--C 1.533 0.312 0 CA-C-N 116.859 0.33 . . . . 0.0 111.431 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -59.96 137.62 77.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.914 2.409 . . . . 0.0 112.988 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 17.8 pt -147.56 158.68 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.996 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -137.44 176.18 8.94 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.302 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.85 81.35 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.316 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.0 t -177.66 -28.09 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.018 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -51.89 167.15 0.12 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.933 0.397 . . . . 0.0 111.733 -179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -162.17 -55.99 0.01 OUTLIER Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.263 179.844 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_exo -45.19 -48.29 11.47 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.385 2.057 . . . . 0.0 112.806 -179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.36 87.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.056 0.455 . . . . 0.0 110.063 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . 0.413 ' HG2' ' HE3' ' A' ' 77' ' ' MET . 13.9 tm0? -58.25 -34.61 70.65 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.819 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -32.4 61.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.472 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -43.62 84.45 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.836 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' MET . . . . . 0.413 ' HE3' ' HG2' ' A' ' 74' ' ' GLN . 3.8 ptt? -74.77 150.8 39.25 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.843 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.68 -43.9 0.48 Allowed 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.94 -67.74 0.93 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -179.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -94.46 127.59 40.47 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.869 0.366 . . . . 0.0 111.312 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -157.76 143.86 17.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.591 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 57.8 p -137.36 149.06 46.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.915 0.388 . . . . 0.0 111.477 -179.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.429 HG13 ' CD2' ' A' ' 19' ' ' LEU . 1.1 pp -154.6 152.76 9.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.619 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -109.79 133.11 53.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.127 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 8.4 p -107.95 103.6 15.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.273 0.559 . . . . 0.0 111.239 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -103.38 169.07 8.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.653 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -137.19 139.77 41.32 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.162 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.3 168.4 12.72 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.117 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -161.53 160.73 29.42 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.026 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.86 78.65 1.14 Allowed 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.455 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -85.02 133.07 11.5 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.751 -179.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.377 -1.235 . . . . 0.0 112.48 179.999 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -127.53 74.99 1.56 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.877 0.37 . . . . 0.0 110.94 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -144.77 152.02 39.73 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 18.2 pt -98.86 124.32 52.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.119 179.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 -84.41 122.4 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.056 -179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -119.56 117.28 27.94 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.258 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 95.27 10.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.325 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.3 t -83.88 122.1 37.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.3 -179.538 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.68 119.29 37.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.227 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -83.6 136.38 14.91 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.752 -179.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.23 -35.81 81.58 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -58.4 -32.68 68.86 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.292 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.89 45.67 0.2 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 121.193 -0.527 . . . . 0.0 112.389 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.52 160.8 38.66 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.662 0.268 . . . . 0.0 110.969 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.0 t -142.03 101.57 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.4 t -105.59 147.17 11.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.075 179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -114.86 122.77 47.34 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.221 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -129.99 146.36 51.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.92 144.42 51.0 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.37 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.8 pt -145.11 178.96 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.367 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.49 148.25 26.06 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.629 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.8 56.65 4.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.884 0.373 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -165.05 35.41 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.4 ' HB ' ' HD3' ' A' ' 41' ' ' LYS . 0.0 OUTLIER -155.95 146.85 16.38 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-O 120.629 0.252 . . . . 0.0 111.307 179.962 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.4 161.63 7.09 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.051 2.5 . . . . 0.0 113.102 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 10.5 mt -59.74 -22.31 61.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.739 179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.08 -31.36 18.68 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.245 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . 0.4 ' HD3' ' HB ' ' A' ' 37' ' ' THR . 0.0 OUTLIER -56.79 -61.63 2.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.902 179.903 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tt -66.78 -45.26 79.01 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.5 mmm -53.86 -41.55 67.62 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.328 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -66.09 -57.9 6.67 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.949 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ALA . . . . . 0.412 ' O ' ' HB2' ' A' ' 49' ' ' ARG . . . -59.55 -34.24 72.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.927 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 35.0 t80 -60.34 -60.81 3.22 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.231 -179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.52 -28.3 69.86 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.271 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.43 -56.6 4.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.412 ' HB2' ' O ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -57.13 -41.32 78.83 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.467 -179.636 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.16 -72.41 0.25 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.137 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.06 41.81 0.09 OUTLIER Glycine 0 C--N 1.335 0.492 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.779 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -103.74 -152.5 0.45 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 110.559 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.83 122.44 47.67 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.747 0.308 . . . . 0.0 110.929 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.2 tpt -63.34 -26.43 68.76 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.487 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.3 25.9 7.75 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.7 78.04 0.61 Allowed 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.126 0.488 . . . . 0.0 110.467 179.125 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 20.2 mm -146.88 159.14 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.847 179.651 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 ttm-85 -141.0 135.34 31.04 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.732 179.82 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PHE . . . . . 0.405 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -120.96 143.03 49.22 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -135.04 119.33 17.78 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.378 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -107.15 103.52 12.94 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.268 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.74 38.2 29.34 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.91 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.94 28.52 49.97 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.159 -0.543 . . . . 0.0 112.966 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -124.72 107.1 29.11 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-N 116.849 0.324 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.06 129.34 32.82 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.082 2.521 . . . . 0.0 112.855 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . 0.405 HG13 ' HB3' ' A' ' 59' ' ' PHE . 11.0 pt -146.95 145.83 19.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.467 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -99.31 173.72 6.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.712 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.78 47.9 0.44 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.672 0.273 . . . . 0.0 111.608 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.5 p -148.35 18.01 1.06 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.572 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -74.41 176.7 6.53 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.23 -56.7 0.01 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.365 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -48.37 -48.63 16.46 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.562 2.175 . . . . 0.0 112.887 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.15 -42.14 76.36 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.759 0.314 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.73 -37.99 74.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.684 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.69 -31.99 57.61 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.518 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.48 -30.93 67.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.831 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.5 mtt -62.47 170.78 2.24 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.407 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -137.92 -52.97 0.63 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.425 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -156.61 -61.71 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -96.82 120.47 37.21 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.755 0.312 . . . . 0.0 111.172 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 159.28 43.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.266 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -122.91 151.1 42.1 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.458 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.404 HG21 HD11 ' A' ' 83' ' ' ILE . 1.2 mt -144.51 168.07 10.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.923 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 16.4 m-20 -137.86 97.2 3.37 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.677 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 13.4 p -82.08 119.8 32.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.033 0.444 . . . . 0.0 111.138 179.847 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -99.34 129.13 45.52 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.983 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -109.46 143.34 39.21 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -132.61 152.66 51.57 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 -115.37 -55.2 2.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.195 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.0 m -101.02 -60.28 1.55 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.129 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 139.16 160.38 8.34 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.793 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.496 -1.169 . . . . 0.0 112.453 -179.894 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.767 0.318 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -142.22 146.14 34.88 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.465 HD12 HD11 ' A' ' 19' ' ' LEU . 16.5 pt -93.27 125.63 45.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.055 0.455 . . . . 0.0 111.208 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -94.18 89.37 5.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.836 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.465 HD11 HD12 ' A' ' 17' ' ' ILE . 6.8 mp -90.25 123.68 34.24 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.25 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.85 93.18 4.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.261 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.755 HG22 HD13 ' A' ' 83' ' ' ILE . 31.9 t -85.52 125.34 40.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.17 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.73 117.07 33.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.953 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.67 149.75 27.42 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.634 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -19.59 54.15 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.06 31.84 0.96 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.24 41.07 94.69 Favored Glycine 0 C--N 1.338 0.655 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.846 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.2 t -115.67 127.32 55.09 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.607 0.242 . . . . 0.0 111.094 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.3 m -117.09 115.29 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.118 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.2 t -136.95 134.23 48.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.248 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -105.56 154.64 20.1 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.159 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -135.78 146.18 47.33 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -119.02 111.94 18.94 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.144 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.1 pt -145.86 178.87 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.2 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.4 159.98 18.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.729 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.86 31.86 2.54 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.331 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.31 31.6 5.01 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.127 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.18 157.96 42.04 Favored Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.844 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.674 ' HA ' HG23 ' A' ' 71' ' ' THR . 57.8 Cg_endo -70.83 163.27 39.71 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.63 2.22 . . . . 0.0 112.645 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.686 HD12 ' HB3' ' A' ' 70' ' ' ASP . 10.1 mt -66.15 -12.98 59.36 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.832 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 61.8 m -51.29 -33.81 30.39 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.524 0.202 . . . . 0.0 111.26 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -56.43 5.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.559 -0.292 . . . . 0.0 110.958 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.81 -46.61 88.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.094 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -48.7 80.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.77 -54.28 44.56 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.79 -34.71 67.91 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.462 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.466 ' CE1' HG11 ' A' ' 85' ' ' VAL . 39.4 t80 -74.65 -54.85 6.64 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.978 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.448 ' HA ' HD12 ' A' ' 52' ' ' LEU . 42.5 t -59.8 -41.24 90.77 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.295 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -68.51 -37.06 79.72 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.317 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.65 -39.67 44.3 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.521 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -67.11 -64.91 0.76 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.348 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.39 46.96 0.05 OUTLIER Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.063 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 47' ' ' SER . 2.6 mt -122.25 -161.39 0.93 Allowed 'General case' 0 C--O 1.234 0.253 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.406 ' O ' HD11 ' A' ' 57' ' ' ILE . 0.9 OUTLIER -123.59 166.92 14.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.915 179.86 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 68.7 mtp -96.08 24.51 5.54 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.308 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -136.7 12.85 3.18 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.458 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.597 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.5 OUTLIER -160.84 78.12 0.6 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.121 0.486 . . . . 0.0 110.334 179.157 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.597 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.8 mm -141.94 156.86 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.037 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.412 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -156.89 116.28 3.42 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.944 179.617 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -95.8 123.6 39.44 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.721 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -106.53 117.86 35.15 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.253 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -121.6 101.98 7.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.345 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.9 38.75 29.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 76.84 25.35 64.9 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.102 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -125.51 91.11 49.39 Favored Pre-proline 0 C--O 1.233 0.19 0 CA-C-N 116.859 0.329 . . . . 0.0 110.737 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 115.82 2.63 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.01 2.474 . . . . 0.0 112.32 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.521 HD12 ' CD1' ' A' ' 39' ' ' LEU . 18.1 pt -117.51 140.92 38.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.341 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -90.44 172.73 8.52 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.752 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.79 -20.11 65.88 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.393 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 21.7 p -85.93 28.06 0.83 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.686 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -84.34 168.02 16.0 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.658 0.266 . . . . 0.0 111.149 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.674 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -171.01 -57.85 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.253 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -47.16 -50.28 11.35 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.624 2.216 . . . . 0.0 113.009 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.96 -45.41 85.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.792 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -60.87 -31.73 71.19 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.189 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 tt -75.96 -37.22 58.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.807 0.337 . . . . 0.0 110.347 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.79 -33.87 70.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.03 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 16.1 mtt -64.6 169.56 4.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.396 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -111.71 -54.68 2.59 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.989 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -175.01 -48.46 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.432 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -84.92 93.31 8.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.997 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -141.14 138.25 33.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.903 0.383 . . . . 0.0 111.366 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.87 142.23 39.78 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.22 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.755 HD13 HG22 ' A' ' 21' ' ' VAL . 0.1 OUTLIER -135.34 167.84 24.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.665 179.854 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.438 ' H ' HG22 ' A' ' 83' ' ' ILE . 65.4 m-20 -133.62 108.49 8.6 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.566 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.466 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.0 p -82.15 121.92 36.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.042 0.449 . . . . 0.0 111.203 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -123.14 167.45 13.67 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.319 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 . . . . . 0 CA--C 1.533 0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.733 -179.816 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.746 0.308 . . . . 0.0 110.638 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 m80 -135.83 158.79 43.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.049 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.46 HD11 HG13 ' A' ' 33' ' ' ILE . 14.5 pt -96.63 124.63 49.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.272 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -89.17 91.01 8.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.465 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 1.013 HD23 HD11 ' A' ' 83' ' ' ILE . 2.0 mp -107.43 124.23 49.56 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.282 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.878 ' HB2' HG22 ' A' ' 82' ' ' THR . 8.7 mttt -90.6 116.37 28.44 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.687 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.5 t -101.03 112.34 33.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.102 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.84 124.05 44.72 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.183 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.08 139.2 20.27 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.511 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -58.61 -30.64 67.39 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.11 -32.26 67.95 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.56 0.219 . . . . 0.0 111.536 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 125.25 45.03 0.26 Allowed Glycine 0 C--N 1.334 0.422 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.461 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.7 m -140.41 160.67 39.47 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.623 0.249 . . . . 0.0 110.89 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -140.76 114.14 5.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 120.818 0.342 . . . . 0.0 111.158 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 t -113.67 140.59 33.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.259 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -90.15 113.46 25.22 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.902 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.37 160.53 25.22 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 pttm -154.08 148.56 26.17 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.388 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.46 HG13 HD11 ' A' ' 17' ' ' ILE . 24.7 pt -146.91 178.04 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.321 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.43 148.38 25.01 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.419 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -82.95 55.64 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.962 0.41 . . . . 0.0 111.055 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m170 -156.93 31.29 0.3 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.955 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.43 150.78 25.89 Favored Pre-proline 0 N--CA 1.463 0.218 0 CA-C-O 120.625 0.25 . . . . 0.0 111.32 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.04 174.22 10.07 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.082 2.522 . . . . 0.0 112.794 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 66' ' ' ILE . 9.5 mt -61.21 -24.77 66.58 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.7 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 -36.46 64.89 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.527 0.203 . . . . 0.0 110.763 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -46.63 84.78 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.541 179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.434 ' HB2' HD13 ' A' ' 33' ' ' ILE . 3.4 tt -66.48 -51.71 53.86 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.448 ' HG3' ' CE1' ' A' ' 59' ' ' PHE . 5.4 ttp -60.28 -35.97 76.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.624 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -62.89 -58.89 5.83 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.585 0.231 . . . . 0.0 110.777 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.23 88.88 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.597 ' CE2' HG11 ' A' ' 85' ' ' VAL . 77.1 t80 -66.36 -37.43 85.3 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.419 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -80.66 -31.38 36.43 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.0 -55.95 4.75 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.95 -33.19 62.07 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.599 0.238 . . . . 0.0 111.372 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 3.7 tt0 -74.62 -54.82 6.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.274 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.25 -6.26 3.05 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.907 -0.663 . . . . 0.0 113.063 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.5 mt -71.45 -167.72 0.27 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.923 0.392 . . . . 0.0 110.753 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.7 m -116.1 159.53 21.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.56 29.73 2.2 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.49 6.67 4.12 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.582 ' O ' HD13 ' A' ' 57' ' ' ILE . 1.5 tt0 -160.79 77.7 0.59 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 110.427 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.582 HD13 ' O ' ' A' ' 56' ' ' GLN . 5.8 mm -147.21 155.99 10.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.726 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -159.59 154.91 25.36 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.213 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.53 ' HB3' HD11 ' A' ' 66' ' ' ILE . 3.4 m-85 -120.48 155.49 33.46 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.974 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.57 119.42 10.58 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 71.8 t80 -105.6 98.89 8.52 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.239 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 54.95 39.08 31.43 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 111.162 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.17 22.75 43.56 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.102 -0.571 . . . . 0.0 113.161 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 3.3 mt-30 -115.01 92.85 32.54 Favored Pre-proline 0 C--O 1.233 0.196 0 CA-C-N 116.991 0.396 . . . . 0.0 110.659 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.98 113.48 1.35 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.887 2.391 . . . . 0.0 111.99 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.687 HD12 HD11 ' A' ' 39' ' ' LEU . 21.5 pt -116.7 143.93 25.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.953 0.406 . . . . 0.0 111.461 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -92.7 170.35 9.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.076 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.51 -3.19 32.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.688 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 20.9 p -96.21 18.13 14.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.576 ' CB ' HD12 ' A' ' 39' ' ' LEU . 11.2 t0 -72.92 160.09 32.68 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.08 -55.49 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.54 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.25 -50.23 14.58 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 122.394 2.063 . . . . 0.0 112.958 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.82 86.73 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.936 0.398 . . . . 0.0 110.755 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -27.11 68.68 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.4 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.4 -34.37 41.92 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.559 0.218 . . . . 0.0 110.565 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -65.4 -47.89 74.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.878 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.93 114.21 27.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.73 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.455 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -152.73 69.68 0.87 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.869 0.366 . . . . 0.0 111.794 -179.746 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -172.63 -69.38 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.963 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -143.07 92.2 2.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.6 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -139.64 146.4 39.68 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.996 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.878 HG22 ' HB2' ' A' ' 20' ' ' LYS . 71.2 p -119.41 147.67 44.11 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.628 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 1.013 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -133.2 167.06 27.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.813 179.549 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.413 ' H ' HG22 ' A' ' 83' ' ' ILE . 1.8 t0 -116.14 97.74 6.23 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.489 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.597 HG11 ' CE2' ' A' ' 46' ' ' TYR . 11.0 p -81.38 114.28 22.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 121.269 0.557 . . . . 0.0 111.504 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -98.8 131.44 44.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.667 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 . . . . . 0 CA--C 1.534 0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 179.636 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.825 0.345 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -153.89 125.53 7.63 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.755 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.3 pt -80.95 129.87 36.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 111.234 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -89.74 113.42 24.94 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.289 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.8 mp -122.83 133.2 54.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.257 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.673 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.0 OUTLIER -101.62 112.93 25.65 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.45 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.826 HG22 HD11 ' A' ' 83' ' ' ILE . 16.3 t -90.5 124.4 43.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.07 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.7 115.48 30.32 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.74 149.82 32.04 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.691 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -54.56 -33.5 60.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.416 0.287 . . . . 0.0 111.552 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.45 32.3 2.04 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.75 53.67 15.02 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.966 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -107.29 101.18 10.58 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.545 0.212 . . . . 0.0 110.891 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -97.63 109.25 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 120.735 0.302 . . . . 0.0 111.344 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 t -139.78 151.99 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.51 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -112.47 147.55 36.29 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.316 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -142.62 137.94 30.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.106 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -110.11 116.21 31.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.869 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.7 pt -133.95 178.45 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.485 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.99 156.48 16.3 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.821 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.48 39.62 1.03 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.39 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -147.17 33.39 0.9 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.74 0.305 . . . . 0.0 111.133 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -142.07 155.41 65.33 Favored Pre-proline 0 C--O 1.232 0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.828 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.415 ' HA ' HG23 ' A' ' 71' ' ' THR . 54.8 Cg_endo -69.13 165.97 28.42 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.526 2.151 . . . . 0.0 112.243 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.719 HD11 HD12 ' A' ' 66' ' ' ILE . 10.4 mt -58.21 -24.39 58.99 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 24.7 p -53.39 -32.89 51.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.362 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.57 -58.96 5.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.824 -0.171 . . . . 0.0 110.694 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.63 -39.6 91.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.636 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.6 -43.1 85.76 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.352 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -63.51 -38.67 92.01 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.767 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.19 -34.2 61.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.579 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.579 ' CE1' HG11 ' A' ' 85' ' ' VAL . 53.5 t80 -80.86 -37.11 30.48 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 t -79.39 -41.08 28.56 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -72.67 -45.05 60.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.733 -0.212 . . . . 0.0 111.519 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -62.22 -35.65 79.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.299 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . 0.434 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 1.9 tt0 -75.47 -66.86 0.72 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.078 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.16 46.21 0.11 Allowed Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.188 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 13.7 mt -112.2 -154.38 0.54 Allowed 'General case' 0 C--O 1.233 0.198 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.6 166.1 10.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.946 0.403 . . . . 0.0 111.284 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.64 -36.75 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.221 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.9 28.53 2.69 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.69 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.444 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -160.67 77.56 0.6 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.104 0.478 . . . . 0.0 110.28 178.854 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.473 HG22 ' N ' ' A' ' 58' ' ' ARG . 10.0 mm -152.02 158.64 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.511 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.473 ' N ' HG22 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -156.64 129.95 8.05 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.957 0.408 . . . . 0.0 111.21 179.307 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -106.4 136.99 45.19 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.655 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -113.47 121.32 43.94 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.256 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -113.61 89.07 2.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.99 39.09 31.48 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.05 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.88 23.19 39.47 Favored Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.081 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -119.82 92.68 46.85 Favored Pre-proline 0 C--O 1.233 0.216 0 CA-C-N 116.976 0.388 . . . . 0.0 110.603 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.09 106.82 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.957 2.438 . . . . 0.0 112.25 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.719 HD12 HD11 ' A' ' 39' ' ' LEU . 14.3 pt -111.47 133.41 57.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.374 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -87.68 177.04 7.15 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 40' ' ' SER . 1.2 pm0 -83.49 23.74 0.91 Allowed 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.9 p -126.6 13.97 7.55 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 122.508 -0.12 . . . . 0.0 111.284 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.713 ' HB2' HD12 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -73.44 175.78 6.67 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.649 0.261 . . . . 0.0 111.297 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.415 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -168.43 -55.19 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.351 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -49.6 -50.18 13.79 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 122.39 2.06 . . . . 0.0 113.16 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.01 -44.86 87.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.67 0.271 . . . . 0.0 110.86 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -39.51 75.47 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 tt -81.88 -33.22 30.64 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.002 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.51 -29.88 62.37 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.361 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.3 mtt -62.77 170.96 2.31 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.249 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -117.34 -51.49 2.52 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.253 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.07 -56.36 0.02 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 120.657 0.265 . . . . 0.0 111.032 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -83.1 107.68 15.84 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.66 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.44 157.6 43.21 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.266 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.673 HG22 ' HB2' ' A' ' 20' ' ' LYS . 21.9 p -146.09 149.04 33.3 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.377 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.826 HD11 HG22 ' A' ' 21' ' ' VAL . 1.2 pp -144.26 160.57 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.967 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.61 106.8 14.95 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.579 HG11 ' CE1' ' A' ' 46' ' ' TYR . 9.6 p -79.91 114.99 21.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.126 0.489 . . . . 0.0 110.996 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.412 ' O ' ' HG3' ' A' ' 58' ' ' ARG . 3.8 m-85 -110.7 169.38 8.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.973 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 . . . . . 0 N--CA 1.465 0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.348 -179.882 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 120.76 0.314 . . . . 0.0 111.05 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -141.33 164.71 29.52 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.039 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 78' ' ' GLU . 16.3 pt -105.71 124.55 60.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.417 . . . . 0.0 111.202 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -85.57 122.73 30.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mp -119.44 134.17 55.35 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.366 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.568 ' HB2' HG22 ' A' ' 82' ' ' THR . 11.6 mmtt -104.91 94.01 5.03 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.456 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.766 HG22 HD11 ' A' ' 83' ' ' ILE . 16.4 t -83.45 112.11 20.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.156 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.24 112.42 25.44 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.053 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.95 128.57 8.58 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.398 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -57.1 -36.0 70.11 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.509 0.195 . . . . 0.0 111.197 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -62.31 -30.54 71.22 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.132 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.53 57.47 0.19 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.581 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -149.76 107.57 3.69 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.709 0.29 . . . . 0.0 111.041 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.4 HG13 ' O ' ' A' ' 28' ' ' VAL . 13.2 p -107.99 123.39 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.231 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.1 t -139.96 138.72 37.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.111 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -92.55 130.67 38.14 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.9 158.93 22.25 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.13 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 mtpm? -132.35 94.8 3.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.955 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 HD23 ' A' ' 42' ' ' LEU . 4.2 pt -115.27 179.43 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.25 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.9 166.55 11.73 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.838 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.0 33.2 1.36 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.148 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -145.3 28.71 1.19 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.12 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.6 p -135.58 131.25 19.23 Favored Pre-proline 0 C--O 1.231 0.131 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' HG23 ' A' ' 71' ' ' THR . 40.5 Cg_exo -56.77 164.68 5.66 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.654 2.236 . . . . 0.0 112.509 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.794 HD11 HD12 ' A' ' 66' ' ' ILE . 9.8 mt -55.54 -23.47 26.81 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.307 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.4 p -52.44 -42.57 64.26 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.04 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -49.41 77.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 110.772 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 42' ' ' LEU . 0.3 OUTLIER -65.58 -48.59 71.85 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.635 179.617 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -50.87 71.73 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.243 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -57.47 -56.01 27.35 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.814 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.07 87.76 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.616 ' CE2' HG11 ' A' ' 85' ' ' VAL . 70.5 t80 -62.79 -51.64 66.31 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.224 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.472 ' HA ' HD12 ' A' ' 52' ' ' LEU . 97.1 p -63.31 -44.05 96.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -65.37 -37.17 86.2 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.955 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -74.25 -41.1 61.83 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.267 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -67.12 0.68 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.285 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 147.53 45.97 0.03 OUTLIER Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.202 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 47' ' ' SER . 0.9 OUTLIER -128.62 -163.42 1.28 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.743 0.306 . . . . 0.0 110.644 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 m -138.39 174.57 10.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.004 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.0 ttp -96.32 30.3 2.56 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.007 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -115.97 -5.58 11.99 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.71 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.652 ' O ' HD13 ' A' ' 57' ' ' ILE . 5.6 tt0 -160.23 78.02 0.65 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.219 0.533 . . . . 0.0 110.156 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.652 HD13 ' O ' ' A' ' 56' ' ' GLN . 15.5 mm -142.31 157.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.76 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.433 ' N ' HG22 ' A' ' 57' ' ' ILE . 4.7 tpt180 -153.6 117.07 4.64 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.023 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -98.95 143.31 29.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.343 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -133.75 134.57 43.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.344 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -117.6 104.98 11.57 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.401 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.58 37.05 25.44 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.012 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 82.6 25.37 50.67 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 121.02 -0.61 . . . . 0.0 113.042 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -119.77 101.43 48.12 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.803 0.302 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.32 122.06 10.54 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.99 2.46 . . . . 0.0 112.74 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.794 HD12 HD11 ' A' ' 39' ' ' LEU . 15.0 pt -138.24 154.95 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.228 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 36.9 m-20 -95.06 178.79 5.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.593 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.446 ' OE2' HG23 ' A' ' 69' ' ' THR . 0.0 OUTLIER -83.87 28.85 0.57 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.429 179.267 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' THR . . . . . 0.446 HG23 ' OE2' ' A' ' 68' ' ' GLU . 41.8 p -120.38 6.24 10.66 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.75 ' HB2' HD12 ' A' ' 39' ' ' LEU . 3.2 t70 -62.02 163.14 8.25 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.863 0.363 . . . . 0.0 111.462 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.459 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -166.04 -56.72 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.212 179.929 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.27 -42.17 40.82 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 122.509 2.14 . . . . 0.0 112.728 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.76 -41.3 65.25 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.582 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -58.19 -37.57 75.02 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.22 -31.29 49.26 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.737 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -58.97 -34.48 71.85 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 17.7 mmt -66.62 173.67 3.29 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.324 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.45 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.7 OUTLIER -126.19 -52.35 1.52 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.22 -179.931 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -148.94 -58.09 0.21 Allowed 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.307 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -80.69 121.68 26.18 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.102 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -151.89 109.24 3.58 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.905 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.568 HG22 ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -100.16 137.16 38.99 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -179.622 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.766 HD11 HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -142.82 162.43 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.337 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -129.36 112.75 14.16 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.983 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.616 HG11 ' CE2' ' A' ' 46' ' ' TYR . 7.7 p -82.66 101.38 7.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.236 0.541 . . . . 0.0 110.778 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -89.82 164.46 14.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.123 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 mm-40 . . . . . 0 C--N 1.332 -0.18 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.969 179.972 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.463 0.184 0 CA-C-O 120.816 0.341 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.407 ' HB3' ' HG2' ' A' ' 32' ' ' LYS . 13.7 m80 -156.31 109.94 2.71 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.661 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.476 HG13 HD11 ' A' ' 19' ' ' LEU . 21.3 pt -81.95 130.1 36.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 111.31 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -92.31 132.16 36.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.456 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.476 HD11 HG13 ' A' ' 17' ' ' ILE . 4.9 mp -137.94 132.07 31.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.082 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.66 100.47 11.17 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.487 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.72 117.76 29.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.323 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.89 115.97 26.01 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.17 143.72 24.18 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.824 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -60.23 -27.65 67.38 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.62 39.1 1.03 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.71 93.44 0.04 OUTLIER Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.588 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 62.1 p -168.44 161.68 11.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.802 0.334 . . . . 0.0 111.538 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 28' ' ' VAL . 8.3 p -152.27 109.65 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.14 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.7 t -137.62 135.28 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.222 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -104.71 139.62 39.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.118 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -128.72 153.12 47.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.196 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.407 ' HG2' ' HB3' ' A' ' 16' ' ' HIS . 2.7 tttt -129.46 124.14 33.31 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.904 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.3 pt -140.47 177.02 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.61 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 152.6 34.82 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.198 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -88.32 55.53 3.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 111.16 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.03 40.89 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.934 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.2 t -149.33 142.59 16.09 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.032 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.465 ' CA ' HG23 ' A' ' 71' ' ' THR . 55.4 Cg_endo -69.37 167.78 22.93 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.795 2.33 . . . . 0.0 112.613 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.649 HD12 ' CB ' ' A' ' 70' ' ' ASP . 12.4 mt -66.51 -12.83 59.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.851 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.3 t -53.97 -36.23 62.65 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.605 0.24 . . . . 0.0 111.285 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -39.09 24.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.374 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.503 HD23 ' CD2' ' A' ' 39' ' ' LEU . 20.3 tp -68.23 -40.9 81.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.76 0.314 . . . . 0.0 110.547 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.488 ' HG3' ' CD1' ' A' ' 59' ' ' PHE . 2.0 ttm -67.14 -34.39 77.49 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.19 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -69.93 -47.8 60.98 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.635 0.255 . . . . 0.0 110.828 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.89 97.86 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.263 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.593 ' CE2' HG11 ' A' ' 85' ' ' VAL . 88.5 t80 -59.99 -44.52 94.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -38.82 88.34 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.119 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.96 -38.83 61.61 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.603 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.03 -46.6 73.93 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -68.35 -64.6 0.83 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.528 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 146.77 47.0 0.03 OUTLIER Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.267 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.6 mt -127.33 -161.0 1.04 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.96 157.89 28.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.769 0.318 . . . . 0.0 110.954 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.8 mtm -97.62 29.51 3.3 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -127.24 4.74 6.36 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.628 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.481 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.69 77.75 0.6 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.147 0.499 . . . . 0.0 110.314 179.634 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.481 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.4 mm -147.12 158.96 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.663 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.47 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.7 ptp85 -154.92 145.45 22.21 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.239 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.488 ' CD1' ' HG3' ' A' ' 43' ' ' MET . 2.8 m-85 -117.28 164.78 14.3 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.006 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -148.96 119.77 7.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -91.43 94.77 9.64 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.453 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 56.23 39.73 30.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 85.92 21.37 53.17 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.336 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -108.79 114.87 58.17 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.97 0.385 . . . . 0.0 110.373 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.96 96.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.825 2.35 . . . . 0.0 112.329 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.412 HD11 ' HB3' ' A' ' 59' ' ' PHE . 10.7 pt -114.32 133.75 59.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.272 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -90.66 176.25 6.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.935 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -15.88 63.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.509 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 6.6 p -89.42 32.74 0.84 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.563 0.22 . . . . 0.0 111.543 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.649 ' CB ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -74.25 155.7 37.99 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-O 120.484 0.183 . . . . 0.0 110.793 179.752 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.465 HG23 ' CA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -166.0 -57.15 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.376 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.434 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -46.67 -53.66 5.85 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.48 2.12 . . . . 0.0 113.152 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.34 96.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.757 0.313 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.42 -32.07 70.99 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.137 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.99 -33.2 51.46 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.688 0.28 . . . . 0.0 110.537 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -41.34 85.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.766 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -177.3 1.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.227 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -148.35 -59.21 0.24 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.415 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -136.85 23.34 3.09 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -166.14 93.71 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.788 0.328 . . . . 0.0 111.346 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.401 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 39.7 t0 -121.34 109.22 14.64 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.67 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.2 p -91.81 125.4 36.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.398 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.476 HD13 ' HE2' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -145.49 146.31 19.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.389 179.793 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -109.25 107.3 17.48 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.91 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.593 HG11 ' CE2' ' A' ' 46' ' ' TYR . 9.0 p -80.79 112.84 19.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 121.243 0.544 . . . . 0.0 111.159 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -96.47 158.86 15.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.954 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.189 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.731 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.602 0.239 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -139.36 129.66 25.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.134 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.676 HG22 ' O ' ' A' ' 78' ' ' GLU . 18.8 pt -80.29 126.51 39.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.118 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -85.94 106.21 16.97 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.348 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.614 HD13 HD22 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -105.23 125.23 50.75 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.416 179.866 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -93.17 90.27 6.78 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.138 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.454 ' HA ' HD12 ' A' ' 83' ' ' ILE . 18.8 t -81.52 100.16 5.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.152 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.27 111.93 24.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.18 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.24 146.31 27.6 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.455 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.04 55.76 1.86 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 111.064 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -178.14 41.17 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.276 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.72 73.79 0.61 Allowed Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.073 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.4 p -166.53 106.22 0.64 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.761 0.281 . . . . 0.0 111.43 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -122.52 108.48 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.944 0.402 . . . . 0.0 111.302 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.1 t -121.01 149.93 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.316 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.96 113.85 26.91 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.159 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.78 150.32 24.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.05 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 mttp -130.74 124.62 31.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.41 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 pt -145.85 -180.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.395 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.13 152.43 34.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.114 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.07 59.49 2.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -168.62 39.84 0.03 OUTLIER 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.677 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 t -151.27 145.01 17.56 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.021 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.34 163.92 24.86 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.99 2.46 . . . . 0.0 112.509 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.773 HD23 HD21 ' A' ' 42' ' ' LEU . 12.3 mt -56.61 -27.45 58.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.046 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.3 p -51.66 -36.35 45.91 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -58.48 -63.46 1.27 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.556 0.217 . . . . 0.0 110.927 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.773 HD21 HD23 ' A' ' 39' ' ' LEU . 3.5 pp -65.53 -29.42 70.06 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.867 179.465 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.5 mmt -59.21 -49.06 79.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.607 0.241 . . . . 0.0 110.618 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -66.57 -39.1 88.32 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.876 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.33 -45.77 68.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.506 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -61.86 -47.04 86.8 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.422 ' HA ' HD12 ' A' ' 52' ' ' LEU . 42.3 p -62.08 -37.73 86.12 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.748 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.01 -38.9 56.76 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.412 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.65 64.69 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -73.45 -70.19 0.38 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.714 0.292 . . . . 0.0 111.514 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 156.05 46.09 0.02 OUTLIER Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.068 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 47' ' ' SER . 1.5 mt -119.43 -159.92 0.79 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -128.32 161.36 29.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.85 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.08 27.81 3.47 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.121 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -131.09 8.49 4.75 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.494 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.21 77.71 0.64 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.251 0.548 . . . . 0.0 110.08 178.999 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.494 HD13 ' O ' ' A' ' 56' ' ' GLN . 10.8 mm -144.8 158.39 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.636 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 57' ' ' ILE . 26.2 ttt85 -149.53 141.71 24.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -119.29 160.7 21.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.894 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -146.17 109.99 4.89 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.464 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.621 ' HA ' HG22 ' A' ' 83' ' ' ILE . 56.7 t80 -89.27 101.91 14.58 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.118 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 t0 53.13 40.61 31.51 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.979 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 99.39 -35.15 4.89 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.961 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.44 112.77 14.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.658 0.229 . . . . 0.0 111.269 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.2 144.45 37.31 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.74 2.293 . . . . 0.0 112.873 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.544 ' N ' HD13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -144.94 173.87 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 179.593 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -109.16 178.52 4.43 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.456 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.82 -12.78 61.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.431 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.8 p -89.79 28.32 1.37 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.678 ' CB ' HD12 ' A' ' 39' ' ' LEU . 9.2 t0 -76.15 169.04 18.94 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.647 0.26 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.3 -54.82 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.367 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.89 -53.31 5.86 Favored 'Trans proline' 0 C--N 1.358 1.033 0 C-N-CA 122.669 2.246 . . . . 0.0 113.242 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.503 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . . . -61.3 -35.45 77.38 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.12 0.486 . . . . 0.0 110.647 179.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.421 HE22 HD23 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -73.49 -26.21 60.8 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.477 179.567 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 75' ' ' LEU . 0.3 OUTLIER -85.94 -36.61 19.76 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.621 0.248 . . . . 0.0 110.976 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 73' ' ' ALA . 11.5 pt-20 -66.23 -34.53 78.22 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.991 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.491 ' HE1' HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -69.28 178.18 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.822 179.661 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.676 ' O ' HG22 ' A' ' 17' ' ' ILE . 17.5 tt0 -136.48 -64.54 0.59 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -134.24 -48.17 0.78 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.318 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -92.76 114.37 26.91 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.691 0.281 . . . . 0.0 111.418 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -138.8 137.83 37.01 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -123.33 130.01 52.13 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.48 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.621 HG22 ' HA ' ' A' ' 61' ' ' PHE . 1.2 pp -147.84 152.43 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.145 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.23 111.54 22.67 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.122 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 85' ' ' VAL . 11.7 p -82.62 111.8 19.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.253 0.549 . . . . 0.0 111.369 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -97.97 152.27 19.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.015 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 CA--C 1.532 0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.059 179.913 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.811 0.339 . . . . 0.0 111.346 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -152.27 138.44 18.31 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.882 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.628 HG22 ' HB2' ' A' ' 78' ' ' GLU . 25.4 pt -80.91 130.53 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.605 ' O ' HD13 ' A' ' 19' ' ' LEU . 2.8 m-20 -106.31 111.91 24.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.502 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.899 HD12 ' HB3' ' A' ' 81' ' ' ASP . 0.4 OUTLIER -124.48 136.4 53.98 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.785 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.4 mttp -97.25 97.4 9.13 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.553 HG22 HD11 ' A' ' 83' ' ' ILE . 24.3 t -82.5 108.49 15.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.55 123.56 38.06 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.96 153.27 32.43 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.458 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -28.0 53.55 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -93.59 29.79 1.92 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.43 72.6 0.63 Allowed Glycine 0 C--N 1.337 0.588 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.098 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 m -150.5 92.97 1.91 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.756 0.312 . . . . 0.0 111.245 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.489 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.5 p -91.35 113.98 27.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.933 0.397 . . . . 0.0 111.054 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -116.61 138.65 46.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.159 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -86.24 143.93 27.69 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.129 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -138.0 149.3 45.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -135.51 115.7 13.38 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.161 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.544 HD12 ' O ' ' A' ' 34' ' ' LYS . 1.2 pt -147.16 -179.83 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.834 0.349 . . . . 0.0 111.559 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.544 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.13 151.43 25.73 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.848 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.435 ' HD2' HD13 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -93.16 29.16 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.797 0.332 . . . . 0.0 111.517 179.668 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -122.44 37.48 4.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.7 t -154.64 142.63 14.19 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.631 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.697 ' HA ' HG23 ' A' ' 71' ' ' THR . 33.9 Cg_endo -64.06 168.83 11.55 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.656 2.237 . . . . 0.0 112.34 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.638 HD11 HD12 ' A' ' 66' ' ' ILE . 13.1 mt -55.0 -24.65 25.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.617 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.5 t -51.72 -39.61 58.72 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -60.16 -54.95 39.84 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.602 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 tp -65.99 -34.15 77.44 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.84 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.404 ' HG2' ' CE2' ' A' ' 59' ' ' PHE . 0.1 OUTLIER -59.87 -61.19 2.8 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.957 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -59.52 -40.74 88.11 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -44.38 89.15 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.667 0.27 . . . . 0.0 111.373 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -65.68 -39.0 90.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.489 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.483 ' HA ' HD12 ' A' ' 52' ' ' LEU . 17.7 m -79.09 -48.27 14.65 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.358 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -58.69 -37.63 76.48 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.102 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -68.85 -45.05 72.09 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.31 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -66.89 0.58 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.481 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.87 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.038 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 47' ' ' SER . 1.6 mt -120.6 -159.32 0.79 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.7 125.85 48.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.79 0.329 . . . . 0.0 110.91 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.5 -21.27 64.07 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.44 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -90.73 17.98 7.0 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.562 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.49 77.9 0.62 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 121.289 0.566 . . . . 0.0 110.438 178.531 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.562 HD13 ' O ' ' A' ' 56' ' ' GLN . 13.5 mm -148.17 158.67 7.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.721 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.471 ' N ' HG22 ' A' ' 57' ' ' ILE . 17.7 ttt85 -150.19 142.42 24.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.054 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.564 ' CD1' HD12 ' A' ' 83' ' ' ILE . 4.9 m-85 -117.82 130.77 56.48 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.419 179.518 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.1 mmm-85 -116.59 102.31 9.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.784 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -90.44 105.1 17.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.726 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 45.18 43.37 7.78 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.914 0.486 . . . . 0.0 111.906 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLY . . . . . 0.448 ' O ' ' HD3' ' A' ' 65' ' ' PRO . . . 82.86 2.17 90.64 Favored Glycine 0 CA--C 1.526 0.724 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.318 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -99.47 104.55 27.9 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 117.21 0.505 . . . . 0.0 110.842 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 63' ' ' GLY . 52.9 Cg_exo -56.02 121.72 10.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.999 2.466 . . . . 0.0 112.366 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.638 HD12 HD11 ' A' ' 39' ' ' LEU . 24.6 pt -131.67 150.32 33.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.603 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.59 165.86 11.34 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.264 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -57.85 -26.1 61.61 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.412 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.87 -14.48 53.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.784 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.568 ' CB ' HD12 ' A' ' 39' ' ' LEU . 5.8 t70 -53.32 150.63 6.12 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.033 0.444 . . . . 0.0 111.655 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.697 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -163.35 -56.27 0.01 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.151 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.52 -52.34 9.23 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 122.46 2.107 . . . . 0.0 112.71 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.99 79.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.992 0.425 . . . . 0.0 110.509 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -69.33 -21.62 63.83 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.432 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.435 HD13 ' HD2' ' A' ' 35' ' ' ARG . 1.1 mm? -78.07 -36.95 47.63 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.072 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -70.02 -36.38 75.04 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 8.1 mmt -106.76 97.02 6.86 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.328 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.628 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -139.96 67.91 1.37 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.408 -179.462 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -173.29 -64.07 0.02 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.977 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -135.2 83.22 2.01 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.477 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.899 ' HB3' HD12 ' A' ' 19' ' ' LEU . 11.8 t70 -127.07 135.17 50.41 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.878 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 30.2 p -115.98 144.32 44.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.405 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.564 HD12 ' CD1' ' A' ' 59' ' ' PHE . 2.4 pt -141.05 165.13 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.604 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -115.57 104.65 11.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.748 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 85' ' ' VAL . 13.3 p -80.17 115.5 22.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.168 0.509 . . . . 0.0 111.418 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -109.14 154.2 22.66 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.066 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 . . . . . 0 C--O 1.233 0.189 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.841 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 CA--C 1.531 0.235 0 CA-C-O 120.588 0.232 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.482 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 47.2 m80 -142.88 160.57 40.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.729 0.3 . . . . 0.0 111.21 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.73 HG12 HG23 ' A' ' 33' ' ' ILE . 6.8 pt -108.14 122.06 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 121.1 0.476 . . . . 0.0 110.98 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -80.33 102.04 9.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.339 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mp -103.57 138.17 40.62 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.873 0.368 . . . . 0.0 111.571 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -96.61 100.04 11.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.237 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.483 HG22 HD11 ' A' ' 83' ' ' ILE . 22.4 t -83.39 93.8 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.59 125.23 39.11 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.286 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.77 161.2 17.77 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.593 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -92.32 43.11 1.12 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.944 0.402 . . . . 0.0 110.852 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.92 34.38 0.21 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.4 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.12 56.68 7.65 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.713 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 p -140.83 98.28 3.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.723 0.297 . . . . 0.0 111.185 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.8 m -115.07 92.65 2.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.944 0.402 . . . . 0.0 110.928 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.84 145.69 28.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.321 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -118.2 116.9 27.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -114.72 170.6 8.2 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.482 ' HG2' ' HB2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -110.41 151.99 26.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.73 HG23 HG12 ' A' ' 17' ' ' ILE . 6.2 tp -158.64 149.0 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.247 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.7 144.84 26.34 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.794 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ptp85 -81.92 57.67 3.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.97 0.414 . . . . 0.0 111.021 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.95 23.73 0.66 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.461 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.516 HG22 ' HD2' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -162.17 148.93 11.02 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 120.512 0.196 . . . . 0.0 110.764 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.516 ' HD2' HG22 ' A' ' 37' ' ' THR . 50.7 Cg_exo -54.08 161.18 5.28 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.886 2.39 . . . . 0.0 112.59 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.686 HD12 ' HB3' ' A' ' 70' ' ' ASP . 11.0 mt -61.28 -17.22 52.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.875 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.05 -37.58 54.12 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.478 0.18 . . . . 0.0 111.082 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -43.01 88.02 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.893 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.8 -47.42 46.62 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.6 tmm? -59.65 -44.51 93.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.252 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -59.5 -49.71 76.71 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.746 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.33 -34.6 78.34 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.491 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -72.5 -53.32 12.4 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.503 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -60.21 -43.72 95.72 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.147 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.27 -42.88 99.38 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.706 0.289 . . . . 0.0 110.827 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.437 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -78.48 -71.99 0.4 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.672 0.273 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.24 45.58 0.02 OUTLIER Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.118 -0.563 . . . . 0.0 112.151 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.4 mt -127.24 -164.94 1.41 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.695 0.283 . . . . 0.0 110.516 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -143.72 176.45 9.23 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.979 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -93.59 28.13 2.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.266 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -118.31 -3.67 10.98 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.564 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -160.48 77.92 0.63 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.192 0.52 . . . . 0.0 110.206 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.564 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.6 mm -144.98 157.86 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.921 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.436 ' N ' HG22 ' A' ' 57' ' ' ILE . 5.6 tpt180 -141.2 121.98 14.38 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -111.8 127.47 55.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -127.49 103.31 7.28 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.423 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.855 ' HA ' HG22 ' A' ' 83' ' ' ILE . 61.3 t80 -81.12 101.38 9.59 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.01 35.04 24.85 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.099 -179.19 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 103.71 -38.14 3.39 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 121.004 -0.617 . . . . 0.0 113.132 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.03 110.61 3.41 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.671 0.235 . . . . 0.0 111.202 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.17 129.5 16.21 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.086 2.524 . . . . 0.0 112.787 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 pp -145.79 163.07 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.494 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -103.86 177.32 4.88 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.854 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -64.73 -17.79 64.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.584 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.3 p -88.81 33.39 0.78 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.686 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -83.46 177.46 8.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.658 0.266 . . . . 0.0 111.312 179.77 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.409 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -169.89 -54.25 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.962 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.409 ' HD2' ' H ' ' A' ' 71' ' ' THR . 82.9 Cg_exo -47.63 -57.28 2.42 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 122.409 2.073 . . . . 0.0 112.802 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.95 -41.87 97.13 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.78 0.324 . . . . 0.0 110.692 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.4 ' HB2' ' HG ' ' A' ' 39' ' ' LEU . 20.3 tm0? -57.27 -41.42 79.7 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.9 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.3 -32.44 38.05 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.733 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -29.3 60.65 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.923 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.16 173.92 2.25 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.966 0.412 . . . . 0.0 111.283 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.488 ' O ' HG22 ' A' ' 17' ' ' ILE . 14.5 pt-20 -135.2 -49.54 0.74 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.412 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -169.41 -41.72 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.246 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -108.35 106.87 17.21 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.717 0.294 . . . . 0.0 111.02 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -152.94 161.9 41.98 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.199 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.7 t -140.43 156.8 46.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.323 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.855 HG22 ' HA ' ' A' ' 61' ' ' PHE . 0.8 OUTLIER -143.72 157.99 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.158 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -115.81 92.88 4.04 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.517 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.535 HG13 HD12 ' A' ' 83' ' ' ILE . 34.3 m -83.95 111.3 19.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 111.592 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -99.24 156.4 16.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.103 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 . . . . . 0 N--CA 1.464 0.247 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.145 -179.94 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.785 0.326 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -124.47 116.8 23.1 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.569 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.593 HG22 ' HA ' ' A' ' 79' ' ' ASP . 8.1 pt -86.48 117.0 30.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 111.136 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -90.02 92.56 9.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.309 0.576 . . . . 0.0 111.211 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.24 126.71 38.49 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.417 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -84.18 128.45 34.57 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.808 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.553 HG22 HD11 ' A' ' 83' ' ' ILE . 21.8 t -109.94 114.38 46.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.796 0.332 . . . . 0.0 111.334 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -103.0 120.81 41.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.985 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.33 144.7 26.01 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.691 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 86' ' ' PHE . 5.2 pm0 -54.98 -33.07 62.19 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -70.0 -25.84 63.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.87 -5.53 6.49 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 121.098 -0.573 . . . . 0.0 113.059 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.1 p -66.85 154.24 41.42 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.536 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -141.13 108.53 2.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.23 146.13 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.168 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -104.32 148.66 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.215 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -148.66 151.08 34.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.083 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 1.6 ptmm? -136.0 134.72 38.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.089 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.744 HG12 HD12 ' A' ' 42' ' ' LEU . 4.7 pt -145.35 178.11 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.365 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.03 139.7 32.34 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.62 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.39 54.74 2.68 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.853 0.359 . . . . 0.0 111.109 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -158.97 32.87 0.21 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -151.92 157.19 34.39 Favored Pre-proline 0 N--CA 1.466 0.358 0 CA-C-O 120.632 0.253 . . . . 0.0 111.142 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.575 ' HA ' HG23 ' A' ' 71' ' ' THR . 32.1 Cg_exo -58.32 163.98 9.46 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.932 2.421 . . . . 0.0 112.775 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.754 HD12 ' HB3' ' A' ' 70' ' ' ASP . 7.8 mt -62.46 -23.32 66.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.699 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -52.93 -32.1 43.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.831 -0.168 . . . . 0.0 111.335 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -53.23 60.26 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.652 0.263 . . . . 0.0 110.867 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.744 HD12 HG12 ' A' ' 33' ' ' ILE . 0.7 OUTLIER -75.18 -35.76 61.52 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.897 179.478 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.585 ' HE1' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -62.51 -52.0 65.2 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.365 -179.873 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -60.31 -52.84 63.56 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.76 -34.52 62.68 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.248 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -71.49 -54.59 10.09 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.022 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.86 -37.07 75.69 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.107 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -49.73 34.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.238 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.577 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -65.29 -69.76 0.27 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.344 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.08 45.66 0.07 OUTLIER Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.048 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 mt -114.41 -157.89 0.65 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.2 m -126.05 156.04 40.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.846 0.355 . . . . 0.0 111.063 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.57 28.78 2.18 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.174 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -129.31 3.27 5.15 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.712 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -157.68 77.52 0.83 Allowed 'General case' 0 CA--C 1.521 -0.153 0 CA-C-O 121.068 0.461 . . . . 0.0 109.903 179.414 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.712 HD13 ' O ' ' A' ' 56' ' ' GLN . 7.4 mm -145.3 154.95 13.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.772 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.85 143.83 33.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.715 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.617 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.5 OUTLIER -118.2 129.69 55.65 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.414 179.492 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 21.3 mtt-85 -124.07 100.12 6.57 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.243 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.491 ' HA ' HG22 ' A' ' 83' ' ' ILE . 37.4 t80 -89.82 109.38 20.38 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.699 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 t70 56.9 37.15 28.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.134 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.25 25.55 59.16 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.923 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.53 125.02 26.97 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.875 0.337 . . . . 0.0 110.851 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.0 127.27 14.93 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.885 2.39 . . . . 0.0 112.738 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.545 HD12 HD13 ' A' ' 39' ' ' LEU . 3.7 pt -146.49 161.55 9.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.379 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -107.9 174.14 6.01 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.977 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.93 1.14 32.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.655 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.2 p -92.38 0.87 57.48 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.754 ' HB3' HD12 ' A' ' 39' ' ' LEU . 3.8 t0 -64.69 173.64 2.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.812 0.339 . . . . 0.0 111.328 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.575 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -167.75 -56.53 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.357 -179.661 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -49.46 -44.37 35.04 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.438 2.092 . . . . 0.0 112.808 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.456 ' HB3' ' OD2' ' A' ' 70' ' ' ASP . . . -71.57 -41.54 68.9 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.707 0.289 . . . . 0.0 110.799 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -38.05 89.64 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.72 -33.4 46.76 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.719 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -68.79 -21.3 64.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.243 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.0 mtt -61.85 177.52 0.43 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.983 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -116.09 -63.5 1.44 Allowed 'General case' 0 C--O 1.233 0.203 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.593 ' HA ' HG22 ' A' ' 17' ' ' ILE . 15.1 t0 -170.86 -54.44 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.167 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -86.81 108.6 18.8 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.173 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -151.56 164.28 37.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.208 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 6.2 t -144.14 149.53 36.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.927 0.394 . . . . 0.0 111.5 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.617 HD13 ' CE2' ' A' ' 59' ' ' PHE . 1.0 OUTLIER -140.0 175.07 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.629 -179.416 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.52 102.63 6.95 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.415 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.421 HG13 ' O ' ' A' ' 85' ' ' VAL . 14.8 p -79.97 121.64 33.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 111.184 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.402 ' HA ' ' OE1' ' A' ' 24' ' ' GLN . 3.7 m-85 -115.37 143.13 45.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.797 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 C--N 1.332 -0.195 0 CA-C-O 120.746 0.308 . . . . 0.0 111.242 179.995 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.257 0 CA-C-O 120.623 0.249 . . . . 0.0 111.036 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.412 ' HB3' ' HB2' ' A' ' 32' ' ' LYS . 7.4 m80 -149.99 148.19 28.77 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.12 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.617 HG13 HD13 ' A' ' 19' ' ' LEU . 14.9 pt -98.75 123.89 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 111.061 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -83.76 102.02 12.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.617 HD13 HG13 ' A' ' 17' ' ' ILE . 8.0 mp -109.78 130.04 55.56 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.12 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -96.66 93.56 6.81 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.514 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.428 HG22 HD13 ' A' ' 83' ' ' ILE . 17.5 t -82.78 122.37 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.127 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.81 118.22 36.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.7 138.15 14.45 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.605 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -56.69 -43.56 80.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.559 0.218 . . . . 0.0 111.332 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.68 -28.02 66.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.526 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.66 54.18 0.22 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.275 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.6 p -134.89 103.81 5.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.9 95.89 4.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.05 137.16 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.197 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -94.19 87.26 5.2 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -91.37 142.24 27.9 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HB2' ' HB3' ' A' ' 16' ' ' HIS . 1.5 pttt -114.64 138.72 50.33 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.214 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.854 HG12 HD12 ' A' ' 42' ' ' LEU . 1.7 pp -144.32 -179.74 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.471 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.585 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.98 148.65 26.78 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.256 -179.885 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.95 28.44 1.57 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.799 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -126.31 29.4 5.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.695 0.283 . . . . 0.0 111.015 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.65 151.71 29.06 Favored Pre-proline 0 N--CA 1.463 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.63 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.51 ' HA ' HG23 ' A' ' 71' ' ' THR . 41.3 Cg_endo -67.71 156.8 64.57 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.559 2.173 . . . . 0.0 112.242 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.551 HD12 ' OD2' ' A' ' 70' ' ' ASP . 8.2 mt -57.91 -22.46 48.62 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.155 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' MET . 41.8 t -49.76 -36.16 24.92 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.725 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -46.55 61.95 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.538 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.854 HD12 HG12 ' A' ' 33' ' ' ILE . 6.9 tt -62.6 -52.64 62.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.696 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.426 ' HG3' ' O ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -58.59 -35.43 72.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.076 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.86 6.76 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.008 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -43.04 95.22 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.586 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.429 ' HE2' HG11 ' A' ' 85' ' ' VAL . 78.7 t80 -60.15 -48.34 82.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.338 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.3 m -74.41 -34.81 63.37 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.234 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.03 -50.15 51.28 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.108 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -56.09 -36.45 68.15 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.011 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.81 -55.48 8.44 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.466 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.5 -18.43 0.89 Allowed Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.492 -179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.476 ' HB3' HD11 ' A' ' 57' ' ' ILE . 4.5 mm? -62.41 -178.73 0.2 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.945 0.402 . . . . 0.0 110.894 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -107.12 173.77 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.285 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.3 ptt? -104.35 26.35 9.03 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.419 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.62 13.38 2.74 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.458 ' O ' HD13 ' A' ' 57' ' ' ILE . 2.9 tt0 -160.66 77.88 0.61 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.221 0.534 . . . . 0.0 110.225 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 58' ' ' ARG . 9.9 mm -149.12 160.88 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.418 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.485 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -156.77 139.6 15.21 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.612 0.244 . . . . 0.0 111.469 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.421 ' CE2' ' HB ' ' A' ' 85' ' ' VAL . 15.1 m-85 -117.47 160.83 20.57 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.776 0.322 . . . . 0.0 111.378 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -137.35 127.19 25.61 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.138 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.44 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 24.4 t80 -106.16 91.76 3.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.457 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 58.18 37.04 26.25 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.261 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 89.32 23.04 35.55 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.021 -0.609 . . . . 0.0 113.02 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 0.0 OUTLIER -114.81 103.95 54.49 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.756 0.278 . . . . 0.0 110.484 179.802 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.7 93.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.807 2.338 . . . . 0.0 112.138 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.7 pt -103.01 135.71 39.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.097 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -79.93 157.73 26.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.829 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.33 51.7 0.72 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.821 0.343 . . . . 0.0 110.978 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.1 t -166.56 25.36 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.717 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.551 ' OD2' HD12 ' A' ' 39' ' ' LEU . 3.2 p30 -77.03 -175.16 3.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.635 0.255 . . . . 0.0 110.922 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.51 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -167.82 -58.05 0.01 OUTLIER Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.271 -179.627 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -45.7 -50.74 9.1 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.591 2.194 . . . . 0.0 113.065 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.62 -49.46 66.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.7 -29.31 69.26 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.261 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -33.71 47.42 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.749 0.309 . . . . 0.0 110.414 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.53 -50.26 74.43 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.74 148.25 26.46 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.537 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.616 ' CG ' HG22 ' A' ' 17' ' ' ILE . 3.8 tt0 -164.81 61.29 0.13 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.036 -179.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -179.27 -60.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.45 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -142.22 96.74 3.0 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.753 0.311 . . . . 0.0 110.859 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.459 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 9.8 t70 -127.71 114.32 17.17 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.736 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.29 131.37 36.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.882 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.428 HD13 HG22 ' A' ' 21' ' ' VAL . 0.3 OUTLIER -129.91 166.73 26.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.1 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.525 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 2.6 m-20 -133.84 105.87 7.01 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.663 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 85' ' ' VAL . 9.8 p -92.83 112.99 27.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.143 0.497 . . . . 0.0 111.324 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.525 ' CE1' ' HB3' ' A' ' 84' ' ' ASP . 92.6 m-85 -105.37 166.53 10.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.774 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 . . . . . 0 C--O 1.233 0.187 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.192 179.756 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 t70 . . . . . 0 CA--C 1.531 0.236 0 CA-C-O 120.696 0.284 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.455 ' CG ' ' HG2' ' A' ' 32' ' ' LYS . 1.3 m-70 -161.56 119.83 2.35 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.714 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.755 HG12 HG23 ' A' ' 33' ' ' ILE . 13.1 pt -80.96 130.06 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 111.063 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -81.5 116.72 21.42 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.041 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.422 HD21 ' CG1' ' A' ' 83' ' ' ILE . 7.9 tt -131.52 135.95 47.48 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.091 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.778 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.9 OUTLIER -104.25 106.04 16.4 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.293 179.49 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 23.4 t -82.42 124.44 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.14 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.657 ' O ' HG12 ' A' ' 85' ' ' VAL . . . -104.83 177.67 4.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.13 148.95 20.87 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.787 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLN . . . . . 0.41 ' HG3' ' CE2' ' A' ' 86' ' ' PHE . 1.4 tt0 -52.37 -38.51 58.99 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 111.433 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.45 33.27 2.51 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.588 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.77 83.72 0.2 Allowed Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.785 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.59 68.18 1.31 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.726 0.298 . . . . 0.0 111.493 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.6 t -84.54 107.8 16.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.988 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -124.56 148.98 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.433 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -93.07 110.88 22.37 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.844 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -112.75 165.66 12.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.455 ' HG2' ' CG ' ' A' ' 16' ' ' HIS . 6.9 tttt -130.36 143.62 50.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.01 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.755 HG23 HG12 ' A' ' 17' ' ' ILE . 3.7 tt -154.91 148.44 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.08 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -77.77 176.56 8.93 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.044 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -112.07 49.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.895 0.378 . . . . 0.0 111.453 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -157.59 33.24 0.27 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.237 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.03 143.88 10.56 Favored Pre-proline 0 N--CA 1.466 0.344 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.981 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.33 164.29 7.12 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.809 2.339 . . . . 0.0 112.65 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.656 HD12 ' CB ' ' A' ' 70' ' ' ASP . 12.6 mt -60.24 -14.78 19.61 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 p -51.98 -33.14 36.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.467 0.175 . . . . 0.0 111.16 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -57.06 -58.63 7.36 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.671 0.272 . . . . 0.0 110.543 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 tp -61.76 -38.11 86.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.72 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.53 -55.13 32.37 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.988 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -61.41 -43.92 98.04 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.234 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.31 -42.0 94.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.565 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.636 ' CE1' HG11 ' A' ' 85' ' ' VAL . 51.3 t80 -78.13 -42.53 31.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.448 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.5 p -65.47 -43.01 91.61 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.473 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.58 -34.89 62.98 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.902 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.42 -57.09 12.64 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.579 0.228 . . . . 0.0 111.464 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.86 -47.8 11.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.226 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.33 57.09 0.63 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.718 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.48 HD12 ' OE1' ' A' ' 87' ' ' GLN . 3.5 mm? -91.15 -78.92 0.38 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.607 0.241 . . . . 0.0 110.4 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -172.06 157.97 4.5 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.698 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -37.34 7.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.692 0.282 . . . . 0.0 110.523 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -101.57 27.29 6.47 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.62 77.83 0.61 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.084 0.468 . . . . 0.0 110.518 179.076 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.464 HG22 ' N ' ' A' ' 58' ' ' ARG . 10.8 mm -152.59 157.58 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.466 179.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.464 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -159.02 123.31 3.98 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.166 179.318 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -93.63 151.9 19.36 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.767 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.03 127.09 35.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.246 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -103.44 91.87 4.24 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.326 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.5 39.56 30.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.127 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.83 21.12 29.28 Favored Glycine 0 CA--C 1.522 0.518 0 C-N-CA 121.07 -0.586 . . . . 0.0 113.032 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -118.46 94.8 47.9 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 116.855 0.327 . . . . 0.0 110.436 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -52.96 105.88 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.972 2.448 . . . . 0.0 112.47 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.7 pt -113.03 160.29 12.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.325 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -103.68 164.4 11.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.096 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -68.13 -15.06 63.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.39 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 14.9 p -91.29 30.49 1.26 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.656 ' CB ' HD12 ' A' ' 39' ' ' LEU . 3.0 t70 -75.08 155.97 36.58 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 111.35 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.419 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.2 OUTLIER -160.68 -55.27 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.422 179.903 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.419 ' HD2' ' H ' ' A' ' 71' ' ' THR . 54.8 Cg_exo -52.41 -53.75 6.36 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.356 2.037 . . . . 0.0 112.759 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.84 -37.42 86.75 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.868 0.366 . . . . 0.0 110.493 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.05 -20.11 65.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.452 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -81.58 -35.19 30.47 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.92 -40.2 91.22 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.976 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.16 122.9 47.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.579 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.553 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -146.83 31.29 0.95 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.523 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -148.62 -51.29 0.16 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.28 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.13 99.45 4.13 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.652 0.263 . . . . 0.0 110.905 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -140.33 133.14 29.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.778 HG22 ' HB2' ' A' ' 20' ' ' LYS . 24.7 p -125.47 136.48 53.42 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.545 -179.404 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.422 ' CG1' HD21 ' A' ' 19' ' ' LEU . 0.6 OUTLIER -138.2 161.6 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.35 179.802 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.411 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 8.0 t0 -125.63 118.72 26.27 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.636 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.657 HG12 ' O ' ' A' ' 22' ' ' ALA . 13.6 p -82.7 121.34 35.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.232 0.539 . . . . 0.0 111.148 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.418 ' HB2' ' CD ' ' A' ' 58' ' ' ARG . 9.4 m-85 -107.46 164.35 12.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.78 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLN . . . . . 0.48 ' OE1' HD12 ' A' ' 52' ' ' LEU . 19.2 mt-30 . . . . . 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.239 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.235 0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.453 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -147.21 175.18 10.94 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.26 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.3 pt -104.77 128.66 58.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -82.21 119.68 24.39 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.235 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 42' ' ' LEU . 1.4 mt -123.86 116.95 23.77 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.75 0.309 . . . . 0.0 111.362 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -96.54 93.33 6.72 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.483 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.569 HG22 HD13 ' A' ' 83' ' ' ILE . 21.9 t -94.96 122.42 46.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.003 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -93.68 123.45 37.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.268 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.431 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -83.8 148.55 24.81 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.831 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.95 -37.83 72.1 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.49 0.186 . . . . 0.0 111.238 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.21 -28.37 67.93 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.469 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.6 31.96 2.63 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.205 -0.521 . . . . 0.0 112.592 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.0 m -110.86 144.86 39.24 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.756 0.312 . . . . 0.0 110.852 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.46 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.8 p -112.02 117.13 54.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.178 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.15 133.03 69.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.934 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -117.82 106.55 13.13 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.007 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -97.86 155.56 17.0 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.4 mtmm -131.95 113.09 13.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.992 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.656 HD13 ' HB2' ' A' ' 42' ' ' LEU . 45.4 pt -129.29 178.54 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.412 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -80.66 147.37 30.69 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.941 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -89.02 54.72 3.09 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.232 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.6 m170 -159.84 35.27 0.18 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.094 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.5 145.15 16.64 Favored Pre-proline 0 N--CA 1.465 0.308 0 CA-C-N 116.704 -0.225 . . . . 0.0 110.962 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.666 ' HA ' HG23 ' A' ' 71' ' ' THR . 47.8 Cg_exo -56.12 158.69 14.09 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.902 2.402 . . . . 0.0 112.801 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.661 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.6 mt -57.62 -23.74 52.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.805 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 t -47.77 -35.02 9.27 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.99 0.181 . . . . 0.0 111.342 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmt -60.08 -57.63 12.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.958 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 19' ' ' LEU . 5.4 tt -71.11 -36.83 72.31 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.128 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.536 ' CE ' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -58.37 -49.79 75.99 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.239 -179.855 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -62.6 -48.47 79.29 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.601 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.06 92.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.485 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.63 ' CE1' HG11 ' A' ' 85' ' ' VAL . 21.5 t80 -69.87 -45.62 67.29 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.02 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 t -68.35 -47.53 67.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.444 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -59.66 -40.66 88.46 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.99 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -66.65 -39.42 88.21 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.057 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -66.1 0.65 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.293 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.63 46.06 0.1 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.292 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 15.0 mt -119.78 -154.64 0.58 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . 0.408 ' O ' HD11 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -127.49 166.0 18.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.795 0.331 . . . . 0.0 111.077 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -95.88 25.98 4.37 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.263 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 56' ' ' GLN . 20.2 mtt180 -134.75 9.8 3.63 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.673 ' O ' HD13 ' A' ' 57' ' ' ILE . 4.3 mp0 -157.96 77.63 0.82 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.109 0.481 . . . . 0.0 109.738 178.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.673 HD13 ' O ' ' A' ' 56' ' ' GLN . 8.4 mm -144.66 155.22 14.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.814 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -144.79 116.77 8.3 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.167 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.55 101.64 13.13 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.128 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -85.19 143.24 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.072 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.423 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 54.0 t80 -137.21 86.25 2.19 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.656 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.67 37.61 20.53 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.001 0.429 . . . . 0.0 111.115 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.48 36.19 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.143 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 1.7 mm100 -115.94 98.47 51.18 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.996 0.398 . . . . 0.0 110.84 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -68.51 107.3 1.59 Allowed 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.685 2.257 . . . . 0.0 112.265 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.9 pt -122.84 144.82 30.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.503 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -86.95 178.21 7.02 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.165 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.51 36.48 0.31 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.881 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.2 p -136.71 17.38 3.08 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.661 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.1 t70 -67.25 162.88 21.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.006 0.431 . . . . 0.0 111.785 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.666 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -163.13 -54.95 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.551 179.836 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.429 ' HD2' ' H ' ' A' ' 71' ' ' THR . 76.4 Cg_exo -50.45 -52.22 9.43 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.441 2.094 . . . . 0.0 113.247 -179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.19 96.75 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.802 0.334 . . . . 0.0 110.956 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.93 -33.96 71.18 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.23 -34.56 59.22 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.593 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.85 -36.35 72.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 4.8 mmt -70.09 179.25 2.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.242 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -132.03 -58.14 0.96 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.484 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -145.82 -66.91 0.3 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.373 0.13 . . . . 0.0 111.317 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.0 119.85 20.52 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.94 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -146.72 143.26 28.58 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.274 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 132.07 55.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.579 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -138.11 167.79 21.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.919 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.464 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 2.7 m-20 -142.47 110.47 5.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.256 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.63 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.9 p -92.45 113.86 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.022 0.439 . . . . 0.0 111.11 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.464 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 22.6 m-85 -130.8 170.48 14.33 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.883 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 . . . . . 0 N--CA 1.464 0.259 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.898 179.8 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 120.847 0.356 . . . . 0.0 111.525 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.434 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 71.3 m-70 -155.42 107.68 2.67 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.609 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.676 HG12 HG23 ' A' ' 33' ' ' ILE . 6.8 pt -79.76 128.07 38.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.724 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -84.05 119.09 24.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.195 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.478 HD11 ' HG2' ' A' ' 77' ' ' MET . 0.4 OUTLIER -122.28 137.26 54.91 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.859 0.362 . . . . 0.0 111.498 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.0 OUTLIER -101.73 97.26 7.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.365 179.472 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.586 HG22 HD11 ' A' ' 83' ' ' ILE . 21.5 t -85.51 118.46 32.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.262 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.49 113.58 27.02 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.0 156.12 39.56 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.569 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -92.72 29.76 1.7 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -133.38 26.05 4.13 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.257 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.98 61.74 4.71 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.604 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -162.21 114.15 1.67 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.797 0.332 . . . . 0.0 111.409 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.16 130.19 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 t -147.36 153.38 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.43 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -119.87 137.05 54.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.702 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -122.96 154.09 38.86 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.434 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -104.83 113.14 26.54 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.738 179.837 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.676 HG23 HG12 ' A' ' 17' ' ' ILE . 8.9 tp -124.49 153.81 31.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.346 -179.556 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.91 153.54 18.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.872 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.78 58.1 3.76 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.371 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.415 ' O ' HG23 ' A' ' 37' ' ' THR . 0.3 OUTLIER -164.62 32.63 0.07 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.534 179.64 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 36' ' ' HIS . 6.1 p -157.62 153.22 22.46 Favored Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.885 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.57 155.09 22.46 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.735 2.29 . . . . 0.0 112.622 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.634 HD13 HD12 ' A' ' 66' ' ' ILE . 0.6 OUTLIER -61.4 -20.02 62.57 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.979 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.84 -34.22 26.94 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.519 0.199 . . . . 0.0 110.957 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.1 mmmt -54.19 -42.95 70.29 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.908 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.57 -45.54 30.01 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.746 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.1 ttp -57.08 -36.8 71.0 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.053 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HD3' ' HB2' ' A' ' 54' ' ' MET . 27.9 mmtm -77.97 -54.0 6.79 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.051 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.59 -32.34 62.98 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.476 ' CE1' HG11 ' A' ' 85' ' ' VAL . 56.4 t80 -79.47 -52.69 7.71 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.485 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.9 p -66.31 -37.02 84.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.299 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.08 -47.27 68.73 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.062 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 mtt180 -59.87 -49.09 79.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.376 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -64.39 -69.15 0.3 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.28 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.2 38.24 0.13 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.943 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.617 HD22 ' N ' ' A' ' 52' ' ' LEU . 0.7 OUTLIER -107.99 -153.54 0.51 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.743 0.272 . . . . 0.0 110.563 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.9 p -95.96 119.68 34.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.932 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' MET . . . . . 0.401 ' HB2' ' HD3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -72.86 -4.69 33.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.802 179.557 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -120.01 23.45 11.01 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.502 0.191 . . . . 0.0 111.216 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.468 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.76 77.78 0.6 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.199 0.523 . . . . 0.0 110.452 179.173 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 58' ' ' ARG . 15.4 mm -150.86 160.11 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.149 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.485 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -152.14 150.65 30.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.447 179.752 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.484 ' CD1' HD12 ' A' ' 83' ' ' ILE . 64.8 m-85 -116.37 161.06 19.62 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.76 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -139.59 114.79 9.71 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.438 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -108.46 101.42 10.6 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.306 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 53.18 46.95 25.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.076 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 74.33 19.88 79.74 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.001 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.21 86.65 33.17 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.83 0.315 . . . . 0.0 110.84 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.38 150.96 31.64 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.037 2.491 . . . . 0.0 112.667 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.634 HD12 HD13 ' A' ' 39' ' ' LEU . 14.5 pt -141.01 171.57 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.634 -179.584 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -119.19 171.13 8.5 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -30.82 63.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.887 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 42.4 p -78.92 8.22 5.91 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.575 ' HB3' HD12 ' A' ' 39' ' ' LEU . 1.1 m-20 -65.47 175.89 1.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.869 0.366 . . . . 0.0 111.457 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.82 -55.74 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.522 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -46.91 -51.99 8.39 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.346 2.031 . . . . 0.0 112.919 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.9 91.48 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.828 0.347 . . . . 0.0 110.64 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.505 ' NE2' HD11 ' A' ' 17' ' ' ILE . 15.9 tp60 -58.71 -34.5 71.38 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.192 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 tt -79.48 -33.24 42.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -62.76 -26.11 68.54 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.237 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.482 ' HB3' HD12 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -58.34 160.23 5.42 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 111.492 -179.929 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.619 ' O ' HG22 ' A' ' 17' ' ' ILE . 1.5 tt0 -125.02 -76.98 0.59 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.879 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.57 26.62 0.23 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -174.86 102.87 0.09 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.524 0.202 . . . . 0.0 111.259 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 3.7 m-20 -146.9 130.4 16.79 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.875 0.369 . . . . 0.0 111.54 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.436 HG22 ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -102.92 144.33 31.36 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.367 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.586 HD11 HG22 ' A' ' 21' ' ' VAL . 3.3 pt -150.35 168.07 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.575 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -127.1 106.92 9.59 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.295 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.476 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.8 p -83.06 119.13 31.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.052 0.453 . . . . 0.0 111.242 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -102.67 125.41 49.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.36 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 . . . . . 0 C--O 1.233 0.218 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.175 -179.674 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.674 0.273 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.4 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 73.3 m80 -150.23 130.44 13.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.931 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.72 HG12 HG23 ' A' ' 33' ' ' ILE . 6.6 pt -86.63 127.14 40.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.709 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -81.35 94.37 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.299 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -93.01 132.14 37.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.205 -179.93 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -113.56 104.75 12.56 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.492 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.875 HG22 HD11 ' A' ' 83' ' ' ILE . 36.5 t -87.92 128.6 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.184 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -127.24 147.12 50.22 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.19 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -108.78 158.71 14.52 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.58 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -63.74 -45.6 89.14 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.594 0.235 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.96 -28.2 67.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.303 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.9 50.63 0.16 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.366 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -98.7 151.76 20.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.702 0.287 . . . . 0.0 111.118 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 28' ' ' VAL . 8.3 p -152.05 111.62 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.358 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.54 HG21 ' CE1' ' A' ' 46' ' ' TYR . 14.7 m -137.25 156.87 34.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.402 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -127.35 128.56 46.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -137.65 151.5 48.34 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -104.23 125.2 50.31 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.72 HG23 HG12 ' A' ' 17' ' ' ILE . 8.9 tp -136.62 153.1 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.187 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.02 148.24 22.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.755 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.74 53.99 2.55 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.006 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -150.58 29.32 0.69 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.323 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.6 153.06 25.67 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.972 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.32 162.02 42.27 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.639 2.226 . . . . 0.0 112.287 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.605 HD12 ' HB3' ' A' ' 70' ' ' ASP . 8.3 mt -63.31 -19.54 64.69 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.94 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -48.71 -36.13 15.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.565 0.221 . . . . 0.0 111.23 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.18 -62.24 2.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.124 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.425 ' CD2' HD22 ' A' ' 19' ' ' LEU . 12.6 tp -62.82 -33.86 76.1 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.883 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.414 ' HG2' ' CD1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -55.68 -61.97 2.0 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.685 179.548 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -59.5 -37.54 78.55 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.137 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.508 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.634 ' HE2' HG21 ' A' ' 85' ' ' VAL . 66.9 t80 -73.47 -45.54 53.5 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.439 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.7 m -61.78 -50.01 74.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.409 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.51 72.12 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.997 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.16 68.5 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.892 179.552 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.11 -52.11 15.46 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.084 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.73 -11.85 3.69 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.71 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.7 mt -74.71 -166.0 0.41 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.751 0.276 . . . . 0.0 110.631 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.18 169.17 9.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.092 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.5 29.62 3.21 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.113 179.396 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.22 3.05 5.18 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.512 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.48 77.99 0.63 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.082 0.468 . . . . 0.0 110.275 179.318 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.512 HD13 ' O ' ' A' ' 56' ' ' GLN . 9.9 mm -141.97 157.78 20.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.996 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.417 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -136.63 133.48 36.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.933 0.397 . . . . 0.0 111.454 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.414 ' CD1' ' HG2' ' A' ' 43' ' ' MET . 2.4 m-85 -123.63 109.84 14.25 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.054 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -109.45 139.71 44.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.757 0.313 . . . . 0.0 111.4 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.508 ' HA ' HG22 ' A' ' 83' ' ' ILE . 43.9 t80 -114.41 102.24 9.9 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.109 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 52.18 35.12 15.87 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.077 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.71 24.93 19.35 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.022 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.3 104.67 54.58 Favored Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.878 0.339 . . . . 0.0 110.962 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.84 109.04 2.23 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.754 2.302 . . . . 0.0 112.848 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.8 pt -131.71 150.17 33.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.139 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -89.63 174.85 7.52 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.984 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' A' ' 40' ' ' SER . 2.0 pt-20 -73.58 51.73 0.37 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.341 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.8 p -151.7 19.33 0.71 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.491 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.605 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.8 OUTLIER -68.75 173.02 5.59 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.84 0.352 . . . . 0.0 111.805 -179.572 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.11 -56.85 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.606 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.13 -51.68 9.01 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 122.548 2.165 . . . . 0.0 113.044 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.55 91.34 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.931 0.396 . . . . 0.0 110.593 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -61.5 -38.73 88.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.012 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.18 -34.84 37.18 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.695 0.283 . . . . 0.0 110.642 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -59.2 -29.72 67.69 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.926 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.434 ' HG2' ' HB2' ' A' ' 81' ' ' ASP . 0.3 OUTLIER -66.77 -177.81 0.65 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.405 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.46 -53.91 0.25 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.275 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -146.12 -53.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -87.82 128.33 35.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.842 0.354 . . . . 0.0 110.868 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.434 ' HB2' ' HG2' ' A' ' 77' ' ' MET . 42.4 t0 -149.78 126.3 10.9 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.907 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.5 p -125.6 131.58 52.68 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.14 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.875 HD11 HG22 ' A' ' 21' ' ' VAL . 0.9 OUTLIER -136.52 164.18 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.725 179.805 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -126.2 106.36 9.49 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.332 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.634 HG21 ' HE2' ' A' ' 46' ' ' TYR . 33.1 m -84.83 118.48 31.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.027 0.442 . . . . 0.0 111.181 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.29 173.58 6.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.513 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.058 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.3 t70 . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.738 0.304 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -133.46 139.25 46.59 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.563 HG22 ' HA ' ' A' ' 79' ' ' ASP . 18.8 pt -80.54 126.9 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 121.048 0.451 . . . . 0.0 111.539 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -87.57 105.27 17.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.021 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.404 ' HG ' ' HB3' ' A' ' 81' ' ' ASP . 1.5 mp -111.62 124.94 53.36 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.03 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.451 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.3 OUTLIER -96.79 102.43 14.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.45 179.649 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.674 HG22 HD11 ' A' ' 83' ' ' ILE . 13.4 t -82.4 123.16 38.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.42 102.95 9.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.098 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.76 153.67 31.55 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.468 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -59.91 -33.6 72.07 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -61.29 -31.65 71.49 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.443 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.15 83.4 0.97 Allowed Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.548 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.7 t -157.93 152.06 24.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.674 0.273 . . . . 0.0 111.247 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.3 t -141.28 93.11 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -112.19 137.15 46.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.067 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -99.65 87.29 3.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.949 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.32 132.64 35.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.018 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 13.8 mtmm -111.97 96.51 6.09 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.479 HD11 HD11 ' A' ' 17' ' ' ILE . 3.1 pt -107.0 179.02 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.223 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.62 149.39 22.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.823 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -85.93 51.49 2.22 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.856 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -154.96 34.13 0.39 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.906 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.17 153.31 29.36 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.785 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.543 ' HA ' HG23 ' A' ' 71' ' ' THR . 57.7 Cg_endo -70.7 163.84 37.59 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.63 2.22 . . . . 0.0 112.405 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.654 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.6 mt -59.58 -24.68 63.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.52 -33.73 46.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.638 0.256 . . . . 0.0 111.287 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -57.62 7.38 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.276 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.415 HD12 HG12 ' A' ' 33' ' ' ILE . 9.6 tt -63.64 -43.57 96.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.116 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.665 ' SD ' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -58.2 -50.18 74.46 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.415 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.62 -53.25 58.68 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.69 65.87 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.722 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -79.63 -53.67 6.61 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.045 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.0 t -58.83 -36.35 74.4 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.12 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -72.93 -41.99 63.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.421 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -43.01 93.5 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.498 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -71.83 -76.27 0.11 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.267 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 152.18 39.86 0.03 OUTLIER Glycine 0 C--N 1.334 0.451 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.158 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.554 HD22 ' N ' ' A' ' 52' ' ' LEU . 2.9 mm? -96.78 -166.78 1.45 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.256 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.64 159.34 23.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.949 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.93 25.81 3.95 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.358 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 -139.61 14.7 2.53 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.458 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.662 ' O ' HD13 ' A' ' 57' ' ' ILE . 2.5 pt20 -160.8 77.66 0.59 Allowed 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.269 0.557 . . . . 0.0 110.076 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.665 HG21 ' SD ' ' A' ' 43' ' ' MET . 9.4 mm -145.47 157.2 13.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.795 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.413 ' N ' HG22 ' A' ' 57' ' ' ILE . 54.6 ttt180 -157.37 130.23 7.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.82 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.427 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -103.43 148.5 25.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.576 179.468 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -145.43 127.15 15.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.194 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -100.14 98.74 9.41 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.246 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.72 37.7 28.99 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.081 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.47 24.95 31.98 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.114 -0.565 . . . . 0.0 113.069 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -117.03 108.79 43.6 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.98 0.39 . . . . 0.0 110.659 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -52.1 115.8 2.39 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.044 2.496 . . . . 0.0 112.679 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.427 HG13 ' HB3' ' A' ' 59' ' ' PHE . 10.6 pt -139.16 148.0 24.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.267 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -94.9 170.45 9.42 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.734 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.412 ' HB3' ' HG3' ' A' ' 43' ' ' MET . 0.3 OUTLIER -83.11 23.77 0.84 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.539 179.225 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 p -116.46 11.76 14.97 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 122.457 -0.152 . . . . 0.0 111.111 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.654 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.7 t70 -65.79 168.64 7.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.898 0.38 . . . . 0.0 111.188 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.543 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -168.39 -55.22 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.341 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.92 -48.05 21.04 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.53 2.153 . . . . 0.0 112.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.87 89.07 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.627 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.25 -33.38 69.32 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.905 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.33 -32.49 49.2 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.725 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -58.66 -39.78 81.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.734 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.26 175.85 2.5 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.201 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.481 ' O ' HG22 ' A' ' 17' ' ' ILE . 4.2 pt-20 -123.47 -52.44 1.82 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.573 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASP . . . . . 0.563 ' HA ' HG22 ' A' ' 17' ' ' ILE . 11.2 m-20 -159.73 -57.13 0.06 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.875 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.07 117.06 16.49 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.145 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.404 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 27.4 t70 -158.92 153.15 23.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.451 HG22 ' HB2' ' A' ' 20' ' ' LYS . 32.6 p -137.7 145.65 42.81 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.399 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.674 HD11 HG22 ' A' ' 21' ' ' VAL . 1.0 OUTLIER -145.25 154.37 13.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.528 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -118.42 121.19 39.73 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.078 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.486 ' O ' HG13 ' A' ' 85' ' ' VAL . 13.8 p -94.12 111.56 25.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 121.19 0.519 . . . . 0.0 110.849 178.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -95.88 146.26 24.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.112 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.233 0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.038 179.828 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.234 0.252 0 CA-C-O 120.583 0.23 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.29 123.9 1.16 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.324 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.696 HG22 ' O ' ' A' ' 78' ' ' GLU . 22.6 pt -80.65 129.64 37.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -98.81 104.65 16.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.399 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.75 139.3 35.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.466 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.606 ' HB2' HG23 ' A' ' 82' ' ' THR . 0.0 OUTLIER -111.3 105.46 14.12 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.354 179.549 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.674 HG13 ' CD1' ' A' ' 83' ' ' ILE . 22.0 t -90.32 129.7 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.307 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -115.98 113.7 23.61 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.372 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.432 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -79.86 146.18 28.02 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.01 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -56.15 -51.83 66.57 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.503 0.192 . . . . 0.0 111.428 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -63.42 -23.72 67.53 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.407 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.13 88.94 1.03 Allowed Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.579 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.4 p -153.76 127.38 8.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.705 0.288 . . . . 0.0 111.252 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.86 97.11 5.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.874 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.43 135.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.24 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -110.09 115.86 30.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.082 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -104.75 165.04 11.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.113 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.9 mtpp -135.23 111.59 9.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.47 ' O ' HG12 ' A' ' 17' ' ' ILE . 27.1 pt -129.14 173.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.371 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 158.99 19.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.809 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ARG . . . . . 0.453 ' HD3' ' HA ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -90.76 52.56 2.21 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.831 0.348 . . . . 0.0 111.265 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -160.59 35.48 0.16 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -155.88 148.26 17.68 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 120.485 0.183 . . . . 0.0 111.142 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 35.6 Cg_exo -62.08 165.03 15.41 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.977 2.451 . . . . 0.0 112.878 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.51 HD12 ' CB ' ' A' ' 70' ' ' ASP . 8.8 mt -62.77 -17.87 61.74 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.885 179.728 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.9 p -50.94 -34.59 29.29 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -54.44 45.51 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.47 -41.12 89.5 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.346 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.616 ' HE3' ' HB3' ' A' ' 68' ' ' GLU . 7.4 mmm -59.3 -53.72 55.0 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.521 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -55.12 -54.0 48.78 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.095 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.3 81.28 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.409 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.437 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 71.6 t80 -69.6 -37.15 76.77 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.414 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -76.94 -34.36 57.64 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.668 0.271 . . . . 0.0 111.03 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -78.16 -37.14 46.58 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.389 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -60.17 -36.31 77.3 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.773 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.93 -70.62 0.62 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.396 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.33 46.27 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.944 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -112.02 -160.03 0.7 Allowed 'General case' 0 C--O 1.233 0.227 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 t -130.47 163.33 27.22 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.9 0.381 . . . . 0.0 111.191 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.6 ttp -93.11 26.75 2.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.289 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -135.49 14.36 3.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.474 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.508 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -160.85 77.93 0.59 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.267 0.556 . . . . 0.0 110.541 179.049 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.548 HG21 ' SD ' ' A' ' 43' ' ' MET . 8.3 mm -148.46 158.78 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.747 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.455 ' N ' HG22 ' A' ' 57' ' ' ILE . 6.3 tpt180 -142.28 134.24 27.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.155 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.45 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -121.83 124.97 45.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.302 179.411 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -124.4 120.82 33.19 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.055 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -100.55 95.29 6.61 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.455 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.49 41.65 32.07 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.119 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.46 25.66 32.56 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.969 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -114.98 94.5 38.54 Favored Pre-proline 0 C--O 1.232 0.177 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -56.16 93.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.901 2.401 . . . . 0.0 112.458 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 27.1 pt -114.34 166.11 8.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.191 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -110.14 175.23 5.51 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.777 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.616 ' HB3' ' HE3' ' A' ' 43' ' ' MET . 1.4 pm0 -65.48 -14.9 62.0 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.654 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 80.5 p -91.08 29.39 1.4 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.51 ' CB ' HD12 ' A' ' 39' ' ' LEU . 3.0 t70 -73.59 167.48 21.26 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 120.407 0.146 . . . . 0.0 111.114 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.492 ' N ' ' HD2' ' A' ' 72' ' ' PRO . 17.2 m -169.0 -58.59 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 71' ' ' THR . 5.3 Cg_endo -47.24 -51.22 9.82 Favored 'Trans proline' 0 C--N 1.358 1.04 0 C-N-CA 122.943 2.428 . . . . 0.0 112.773 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.404 ' HB3' ' OD2' ' A' ' 70' ' ' ASP . . . -60.22 -41.16 92.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.053 0.454 . . . . 0.0 110.261 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.94 -33.14 74.11 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.092 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -75.68 -38.94 58.27 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 110.426 179.779 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.74 -40.66 88.81 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.059 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 30.9 mmt -70.61 176.35 4.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.322 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.696 ' O ' HG22 ' A' ' 17' ' ' ILE . 1.4 pm0 -129.71 -47.17 1.15 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.481 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -149.16 -64.54 0.23 Allowed 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 120.523 0.201 . . . . 0.0 111.219 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.62 106.73 2.28 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.006 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -145.76 117.28 8.04 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.832 0.349 . . . . 0.0 111.111 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.606 HG23 ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -115.22 146.26 41.61 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.467 -179.426 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.674 ' CD1' HG13 ' A' ' 21' ' ' VAL . 2.2 pp -146.88 161.33 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.586 179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -115.76 100.01 7.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.738 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 85' ' ' VAL . 14.3 p -79.85 113.59 19.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.164 0.506 . . . . 0.0 110.874 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -104.71 125.59 50.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.112 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.812 0.339 . . . . 0.0 111.177 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 C--O 1.234 0.264 0 CA-C-O 120.655 0.264 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 16' ' ' HIS . . . . . 0.404 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 5.7 m170 -160.93 143.55 12.69 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.672 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.698 HG12 HG23 ' A' ' 33' ' ' ILE . 8.5 pt -92.45 129.6 42.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-O 121.152 0.501 . . . . 0.0 111.174 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -82.36 119.6 24.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.286 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.753 HD23 HD11 ' A' ' 83' ' ' ILE . 0.5 OUTLIER -129.93 124.74 33.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.079 179.668 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -107.93 108.87 20.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.261 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.9 t -81.07 113.1 19.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.036 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.404 ' O ' ' HA ' ' A' ' 84' ' ' ASP . . . -101.4 105.26 16.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.051 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.47 146.27 27.24 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.384 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -24.52 47.73 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.73 40.71 1.05 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.738 0.304 . . . . 0.0 111.455 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.29 39.04 89.62 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.061 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 t -102.05 114.56 28.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.778 0.289 . . . . 0.0 110.97 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.33 98.95 6.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.983 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -126.79 134.6 65.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -84.39 149.48 25.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -154.31 132.91 12.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.016 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.404 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -94.69 149.65 21.02 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.744 179.794 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.698 HG23 HG12 ' A' ' 17' ' ' ILE . 7.8 tp -157.12 148.52 10.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.563 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.4 pttt -76.96 165.77 24.23 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.947 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -101.23 48.88 0.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.126 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.05 32.83 0.34 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.198 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.45 149.25 22.33 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.94 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.16 170.31 17.36 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.786 2.324 . . . . 0.0 112.722 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.833 HD12 ' HB2' ' A' ' 70' ' ' ASP . 6.2 mt -58.14 -22.34 50.7 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.544 179.542 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 t -49.9 -39.2 39.06 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.638 0.256 . . . . 0.0 110.758 178.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -46.46 87.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.173 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 tp -70.66 -47.52 59.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.732 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -43.7 86.73 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.122 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -60.68 -50.76 72.19 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.949 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.65 -45.72 74.48 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.69 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.479 ' CE2' HG11 ' A' ' 85' ' ' VAL . 81.7 t80 -61.97 -45.41 93.77 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.248 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -69.53 -37.79 77.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -72.74 -37.63 67.66 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.164 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -63.77 -33.8 76.47 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.506 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -81.34 -75.13 0.3 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.612 0.244 . . . . 0.0 111.312 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.49 45.8 0.02 OUTLIER Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.9 mt -114.27 -160.31 0.73 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.713 0.292 . . . . 0.0 110.254 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.9 -179.49 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.905 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 mtm -100.04 30.61 3.67 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.093 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.46 0.26 8.24 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.543 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.32 77.75 0.63 Allowed 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 121.251 0.548 . . . . 0.0 110.242 179.266 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.543 HD13 ' O ' ' A' ' 56' ' ' GLN . 8.1 mm -144.28 156.7 15.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.668 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.407 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.2 tpt180 -158.65 126.84 5.22 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.972 179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.63 144.14 42.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.283 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.468 ' O ' HG22 ' A' ' 83' ' ' ILE . 4.7 mtt180 -131.66 135.98 47.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.109 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -123.85 113.63 18.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.532 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 t0 56.25 37.05 28.47 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.66 22.67 63.84 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 121.043 -0.599 . . . . 0.0 113.11 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -119.21 127.41 26.5 Favored Pre-proline 0 C--O 1.231 0.128 0 CA-C-N 116.775 0.287 . . . . 0.0 110.871 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.25 110.07 2.56 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.759 2.306 . . . . 0.0 112.34 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.511 HD12 ' CD1' ' A' ' 39' ' ' LEU . 31.4 pt -116.61 176.61 2.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.132 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -133.28 179.41 6.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.155 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.87 40.08 0.45 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.474 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -141.14 16.59 2.26 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.149 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.833 ' HB2' HD12 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -72.94 168.8 18.23 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 120.762 0.315 . . . . 0.0 111.453 -179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.38 -57.34 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.421 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -47.76 -51.42 9.82 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.433 2.089 . . . . 0.0 113.095 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.39 98.78 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.835 0.35 . . . . 0.0 110.73 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -29.34 69.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.267 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.98 -31.8 39.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 110.709 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.85 -40.49 95.54 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.28 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.49 149.27 25.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.94 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.81 51.34 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.844 0.354 . . . . 0.0 111.647 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -170.79 -54.4 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.131 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -142.07 95.03 2.74 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -127.98 135.14 49.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.146 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -117.23 133.45 55.98 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.73 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.753 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -123.96 165.01 21.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.859 -179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.476 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -129.43 104.04 7.26 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.767 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.479 HG11 ' CE2' ' A' ' 46' ' ' TYR . 14.6 p -86.46 117.48 31.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.132 0.492 . . . . 0.0 111.136 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' PHE . . . . . 0.476 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 79.6 m-85 -108.43 150.88 26.8 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.454 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.332 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.021 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.636 0.255 . . . . 0.0 110.941 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.99 124.1 16.43 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.904 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 32' ' ' LYS . 14.4 pt -80.23 126.51 39.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-O 120.958 0.409 . . . . 0.0 111.221 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -92.62 93.45 8.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.513 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.04 122.1 40.76 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.806 0.336 . . . . 0.0 111.006 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 103.56 13.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.577 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.441 HG11 ' CD1' ' A' ' 46' ' ' TYR . 17.2 t -88.69 110.52 21.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.205 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -116.36 111.81 20.61 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.9 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.0 149.63 22.33 Favored Glycine 0 C--N 1.333 0.393 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.545 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.08 -31.97 61.59 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -64.18 -28.2 69.59 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.411 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 114.12 48.3 0.57 Allowed Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.617 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -125.69 113.27 17.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.594 0.235 . . . . 0.0 110.998 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 m -112.29 125.71 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.228 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.51 168.2 23.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -122.61 95.66 4.72 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.04 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -92.85 137.5 32.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.01 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 35.3 mtpt -126.85 111.87 14.68 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.994 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.4 178.88 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.416 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 155.36 35.08 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.06 30.16 2.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.424 179.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -136.29 35.23 2.76 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.709 0.29 . . . . 0.0 110.808 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.6 t -145.93 138.22 13.59 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.743 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.41 156.51 8.17 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.694 2.263 . . . . 0.0 112.572 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.864 HD12 ' HB2' ' A' ' 70' ' ' ASP . 12.7 mt -54.03 -22.51 10.79 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.944 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 t -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.572 0.225 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.15 -53.66 55.6 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.655 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.9 tt -67.08 -41.37 86.5 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.791 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.421 ' HG2' ' HB3' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -56.0 -58.12 9.25 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.133 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -56.64 -42.2 78.5 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.83 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.58 -35.25 77.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.32 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.441 ' CD1' HG11 ' A' ' 21' ' ' VAL . 83.1 t80 -77.14 -52.14 9.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.601 -179.761 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 p -60.93 -39.22 88.62 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.573 0.225 . . . . 0.0 111.195 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.16 -40.96 77.86 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.035 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -72.67 -40.67 66.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -73.66 -66.47 0.7 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.389 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.28 46.73 0.05 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.081 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -123.08 -159.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.86 163.65 21.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.913 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 5.8 mtm -97.97 27.81 4.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -132.59 8.45 4.22 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.507 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.5 77.97 0.62 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-O 121.228 0.537 . . . . 0.0 110.233 179.084 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.507 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.7 mm -143.69 158.16 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.586 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 57' ' ' ILE . 4.1 tpt180 -142.12 123.38 14.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.145 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.666 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -107.13 136.04 47.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.655 179.494 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.4 mtm-85 -135.42 140.3 44.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.367 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.456 ' CD2' HG23 ' A' ' 83' ' ' ILE . 1.8 t80 -120.23 101.63 7.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.273 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.45 34.76 24.83 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.22 -179.561 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 102.26 -27.94 18.13 Favored Glycine 0 CA--C 1.522 0.485 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.983 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -68.51 113.44 15.61 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.906 0.353 . . . . 0.0 111.007 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -75.13 118.9 5.39 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.592 2.195 . . . . 0.0 112.366 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.601 HD12 ' CD1' ' A' ' 39' ' ' LEU . 25.3 pt -124.32 174.39 8.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.316 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -112.76 178.12 4.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.282 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HB3' ' HG2' ' A' ' 43' ' ' MET . 0.5 OUTLIER -84.24 16.69 2.86 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.673 179.567 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.15 15.72 7.27 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.575 0.226 . . . . 0.0 111.098 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.864 ' HB2' HD12 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -72.8 118.29 15.55 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.753 0.311 . . . . 0.0 110.832 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.468 ' HB ' ' HD3' ' A' ' 72' ' ' PRO . 0.7 OUTLIER -112.0 -50.46 0.05 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.063 -179.737 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.468 ' HD3' ' HB ' ' A' ' 71' ' ' THR . 74.3 Cg_exo -50.38 -58.45 1.68 Allowed 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 122.216 1.944 . . . . 0.0 112.513 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.1 -37.95 89.14 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.9 0.381 . . . . 0.0 110.038 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.6 tm0? -54.39 -45.24 72.83 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.547 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tt -76.32 -31.93 58.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.58 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.28 -27.97 57.11 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.11 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 29.9 mmt -60.13 168.55 1.89 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.723 0.297 . . . . 0.0 110.92 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.19 -62.01 1.31 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.138 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -156.41 -60.96 0.1 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.453 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.85 111.71 22.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.995 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -140.14 146.71 39.17 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.239 -179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.78 137.92 51.85 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.283 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.666 HD13 ' CE2' ' A' ' 59' ' ' PHE . 0.4 OUTLIER -152.33 158.71 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -131.17 120.02 22.71 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.649 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.4 p -85.68 120.95 36.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 121.048 0.451 . . . . 0.0 111.083 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -108.14 158.37 17.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.217 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.178 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.058 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 120.775 0.321 . . . . 0.0 110.967 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m80 -146.76 158.97 44.04 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.154 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.553 HD11 HG13 ' A' ' 33' ' ' ILE . 12.8 pt -100.92 124.78 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.773 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -90.69 111.1 22.31 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.113 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.453 HD22 HG13 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -109.65 125.38 52.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.465 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.735 ' HB2' HG22 ' A' ' 82' ' ' THR . 8.3 mttp -95.91 104.68 16.63 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.366 179.438 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.628 ' HA ' HD12 ' A' ' 83' ' ' ILE . 12.6 t -89.31 120.11 37.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.158 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -118.08 92.14 3.75 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.03 166.03 49.7 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -84.75 48.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.73 0.3 . . . . 0.0 111.19 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -148.58 32.5 0.79 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.071 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.98 30.58 66.86 Favored Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.541 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.25 135.47 54.02 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.702 0.287 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 28' ' ' VAL . 15.6 m -144.23 103.71 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.194 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.3 t -125.13 141.52 44.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.185 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.85 102.75 12.56 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.99 0.424 . . . . 0.0 110.954 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.15 143.27 31.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.787 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -119.95 136.18 54.62 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.844 0.354 . . . . 0.0 111.27 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ILE . . . . . 0.553 HG13 HD11 ' A' ' 17' ' ' ILE . 2.3 pt -135.12 179.55 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.022 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.7 159.46 26.65 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.69 43.59 1.1 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 110.932 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -151.3 35.46 0.58 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -148.44 141.91 15.82 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.752 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' HG23 ' A' ' 71' ' ' THR . 37.1 Cg_endo -65.19 173.59 5.96 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.728 2.285 . . . . 0.0 112.525 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.683 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.2 mt -56.1 -24.18 38.7 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.382 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.4 t -50.4 -40.52 50.2 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.342 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -58.72 -58.6 7.86 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.022 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 42' ' ' LEU . 1.3 tm? -59.44 -42.93 93.08 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.818 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' MET . . . . . 0.469 ' HG2' ' CE1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -60.59 -54.7 42.28 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.141 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -60.7 -50.52 73.17 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.007 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.94 81.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.382 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.444 ' CZ ' HG11 ' A' ' 21' ' ' VAL . 67.7 t80 -69.61 -53.17 20.08 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -44.58 92.21 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.135 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.99 -45.59 92.22 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.851 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.77 78.55 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.126 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -74.9 -75.81 0.16 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.224 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.77 46.63 0.02 OUTLIER Glycine 0 C--N 1.334 0.45 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.196 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 mt -124.9 -163.26 1.16 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.625 0.25 . . . . 0.0 110.416 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.5 m -115.96 170.97 8.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.032 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ptm -102.38 22.89 12.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.432 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.67 15.72 2.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.568 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -160.62 78.03 0.62 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.168 179.174 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.568 HD13 ' O ' ' A' ' 56' ' ' GLN . 14.6 mm -146.44 157.98 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.604 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.447 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.7 tpt180 -142.93 109.0 5.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.328 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.469 ' CE1' ' HG2' ' A' ' 43' ' ' MET . 9.3 m-85 -105.23 151.17 24.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.342 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 56.2 mtt180 -146.21 136.87 24.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.882 0.372 . . . . 0.0 111.294 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' PHE . . . . . 0.586 ' HA ' HG22 ' A' ' 83' ' ' ILE . 67.0 t80 -96.58 94.81 7.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.155 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.03 35.78 20.38 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 112.9 -30.21 7.58 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.946 -0.645 . . . . 0.0 113.253 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -75.56 112.98 22.04 Favored Pre-proline 0 CA--C 1.533 0.312 0 CA-C-N 116.859 0.33 . . . . 0.0 111.431 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -59.96 137.62 77.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.914 2.409 . . . . 0.0 112.988 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.469 HD12 ' CD1' ' A' ' 39' ' ' LEU . 17.8 pt -147.56 158.68 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.996 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -137.44 176.18 8.94 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.302 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.85 81.35 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.316 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.0 t -177.66 -28.09 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.018 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.683 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.6 t70 -51.89 167.15 0.12 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.933 0.397 . . . . 0.0 111.733 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.471 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -162.17 -55.99 0.01 OUTLIER Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.263 179.844 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PRO . . . . . 0.471 ' HD2' ' H ' ' A' ' 71' ' ' THR . 93.6 Cg_exo -45.19 -48.29 11.47 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.385 2.057 . . . . 0.0 112.806 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.36 87.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.056 0.455 . . . . 0.0 110.063 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' GLN . . . . . 0.664 ' HG2' ' HE3' ' A' ' 77' ' ' MET . 13.9 tm0? -58.25 -34.61 70.65 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.819 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -32.4 61.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.472 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -43.62 84.45 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.836 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' MET . . . . . 0.664 ' HE3' ' HG2' ' A' ' 74' ' ' GLN . 3.8 ptt? -74.77 150.8 39.25 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.843 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.68 -43.9 0.48 Allowed 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.94 -67.74 0.93 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -179.565 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -94.46 127.59 40.47 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.869 0.366 . . . . 0.0 111.312 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -157.76 143.86 17.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.591 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' THR . . . . . 0.735 HG22 ' HB2' ' A' ' 20' ' ' LYS . 57.8 p -137.36 149.06 46.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.915 0.388 . . . . 0.0 111.477 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' A' ' 21' ' ' VAL . 1.1 pp -154.6 152.76 9.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.619 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -109.79 133.11 53.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.127 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.515 ' O ' HG13 ' A' ' 85' ' ' VAL . 8.4 p -107.95 103.6 15.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.273 0.559 . . . . 0.0 111.239 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -103.38 169.07 8.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.653 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.162 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.877 0.37 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -144.77 152.02 39.73 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.653 HG22 ' O ' ' A' ' 78' ' ' GLU . 18.2 pt -98.86 124.32 52.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.119 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASN . . . . . 0.451 ' C ' HD22 ' A' ' 19' ' ' LEU . 29.5 m-20 -84.41 122.4 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.056 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LEU . . . . . 0.492 HD12 HD11 ' A' ' 83' ' ' ILE . 4.3 mm? -119.56 117.28 27.94 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.258 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 95.27 10.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.325 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' VAL . . . . . 0.649 HG22 HD12 ' A' ' 83' ' ' ILE . 21.3 t -83.88 122.1 37.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.3 -179.538 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.68 119.29 37.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.227 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . 0.403 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -83.6 136.38 14.91 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.752 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.23 -35.81 81.58 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -58.4 -32.68 68.86 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.292 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.89 45.67 0.2 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 121.193 -0.527 . . . . 0.0 112.389 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.52 160.8 38.66 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.662 0.268 . . . . 0.0 110.969 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.0 t -142.03 101.57 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' VAL . . . . . 0.401 ' HB ' ' CE1' ' A' ' 46' ' ' TYR . 21.4 t -105.59 147.17 11.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.075 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -114.86 122.77 47.34 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.221 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -129.99 146.36 51.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.92 144.42 51.0 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.37 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.8 pt -145.11 178.96 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.367 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.49 148.25 26.06 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.629 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.8 56.65 4.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.884 0.373 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -165.05 35.41 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.95 146.85 16.38 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-O 120.629 0.252 . . . . 0.0 111.307 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.4 161.63 7.09 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.051 2.5 . . . . 0.0 113.102 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.576 ' CD1' HD12 ' A' ' 66' ' ' ILE . 10.5 mt -59.74 -22.31 61.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.739 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.08 -31.36 18.68 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.245 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -61.63 2.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.902 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tt -66.78 -45.26 79.01 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.5 mmm -53.86 -41.55 67.62 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.328 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -66.09 -57.9 6.67 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.949 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 49' ' ' ARG . . . -59.55 -34.24 72.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.927 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.401 ' CE1' ' HB ' ' A' ' 29' ' ' VAL . 35.0 t80 -60.34 -60.81 3.22 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.231 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.52 -28.3 69.86 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.271 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.43 -56.6 4.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -57.13 -41.32 78.83 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.467 -179.636 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.16 -72.41 0.25 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.137 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.06 41.81 0.09 OUTLIER Glycine 0 C--N 1.335 0.492 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.779 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LEU . . . . . 0.609 HD22 ' N ' ' A' ' 52' ' ' LEU . 1.4 mm? -103.74 -152.5 0.45 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 110.559 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.83 122.44 47.67 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.747 0.308 . . . . 0.0 110.929 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.2 tpt -63.34 -26.43 68.76 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.487 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.3 25.9 7.75 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLN . . . . . 0.591 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.7 78.04 0.61 Allowed 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.126 0.488 . . . . 0.0 110.467 179.125 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.591 HD13 ' O ' ' A' ' 56' ' ' GLN . 20.2 mm -146.88 159.14 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.847 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ARG . . . . . 0.484 ' N ' HG22 ' A' ' 57' ' ' ILE . 1.9 ttm-85 -141.0 135.34 31.04 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.732 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' PHE . . . . . 0.425 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -120.96 143.03 49.22 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -135.04 119.33 17.78 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.378 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -107.15 103.52 12.94 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.268 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.74 38.2 29.34 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.91 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.94 28.52 49.97 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.159 -0.543 . . . . 0.0 112.966 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -124.72 107.1 29.11 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-N 116.849 0.324 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.06 129.34 32.82 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.082 2.521 . . . . 0.0 112.855 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ILE . . . . . 0.576 HD12 ' CD1' ' A' ' 39' ' ' LEU . 11.0 pt -146.95 145.83 19.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.467 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -99.31 173.72 6.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.712 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.78 47.9 0.44 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.672 0.273 . . . . 0.0 111.608 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.5 p -148.35 18.01 1.06 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.572 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASP . . . . . 0.53 ' CB ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -74.41 176.7 6.53 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -179.826 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.23 -56.7 0.01 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.365 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -48.37 -48.63 16.46 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.562 2.175 . . . . 0.0 112.887 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.15 -42.14 76.36 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.759 0.314 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.73 -37.99 74.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.684 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.69 -31.99 57.61 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.518 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.48 -30.93 67.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.831 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.5 mtt -62.47 170.78 2.24 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.407 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 0.653 ' O ' HG22 ' A' ' 17' ' ' ILE . 25.5 tt0 -137.92 -52.97 0.63 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.425 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -156.61 -61.71 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -96.82 120.47 37.21 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.755 0.312 . . . . 0.0 111.172 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 159.28 43.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.266 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -122.91 151.1 42.1 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.458 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' ILE . . . . . 0.649 HD12 HG22 ' A' ' 21' ' ' VAL . 1.2 mt -144.51 168.07 10.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.923 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ASP . . . . . 0.453 ' H ' HG22 ' A' ' 83' ' ' ILE . 16.4 m-20 -137.86 97.2 3.37 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.677 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' VAL . . . . . 0.503 HG12 HG12 ' A' ' 21' ' ' VAL . 13.4 p -82.08 119.8 32.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.033 0.444 . . . . 0.0 111.138 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -99.34 129.13 45.52 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.983 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 . . . . . 0 C--O 1.233 0.203 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.935 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 m120 . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 120.597 0.237 . . . . 0.0 111.493 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -94.0 116.27 28.69 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.767 0.318 . . . . 0.0 110.818 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -142.22 146.14 34.88 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.465 HD12 HD11 ' A' ' 19' ' ' LEU . 16.5 pt -93.27 125.63 45.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.055 0.455 . . . . 0.0 111.208 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -94.18 89.37 5.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.836 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.465 HD11 HD12 ' A' ' 17' ' ' ILE . 6.8 mp -90.25 123.68 34.24 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.25 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.85 93.18 4.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.261 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.755 HG22 HD13 ' A' ' 83' ' ' ILE . 31.9 t -85.52 125.34 40.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.17 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.73 117.07 33.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.953 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.67 149.75 27.42 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.634 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -19.59 54.15 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.06 31.84 0.96 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.24 41.07 94.69 Favored Glycine 0 C--N 1.338 0.655 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.846 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.2 t -115.67 127.32 55.09 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.607 0.242 . . . . 0.0 111.094 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.3 m -117.09 115.29 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.118 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.2 t -136.95 134.23 48.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.248 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -105.56 154.64 20.1 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.159 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -135.78 146.18 47.33 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -119.02 111.94 18.94 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.144 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.1 pt -145.86 178.87 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.2 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.4 159.98 18.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.729 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.86 31.86 2.54 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.331 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.31 31.6 5.01 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.127 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.18 157.96 42.04 Favored Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.844 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.674 ' HA ' HG23 ' A' ' 71' ' ' THR . 57.8 Cg_endo -70.83 163.27 39.71 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.63 2.22 . . . . 0.0 112.645 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.686 HD12 ' HB3' ' A' ' 70' ' ' ASP . 10.1 mt -66.15 -12.98 59.36 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.832 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 61.8 m -51.29 -33.81 30.39 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.524 0.202 . . . . 0.0 111.26 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -56.43 5.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.559 -0.292 . . . . 0.0 110.958 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.81 -46.61 88.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.094 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -48.7 80.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.77 -54.28 44.56 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.79 -34.71 67.91 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.462 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.466 ' CE1' HG11 ' A' ' 85' ' ' VAL . 39.4 t80 -74.65 -54.85 6.64 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.978 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.448 ' HA ' HD12 ' A' ' 52' ' ' LEU . 42.5 t -59.8 -41.24 90.77 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.295 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -68.51 -37.06 79.72 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.317 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.65 -39.67 44.3 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.521 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -67.11 -64.91 0.76 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.348 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.39 46.96 0.05 OUTLIER Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.063 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 47' ' ' SER . 2.6 mt -122.25 -161.39 0.93 Allowed 'General case' 0 C--O 1.234 0.253 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.406 ' O ' HD11 ' A' ' 57' ' ' ILE . 0.9 OUTLIER -123.59 166.92 14.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.915 179.86 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 68.7 mtp -96.08 24.51 5.54 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.308 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -136.7 12.85 3.18 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.458 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.597 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.5 OUTLIER -160.84 78.12 0.6 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.121 0.486 . . . . 0.0 110.334 179.157 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.597 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.8 mm -141.94 156.86 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.037 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.412 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -156.89 116.28 3.42 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.944 179.617 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -95.8 123.6 39.44 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.721 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -106.53 117.86 35.15 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.253 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -121.6 101.98 7.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.345 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.9 38.75 29.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 76.84 25.35 64.9 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.102 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -125.51 91.11 49.39 Favored Pre-proline 0 C--O 1.233 0.19 0 CA-C-N 116.859 0.329 . . . . 0.0 110.737 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 115.82 2.63 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.01 2.474 . . . . 0.0 112.32 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.521 HD12 ' CD1' ' A' ' 39' ' ' LEU . 18.1 pt -117.51 140.92 38.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.341 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -90.44 172.73 8.52 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.752 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.79 -20.11 65.88 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.393 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 21.7 p -85.93 28.06 0.83 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.686 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -84.34 168.02 16.0 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.658 0.266 . . . . 0.0 111.149 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.674 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -171.01 -57.85 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.253 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -47.16 -50.28 11.35 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.624 2.216 . . . . 0.0 113.009 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.96 -45.41 85.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.792 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -60.87 -31.73 71.19 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.189 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 tt -75.96 -37.22 58.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.807 0.337 . . . . 0.0 110.347 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.79 -33.87 70.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.03 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 16.1 mtt -64.6 169.56 4.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.396 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -111.71 -54.68 2.59 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.989 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -175.01 -48.46 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.432 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -84.92 93.31 8.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.997 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -141.14 138.25 33.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.903 0.383 . . . . 0.0 111.366 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.87 142.23 39.78 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.22 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.755 HD13 HG22 ' A' ' 21' ' ' VAL . 0.1 OUTLIER -135.34 167.84 24.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.665 179.854 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.438 ' H ' HG22 ' A' ' 83' ' ' ILE . 65.4 m-20 -133.62 108.49 8.6 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.566 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.466 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.0 p -82.15 121.92 36.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.042 0.449 . . . . 0.0 111.203 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -123.14 167.45 13.67 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.319 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -126.09 99.08 5.75 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.733 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -138.3 119.79 14.93 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.568 0.223 . . . . 0.0 111.537 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLN . . . . . 0.401 ' O ' ' HB ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -116.9 -53.09 2.51 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.919 179.344 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 90' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 89' ' ' GLN . 63.5 m 69.58 96.14 0.07 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.073 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -101.33 121.21 7.15 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.825 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.547 -1.14 . . . . 0.0 112.825 179.806 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.1 m-20 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.752 0.31 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.2 107.46 7.24 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.638 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 m80 -135.83 158.79 43.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.049 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.46 HD11 HG13 ' A' ' 33' ' ' ILE . 14.5 pt -96.63 124.63 49.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.272 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -89.17 91.01 8.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.465 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 1.013 HD23 HD11 ' A' ' 83' ' ' ILE . 2.0 mp -107.43 124.23 49.56 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.282 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.878 ' HB2' HG22 ' A' ' 82' ' ' THR . 8.7 mttt -90.6 116.37 28.44 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.687 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.5 t -101.03 112.34 33.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.102 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.84 124.05 44.72 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.183 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.08 139.2 20.27 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.511 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -58.61 -30.64 67.39 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.11 -32.26 67.95 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.56 0.219 . . . . 0.0 111.536 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 125.25 45.03 0.26 Allowed Glycine 0 C--N 1.334 0.422 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.461 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.7 m -140.41 160.67 39.47 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.623 0.249 . . . . 0.0 110.89 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -140.76 114.14 5.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 120.818 0.342 . . . . 0.0 111.158 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 t -113.67 140.59 33.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.259 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -90.15 113.46 25.22 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.902 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.37 160.53 25.22 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 pttm -154.08 148.56 26.17 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.388 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.46 HG13 HD11 ' A' ' 17' ' ' ILE . 24.7 pt -146.91 178.04 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.321 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.43 148.38 25.01 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.419 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -82.95 55.64 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.962 0.41 . . . . 0.0 111.055 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m170 -156.93 31.29 0.3 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.955 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.43 150.78 25.89 Favored Pre-proline 0 N--CA 1.463 0.218 0 CA-C-O 120.625 0.25 . . . . 0.0 111.32 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.04 174.22 10.07 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.082 2.522 . . . . 0.0 112.794 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 66' ' ' ILE . 9.5 mt -61.21 -24.77 66.58 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.7 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 -36.46 64.89 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.527 0.203 . . . . 0.0 110.763 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -46.63 84.78 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.541 179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.434 ' HB2' HD13 ' A' ' 33' ' ' ILE . 3.4 tt -66.48 -51.71 53.86 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.448 ' HG3' ' CE1' ' A' ' 59' ' ' PHE . 5.4 ttp -60.28 -35.97 76.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.624 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -62.89 -58.89 5.83 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.585 0.231 . . . . 0.0 110.777 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.23 88.88 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.597 ' CE2' HG11 ' A' ' 85' ' ' VAL . 77.1 t80 -66.36 -37.43 85.3 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.419 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -80.66 -31.38 36.43 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.0 -55.95 4.75 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.95 -33.19 62.07 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.599 0.238 . . . . 0.0 111.372 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 3.7 tt0 -74.62 -54.82 6.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.274 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.25 -6.26 3.05 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.907 -0.663 . . . . 0.0 113.063 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.5 mt -71.45 -167.72 0.27 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.923 0.392 . . . . 0.0 110.753 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.7 m -116.1 159.53 21.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.56 29.73 2.2 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.49 6.67 4.12 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.582 ' O ' HD13 ' A' ' 57' ' ' ILE . 1.5 tt0 -160.79 77.7 0.59 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 110.427 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.582 HD13 ' O ' ' A' ' 56' ' ' GLN . 5.8 mm -147.21 155.99 10.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.726 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -159.59 154.91 25.36 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.213 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.53 ' HB3' HD11 ' A' ' 66' ' ' ILE . 3.4 m-85 -120.48 155.49 33.46 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.974 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.57 119.42 10.58 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 71.8 t80 -105.6 98.89 8.52 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.239 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 54.95 39.08 31.43 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 111.162 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.17 22.75 43.56 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.102 -0.571 . . . . 0.0 113.161 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 3.3 mt-30 -115.01 92.85 32.54 Favored Pre-proline 0 C--O 1.233 0.196 0 CA-C-N 116.991 0.396 . . . . 0.0 110.659 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.98 113.48 1.35 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.887 2.391 . . . . 0.0 111.99 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.687 HD12 HD11 ' A' ' 39' ' ' LEU . 21.5 pt -116.7 143.93 25.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.953 0.406 . . . . 0.0 111.461 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -92.7 170.35 9.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.076 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.51 -3.19 32.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.688 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 20.9 p -96.21 18.13 14.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.576 ' CB ' HD12 ' A' ' 39' ' ' LEU . 11.2 t0 -72.92 160.09 32.68 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.08 -55.49 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.54 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.25 -50.23 14.58 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 122.394 2.063 . . . . 0.0 112.958 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.82 86.73 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.936 0.398 . . . . 0.0 110.755 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -27.11 68.68 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.4 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.4 -34.37 41.92 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.559 0.218 . . . . 0.0 110.565 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -65.4 -47.89 74.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.878 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.93 114.21 27.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.73 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.455 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -152.73 69.68 0.87 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.869 0.366 . . . . 0.0 111.794 -179.746 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -172.63 -69.38 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.963 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -143.07 92.2 2.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.6 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -139.64 146.4 39.68 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.996 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.878 HG22 ' HB2' ' A' ' 20' ' ' LYS . 71.2 p -119.41 147.67 44.11 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.628 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 1.013 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -133.2 167.06 27.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.813 179.549 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.413 ' H ' HG22 ' A' ' 83' ' ' ILE . 1.8 t0 -116.14 97.74 6.23 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.489 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.597 HG11 ' CE2' ' A' ' 46' ' ' TYR . 11.0 p -81.38 114.28 22.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 121.269 0.557 . . . . 0.0 111.504 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -98.8 131.44 44.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.667 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 -98.88 33.25 2.38 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 68.44 153.62 0.1 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.533 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.83 144.75 45.38 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.965 -179.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.83 84.07 2.04 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.062 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.81 -156.87 49.88 Favored Glycine 0 CA--C 1.52 0.381 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.929 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.56 -1.133 . . . . 0.0 112.556 179.946 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 120.633 0.254 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -152.92 92.9 1.69 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.075 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -153.89 125.53 7.63 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.755 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.3 pt -80.95 129.87 36.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 111.234 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -89.74 113.42 24.94 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.289 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.8 mp -122.83 133.2 54.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.257 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.673 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.0 OUTLIER -101.62 112.93 25.65 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.45 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.826 HG22 HD11 ' A' ' 83' ' ' ILE . 16.3 t -90.5 124.4 43.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.07 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.7 115.48 30.32 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.74 149.82 32.04 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.691 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -54.56 -33.5 60.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.416 0.287 . . . . 0.0 111.552 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.45 32.3 2.04 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.75 53.67 15.02 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.966 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -107.29 101.18 10.58 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.545 0.212 . . . . 0.0 110.891 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -97.63 109.25 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 120.735 0.302 . . . . 0.0 111.344 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 t -139.78 151.99 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.51 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -112.47 147.55 36.29 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.316 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -142.62 137.94 30.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.106 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -110.11 116.21 31.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.869 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.7 pt -133.95 178.45 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.485 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.99 156.48 16.3 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.821 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.48 39.62 1.03 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.39 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -147.17 33.39 0.9 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.74 0.305 . . . . 0.0 111.133 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -142.07 155.41 65.33 Favored Pre-proline 0 C--O 1.232 0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.828 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.415 ' HA ' HG23 ' A' ' 71' ' ' THR . 54.8 Cg_endo -69.13 165.97 28.42 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.526 2.151 . . . . 0.0 112.243 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.719 HD11 HD12 ' A' ' 66' ' ' ILE . 10.4 mt -58.21 -24.39 58.99 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 24.7 p -53.39 -32.89 51.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.362 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.57 -58.96 5.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.824 -0.171 . . . . 0.0 110.694 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.63 -39.6 91.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.636 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.6 -43.1 85.76 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.352 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -63.51 -38.67 92.01 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.767 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.19 -34.2 61.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.579 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.579 ' CE1' HG11 ' A' ' 85' ' ' VAL . 53.5 t80 -80.86 -37.11 30.48 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 t -79.39 -41.08 28.56 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -72.67 -45.05 60.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.733 -0.212 . . . . 0.0 111.519 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -62.22 -35.65 79.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.299 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.434 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 1.9 tt0 -75.47 -66.86 0.72 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.078 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.16 46.21 0.11 Allowed Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.188 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 13.7 mt -112.2 -154.38 0.54 Allowed 'General case' 0 C--O 1.233 0.198 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.6 166.1 10.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.946 0.403 . . . . 0.0 111.284 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.64 -36.75 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.221 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.9 28.53 2.69 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.69 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.444 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -160.67 77.56 0.6 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.104 0.478 . . . . 0.0 110.28 178.854 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.473 HG22 ' N ' ' A' ' 58' ' ' ARG . 10.0 mm -152.02 158.64 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.511 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.473 ' N ' HG22 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -156.64 129.95 8.05 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.957 0.408 . . . . 0.0 111.21 179.307 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -106.4 136.99 45.19 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.655 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -113.47 121.32 43.94 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.256 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -113.61 89.07 2.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.99 39.09 31.48 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.05 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.88 23.19 39.47 Favored Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.081 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -119.82 92.68 46.85 Favored Pre-proline 0 C--O 1.233 0.216 0 CA-C-N 116.976 0.388 . . . . 0.0 110.603 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.09 106.82 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.957 2.438 . . . . 0.0 112.25 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.719 HD12 HD11 ' A' ' 39' ' ' LEU . 14.3 pt -111.47 133.41 57.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.374 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -87.68 177.04 7.15 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 40' ' ' SER . 1.2 pm0 -83.49 23.74 0.91 Allowed 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.9 p -126.6 13.97 7.55 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 122.508 -0.12 . . . . 0.0 111.284 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.713 ' HB2' HD12 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -73.44 175.78 6.67 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.649 0.261 . . . . 0.0 111.297 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.415 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -168.43 -55.19 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.351 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -49.6 -50.18 13.79 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 122.39 2.06 . . . . 0.0 113.16 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.01 -44.86 87.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.67 0.271 . . . . 0.0 110.86 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -39.51 75.47 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 tt -81.88 -33.22 30.64 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.002 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.51 -29.88 62.37 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.361 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.3 mtt -62.77 170.96 2.31 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.249 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -117.34 -51.49 2.52 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.253 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.07 -56.36 0.02 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 120.657 0.265 . . . . 0.0 111.032 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -83.1 107.68 15.84 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.66 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.44 157.6 43.21 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.266 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.673 HG22 ' HB2' ' A' ' 20' ' ' LYS . 21.9 p -146.09 149.04 33.3 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.377 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.826 HD11 HG22 ' A' ' 21' ' ' VAL . 1.2 pp -144.26 160.57 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.967 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.61 106.8 14.95 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.579 HG11 ' CE1' ' A' ' 46' ' ' TYR . 9.6 p -79.91 114.99 21.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.126 0.489 . . . . 0.0 110.996 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.412 ' O ' ' HG3' ' A' ' 58' ' ' ARG . 3.8 m-85 -110.7 169.38 8.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.973 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -130.02 156.7 44.05 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.348 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -129.18 139.23 51.98 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.212 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -133.69 125.43 28.61 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.802 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -60.08 2.41 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.528 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.62 -42.34 1.6 Allowed Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.727 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.468 -1.184 . . . . 0.0 112.743 179.918 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 120.495 0.188 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 63.14 97.77 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.05 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -141.33 164.71 29.52 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.039 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 78' ' ' GLU . 16.3 pt -105.71 124.55 60.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.417 . . . . 0.0 111.202 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -85.57 122.73 30.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mp -119.44 134.17 55.35 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.366 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.568 ' HB2' HG22 ' A' ' 82' ' ' THR . 11.6 mmtt -104.91 94.01 5.03 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.456 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.766 HG22 HD11 ' A' ' 83' ' ' ILE . 16.4 t -83.45 112.11 20.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.156 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.24 112.42 25.44 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.053 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.95 128.57 8.58 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.398 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -57.1 -36.0 70.11 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.509 0.195 . . . . 0.0 111.197 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -62.31 -30.54 71.22 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.132 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.53 57.47 0.19 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.581 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -149.76 107.57 3.69 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.709 0.29 . . . . 0.0 111.041 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.4 HG13 ' O ' ' A' ' 28' ' ' VAL . 13.2 p -107.99 123.39 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.231 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.1 t -139.96 138.72 37.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.111 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -92.55 130.67 38.14 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.9 158.93 22.25 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.13 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 mtpm? -132.35 94.8 3.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.955 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 HD23 ' A' ' 42' ' ' LEU . 4.2 pt -115.27 179.43 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.25 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.9 166.55 11.73 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.838 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.0 33.2 1.36 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.148 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -145.3 28.71 1.19 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.12 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.6 p -135.58 131.25 19.23 Favored Pre-proline 0 C--O 1.231 0.131 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' HG23 ' A' ' 71' ' ' THR . 40.5 Cg_exo -56.77 164.68 5.66 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.654 2.236 . . . . 0.0 112.509 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.794 HD11 HD12 ' A' ' 66' ' ' ILE . 9.8 mt -55.54 -23.47 26.81 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.307 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.4 p -52.44 -42.57 64.26 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.04 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -49.41 77.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 110.772 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 42' ' ' LEU . 0.3 OUTLIER -65.58 -48.59 71.85 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.635 179.617 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -50.87 71.73 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.243 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -57.47 -56.01 27.35 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.814 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.07 87.76 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.616 ' CE2' HG11 ' A' ' 85' ' ' VAL . 70.5 t80 -62.79 -51.64 66.31 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.224 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.472 ' HA ' HD12 ' A' ' 52' ' ' LEU . 97.1 p -63.31 -44.05 96.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -65.37 -37.17 86.2 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.955 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -74.25 -41.1 61.83 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.267 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -67.12 0.68 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.285 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 147.53 45.97 0.03 OUTLIER Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.202 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 47' ' ' SER . 0.9 OUTLIER -128.62 -163.42 1.28 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.743 0.306 . . . . 0.0 110.644 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 m -138.39 174.57 10.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.004 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.0 ttp -96.32 30.3 2.56 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.007 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -115.97 -5.58 11.99 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.71 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.652 ' O ' HD13 ' A' ' 57' ' ' ILE . 5.6 tt0 -160.23 78.02 0.65 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.219 0.533 . . . . 0.0 110.156 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.652 HD13 ' O ' ' A' ' 56' ' ' GLN . 15.5 mm -142.31 157.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.76 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.433 ' N ' HG22 ' A' ' 57' ' ' ILE . 4.7 tpt180 -153.6 117.07 4.64 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.023 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -98.95 143.31 29.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.343 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -133.75 134.57 43.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.344 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -117.6 104.98 11.57 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.401 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.58 37.05 25.44 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.012 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 82.6 25.37 50.67 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 121.02 -0.61 . . . . 0.0 113.042 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -119.77 101.43 48.12 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.803 0.302 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.32 122.06 10.54 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.99 2.46 . . . . 0.0 112.74 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.794 HD12 HD11 ' A' ' 39' ' ' LEU . 15.0 pt -138.24 154.95 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.228 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 36.9 m-20 -95.06 178.79 5.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.593 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.446 ' OE2' HG23 ' A' ' 69' ' ' THR . 0.0 OUTLIER -83.87 28.85 0.57 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.429 179.267 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' THR . . . . . 0.446 HG23 ' OE2' ' A' ' 68' ' ' GLU . 41.8 p -120.38 6.24 10.66 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.75 ' HB2' HD12 ' A' ' 39' ' ' LEU . 3.2 t70 -62.02 163.14 8.25 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.863 0.363 . . . . 0.0 111.462 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.459 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -166.04 -56.72 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.212 179.929 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.27 -42.17 40.82 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 122.509 2.14 . . . . 0.0 112.728 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.76 -41.3 65.25 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.582 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -58.19 -37.57 75.02 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.22 -31.29 49.26 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.737 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -58.97 -34.48 71.85 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 17.7 mmt -66.62 173.67 3.29 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.324 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.45 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.7 OUTLIER -126.19 -52.35 1.52 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.22 -179.931 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -148.94 -58.09 0.21 Allowed 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.307 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -80.69 121.68 26.18 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.102 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -151.89 109.24 3.58 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.905 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.568 HG22 ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -100.16 137.16 38.99 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -179.622 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.766 HD11 HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -142.82 162.43 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.337 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -129.36 112.75 14.16 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.983 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.616 HG11 ' CE2' ' A' ' 46' ' ' TYR . 7.7 p -82.66 101.38 7.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.236 0.541 . . . . 0.0 110.778 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -89.82 164.46 14.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.123 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 mm-40 -121.15 128.45 52.52 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.969 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -67.59 -51.99 43.81 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.346 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 56.88 67.94 0.92 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.35 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -146.63 -60.34 0.3 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.049 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 87.62 -134.19 12.3 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 120.959 -0.638 . . . . 0.0 112.45 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.438 -1.201 . . . . 0.0 112.51 179.964 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 m120 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 120.693 0.282 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.84 87.34 4.06 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.3 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.407 ' HB3' ' HG2' ' A' ' 32' ' ' LYS . 13.7 m80 -156.31 109.94 2.71 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.661 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.476 HG13 HD11 ' A' ' 19' ' ' LEU . 21.3 pt -81.95 130.1 36.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 111.31 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -92.31 132.16 36.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.456 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.476 HD11 HG13 ' A' ' 17' ' ' ILE . 4.9 mp -137.94 132.07 31.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.082 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.66 100.47 11.17 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.487 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.72 117.76 29.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.323 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.89 115.97 26.01 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.17 143.72 24.18 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.824 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -60.23 -27.65 67.38 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.62 39.1 1.03 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.71 93.44 0.04 OUTLIER Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.588 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 62.1 p -168.44 161.68 11.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.802 0.334 . . . . 0.0 111.538 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 28' ' ' VAL . 8.3 p -152.27 109.65 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.14 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.7 t -137.62 135.28 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.222 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -104.71 139.62 39.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.118 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -128.72 153.12 47.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.196 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.407 ' HG2' ' HB3' ' A' ' 16' ' ' HIS . 2.7 tttt -129.46 124.14 33.31 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.904 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.3 pt -140.47 177.02 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.61 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 152.6 34.82 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.198 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -88.32 55.53 3.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 111.16 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.03 40.89 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.934 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.2 t -149.33 142.59 16.09 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.032 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.465 ' CA ' HG23 ' A' ' 71' ' ' THR . 55.4 Cg_endo -69.37 167.78 22.93 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.795 2.33 . . . . 0.0 112.613 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.649 HD12 ' CB ' ' A' ' 70' ' ' ASP . 12.4 mt -66.51 -12.83 59.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.851 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.3 t -53.97 -36.23 62.65 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.605 0.24 . . . . 0.0 111.285 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -39.09 24.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.374 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.503 HD23 ' CD2' ' A' ' 39' ' ' LEU . 20.3 tp -68.23 -40.9 81.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.76 0.314 . . . . 0.0 110.547 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.488 ' HG3' ' CD1' ' A' ' 59' ' ' PHE . 2.0 ttm -67.14 -34.39 77.49 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.19 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -69.93 -47.8 60.98 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.635 0.255 . . . . 0.0 110.828 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.89 97.86 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.263 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.593 ' CE2' HG11 ' A' ' 85' ' ' VAL . 88.5 t80 -59.99 -44.52 94.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -38.82 88.34 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.119 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.96 -38.83 61.61 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.603 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.03 -46.6 73.93 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.2 tt0 -68.35 -64.6 0.83 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.528 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 146.77 47.0 0.03 OUTLIER Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.267 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.6 mt -127.33 -161.0 1.04 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.96 157.89 28.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.769 0.318 . . . . 0.0 110.954 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.8 mtm -97.62 29.51 3.3 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -127.24 4.74 6.36 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.628 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.481 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.69 77.75 0.6 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.147 0.499 . . . . 0.0 110.314 179.634 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.481 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.4 mm -147.12 158.96 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.663 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.47 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.7 ptp85 -154.92 145.45 22.21 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.239 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.488 ' CD1' ' HG3' ' A' ' 43' ' ' MET . 2.8 m-85 -117.28 164.78 14.3 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.006 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -148.96 119.77 7.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -91.43 94.77 9.64 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.453 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 56.23 39.73 30.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 85.92 21.37 53.17 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.336 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -108.79 114.87 58.17 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.97 0.385 . . . . 0.0 110.373 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.96 96.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.825 2.35 . . . . 0.0 112.329 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.412 HD11 ' HB3' ' A' ' 59' ' ' PHE . 10.7 pt -114.32 133.75 59.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.272 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -90.66 176.25 6.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.935 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -15.88 63.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.509 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 6.6 p -89.42 32.74 0.84 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.563 0.22 . . . . 0.0 111.543 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.649 ' CB ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -74.25 155.7 37.99 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-O 120.484 0.183 . . . . 0.0 110.793 179.752 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.465 HG23 ' CA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -166.0 -57.15 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.376 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.434 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -46.67 -53.66 5.85 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.48 2.12 . . . . 0.0 113.152 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.34 96.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.757 0.313 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.42 -32.07 70.99 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.137 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.99 -33.2 51.46 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.688 0.28 . . . . 0.0 110.537 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -41.34 85.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.766 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -177.3 1.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.227 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -148.35 -59.21 0.24 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.415 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -136.85 23.34 3.09 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -166.14 93.71 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.788 0.328 . . . . 0.0 111.346 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.401 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 39.7 t0 -121.34 109.22 14.64 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.67 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.2 p -91.81 125.4 36.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.398 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.476 HD13 ' HE2' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -145.49 146.31 19.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.389 179.793 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -109.25 107.3 17.48 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.91 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.593 HG11 ' CE2' ' A' ' 46' ' ' TYR . 9.0 p -80.79 112.84 19.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 121.243 0.544 . . . . 0.0 111.159 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -96.47 158.86 15.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.954 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.19 151.69 46.79 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.731 -179.348 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -117.45 157.45 26.21 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.999 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 60.27 31.62 20.51 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.114 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.84 -53.07 0.39 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.709 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -131.26 97.77 0.37 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.329 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.181 0 CA-C-O 118.723 -1.043 . . . . 0.0 112.91 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.76 0.314 . . . . 0.0 111.532 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.97 164.22 14.08 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.613 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -139.36 129.66 25.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.134 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.676 HG22 ' O ' ' A' ' 78' ' ' GLU . 18.8 pt -80.29 126.51 39.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.118 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -85.94 106.21 16.97 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.348 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.614 HD13 HD22 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -105.23 125.23 50.75 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.416 179.866 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -93.17 90.27 6.78 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.138 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.454 ' HA ' HD12 ' A' ' 83' ' ' ILE . 18.8 t -81.52 100.16 5.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.152 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.27 111.93 24.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.18 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.24 146.31 27.6 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.455 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.04 55.76 1.86 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 111.064 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -178.14 41.17 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.276 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.72 73.79 0.61 Allowed Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.073 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.4 p -166.53 106.22 0.64 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.761 0.281 . . . . 0.0 111.43 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -122.52 108.48 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.944 0.402 . . . . 0.0 111.302 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.1 t -121.01 149.93 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.316 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.96 113.85 26.91 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.159 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.78 150.32 24.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.05 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 mttp -130.74 124.62 31.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.41 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 pt -145.85 -180.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.395 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.13 152.43 34.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.114 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.07 59.49 2.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -168.62 39.84 0.03 OUTLIER 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.677 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 t -151.27 145.01 17.56 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.021 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.34 163.92 24.86 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.99 2.46 . . . . 0.0 112.509 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.773 HD23 HD21 ' A' ' 42' ' ' LEU . 12.3 mt -56.61 -27.45 58.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.046 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.3 p -51.66 -36.35 45.91 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -58.48 -63.46 1.27 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.556 0.217 . . . . 0.0 110.927 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.773 HD21 HD23 ' A' ' 39' ' ' LEU . 3.5 pp -65.53 -29.42 70.06 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.867 179.465 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.5 mmt -59.21 -49.06 79.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.607 0.241 . . . . 0.0 110.618 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -66.57 -39.1 88.32 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.876 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.33 -45.77 68.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.506 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -61.86 -47.04 86.8 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.422 ' HA ' HD12 ' A' ' 52' ' ' LEU . 42.3 p -62.08 -37.73 86.12 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.748 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.01 -38.9 56.76 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.412 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.65 64.69 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -73.45 -70.19 0.38 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.714 0.292 . . . . 0.0 111.514 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 156.05 46.09 0.02 OUTLIER Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.068 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 47' ' ' SER . 1.5 mt -119.43 -159.92 0.79 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -128.32 161.36 29.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.85 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.08 27.81 3.47 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.121 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -131.09 8.49 4.75 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.494 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.21 77.71 0.64 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.251 0.548 . . . . 0.0 110.08 178.999 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.494 HD13 ' O ' ' A' ' 56' ' ' GLN . 10.8 mm -144.8 158.39 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.636 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 57' ' ' ILE . 26.2 ttt85 -149.53 141.71 24.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -119.29 160.7 21.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.894 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -146.17 109.99 4.89 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.464 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.621 ' HA ' HG22 ' A' ' 83' ' ' ILE . 56.7 t80 -89.27 101.91 14.58 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.118 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 t0 53.13 40.61 31.51 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.979 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 99.39 -35.15 4.89 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.961 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.44 112.77 14.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.658 0.229 . . . . 0.0 111.269 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.2 144.45 37.31 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.74 2.293 . . . . 0.0 112.873 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.544 ' N ' HD13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -144.94 173.87 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 179.593 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -109.16 178.52 4.43 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.456 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.82 -12.78 61.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.431 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.8 p -89.79 28.32 1.37 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.678 ' CB ' HD12 ' A' ' 39' ' ' LEU . 9.2 t0 -76.15 169.04 18.94 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.647 0.26 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.3 -54.82 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.367 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.89 -53.31 5.86 Favored 'Trans proline' 0 C--N 1.358 1.033 0 C-N-CA 122.669 2.246 . . . . 0.0 113.242 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.503 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . . . -61.3 -35.45 77.38 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.12 0.486 . . . . 0.0 110.647 179.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.421 HE22 HD23 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -73.49 -26.21 60.8 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.477 179.567 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 75' ' ' LEU . 0.3 OUTLIER -85.94 -36.61 19.76 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.621 0.248 . . . . 0.0 110.976 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 73' ' ' ALA . 11.5 pt-20 -66.23 -34.53 78.22 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.991 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.491 ' HE1' HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -69.28 178.18 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.822 179.661 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.676 ' O ' HG22 ' A' ' 17' ' ' ILE . 17.5 tt0 -136.48 -64.54 0.59 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -134.24 -48.17 0.78 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.318 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -92.76 114.37 26.91 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.691 0.281 . . . . 0.0 111.418 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -138.8 137.83 37.01 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -123.33 130.01 52.13 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.48 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.621 HG22 ' HA ' ' A' ' 61' ' ' PHE . 1.2 pp -147.84 152.43 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.145 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.23 111.54 22.67 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.122 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 85' ' ' VAL . 11.7 p -82.62 111.8 19.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.253 0.549 . . . . 0.0 111.369 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -97.97 152.27 19.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.015 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -128.73 121.85 29.37 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.059 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.63 156.94 37.2 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.589 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.91 177.82 4.5 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.442 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 19.3 m 75.76 -64.78 0.35 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.474 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.01 108.5 2.71 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.779 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.519 -1.156 . . . . 0.0 112.516 179.58 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 120.695 0.283 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -116.3 105.87 13.03 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.346 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -152.27 138.44 18.31 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.882 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.628 HG22 ' HB2' ' A' ' 78' ' ' GLU . 25.4 pt -80.91 130.53 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.605 ' O ' HD13 ' A' ' 19' ' ' LEU . 2.8 m-20 -106.31 111.91 24.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.899 HD12 ' HB3' ' A' ' 81' ' ' ASP . 0.4 OUTLIER -124.48 136.4 53.98 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.785 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.4 mttp -97.25 97.4 9.13 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.553 HG22 HD11 ' A' ' 83' ' ' ILE . 24.3 t -82.5 108.49 15.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.55 123.56 38.06 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.96 153.27 32.43 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.458 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -28.0 53.55 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -93.59 29.79 1.92 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.43 72.6 0.63 Allowed Glycine 0 C--N 1.337 0.588 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.098 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 m -150.5 92.97 1.91 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.756 0.312 . . . . 0.0 111.245 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.489 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.5 p -91.35 113.98 27.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.933 0.397 . . . . 0.0 111.054 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -116.61 138.65 46.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.159 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -86.24 143.93 27.69 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.129 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -138.0 149.3 45.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -135.51 115.7 13.38 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.161 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.544 HD12 ' O ' ' A' ' 34' ' ' LYS . 1.2 pt -147.16 -179.83 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.834 0.349 . . . . 0.0 111.559 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.544 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.13 151.43 25.73 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.848 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.435 ' HD2' HD13 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -93.16 29.16 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.797 0.332 . . . . 0.0 111.517 179.668 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -122.44 37.48 4.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.7 t -154.64 142.63 14.19 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.631 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.697 ' HA ' HG23 ' A' ' 71' ' ' THR . 33.9 Cg_endo -64.06 168.83 11.55 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.656 2.237 . . . . 0.0 112.34 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.638 HD11 HD12 ' A' ' 66' ' ' ILE . 13.1 mt -55.0 -24.65 25.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.617 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.5 t -51.72 -39.61 58.72 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -60.16 -54.95 39.84 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.602 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 tp -65.99 -34.15 77.44 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.84 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.404 ' HG2' ' CE2' ' A' ' 59' ' ' PHE . 0.1 OUTLIER -59.87 -61.19 2.8 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.957 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -59.52 -40.74 88.11 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -44.38 89.15 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.667 0.27 . . . . 0.0 111.373 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -65.68 -39.0 90.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.489 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.483 ' HA ' HD12 ' A' ' 52' ' ' LEU . 17.7 m -79.09 -48.27 14.65 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.358 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -58.69 -37.63 76.48 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.102 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -68.85 -45.05 72.09 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.31 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -66.89 0.58 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.481 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.87 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.038 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 47' ' ' SER . 1.6 mt -120.6 -159.32 0.79 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.7 125.85 48.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.79 0.329 . . . . 0.0 110.91 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.5 -21.27 64.07 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.44 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -90.73 17.98 7.0 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.562 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.49 77.9 0.62 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 121.289 0.566 . . . . 0.0 110.438 178.531 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.562 HD13 ' O ' ' A' ' 56' ' ' GLN . 13.5 mm -148.17 158.67 7.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.721 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.471 ' N ' HG22 ' A' ' 57' ' ' ILE . 17.7 ttt85 -150.19 142.42 24.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.054 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.564 ' CD1' HD12 ' A' ' 83' ' ' ILE . 4.9 m-85 -117.82 130.77 56.48 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.419 179.518 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.1 mmm-85 -116.59 102.31 9.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.784 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -90.44 105.1 17.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.726 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 45.18 43.37 7.78 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.914 0.486 . . . . 0.0 111.906 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLY . . . . . 0.448 ' O ' ' HD3' ' A' ' 65' ' ' PRO . . . 82.86 2.17 90.64 Favored Glycine 0 CA--C 1.526 0.724 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.318 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -99.47 104.55 27.9 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 117.21 0.505 . . . . 0.0 110.842 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 63' ' ' GLY . 52.9 Cg_exo -56.02 121.72 10.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.999 2.466 . . . . 0.0 112.366 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.638 HD12 HD11 ' A' ' 39' ' ' LEU . 24.6 pt -131.67 150.32 33.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.603 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.59 165.86 11.34 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.264 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -57.85 -26.1 61.61 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.412 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.87 -14.48 53.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.784 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.568 ' CB ' HD12 ' A' ' 39' ' ' LEU . 5.8 t70 -53.32 150.63 6.12 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.033 0.444 . . . . 0.0 111.655 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.697 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -163.35 -56.27 0.01 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.151 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.52 -52.34 9.23 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 122.46 2.107 . . . . 0.0 112.71 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.99 79.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.992 0.425 . . . . 0.0 110.509 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -69.33 -21.62 63.83 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.432 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.435 HD13 ' HD2' ' A' ' 35' ' ' ARG . 1.1 mm? -78.07 -36.95 47.63 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.072 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -70.02 -36.38 75.04 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 8.1 mmt -106.76 97.02 6.86 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.328 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.628 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -139.96 67.91 1.37 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.408 -179.462 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -173.29 -64.07 0.02 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.977 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -135.2 83.22 2.01 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.477 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.899 ' HB3' HD12 ' A' ' 19' ' ' LEU . 11.8 t70 -127.07 135.17 50.41 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.878 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 30.2 p -115.98 144.32 44.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.405 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.564 HD12 ' CD1' ' A' ' 59' ' ' PHE . 2.4 pt -141.05 165.13 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.604 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -115.57 104.65 11.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.748 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 85' ' ' VAL . 13.3 p -80.17 115.5 22.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.168 0.509 . . . . 0.0 111.418 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -109.14 154.2 22.66 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.066 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -142.56 157.17 44.99 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -67.18 -33.31 75.12 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.956 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -102.66 179.98 4.14 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.934 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.9 p -115.6 37.59 3.54 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.162 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 126.74 -151.04 18.03 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.555 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.664 179.884 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.3 m-20 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 120.816 0.341 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -139.02 176.41 8.71 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.148 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.482 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 47.2 m80 -142.88 160.57 40.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.729 0.3 . . . . 0.0 111.21 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.73 HG12 HG23 ' A' ' 33' ' ' ILE . 6.8 pt -108.14 122.06 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 121.1 0.476 . . . . 0.0 110.98 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -80.33 102.04 9.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.339 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mp -103.57 138.17 40.62 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.873 0.368 . . . . 0.0 111.571 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -96.61 100.04 11.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.237 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.483 HG22 HD11 ' A' ' 83' ' ' ILE . 22.4 t -83.39 93.8 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.59 125.23 39.11 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.286 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.77 161.2 17.77 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.593 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -92.32 43.11 1.12 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.944 0.402 . . . . 0.0 110.852 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.92 34.38 0.21 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.4 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.12 56.68 7.65 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.713 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 p -140.83 98.28 3.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.723 0.297 . . . . 0.0 111.185 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.8 m -115.07 92.65 2.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.944 0.402 . . . . 0.0 110.928 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.84 145.69 28.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.321 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -118.2 116.9 27.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -114.72 170.6 8.2 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.482 ' HG2' ' HB2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -110.41 151.99 26.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.73 HG23 HG12 ' A' ' 17' ' ' ILE . 6.2 tp -158.64 149.0 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.247 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.7 144.84 26.34 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.794 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ptp85 -81.92 57.67 3.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.97 0.414 . . . . 0.0 111.021 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.95 23.73 0.66 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.461 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.516 HG22 ' HD2' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -162.17 148.93 11.02 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 120.512 0.196 . . . . 0.0 110.764 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.516 ' HD2' HG22 ' A' ' 37' ' ' THR . 50.7 Cg_exo -54.08 161.18 5.28 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.886 2.39 . . . . 0.0 112.59 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.686 HD12 ' HB3' ' A' ' 70' ' ' ASP . 11.0 mt -61.28 -17.22 52.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.875 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.05 -37.58 54.12 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.478 0.18 . . . . 0.0 111.082 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -43.01 88.02 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.893 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.8 -47.42 46.62 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.6 tmm? -59.65 -44.51 93.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.252 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -59.5 -49.71 76.71 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.746 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.33 -34.6 78.34 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.491 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -72.5 -53.32 12.4 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.503 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -60.21 -43.72 95.72 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.147 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.27 -42.88 99.38 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.706 0.289 . . . . 0.0 110.827 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.437 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -78.48 -71.99 0.4 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.672 0.273 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.24 45.58 0.02 OUTLIER Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.118 -0.563 . . . . 0.0 112.151 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.4 mt -127.24 -164.94 1.41 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.695 0.283 . . . . 0.0 110.516 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -143.72 176.45 9.23 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.979 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -93.59 28.13 2.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.266 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -118.31 -3.67 10.98 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.564 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -160.48 77.92 0.63 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.192 0.52 . . . . 0.0 110.206 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.564 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.6 mm -144.98 157.86 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.921 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.436 ' N ' HG22 ' A' ' 57' ' ' ILE . 5.6 tpt180 -141.2 121.98 14.38 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -111.8 127.47 55.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -127.49 103.31 7.28 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.423 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.855 ' HA ' HG22 ' A' ' 83' ' ' ILE . 61.3 t80 -81.12 101.38 9.59 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.01 35.04 24.85 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.099 -179.19 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 103.71 -38.14 3.39 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 121.004 -0.617 . . . . 0.0 113.132 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.03 110.61 3.41 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.671 0.235 . . . . 0.0 111.202 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.17 129.5 16.21 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.086 2.524 . . . . 0.0 112.787 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 pp -145.79 163.07 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.494 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -103.86 177.32 4.88 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.854 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -64.73 -17.79 64.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.584 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.3 p -88.81 33.39 0.78 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.686 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -83.46 177.46 8.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.658 0.266 . . . . 0.0 111.312 179.77 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.409 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -169.89 -54.25 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.962 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.409 ' HD2' ' H ' ' A' ' 71' ' ' THR . 82.9 Cg_exo -47.63 -57.28 2.42 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 122.409 2.073 . . . . 0.0 112.802 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.95 -41.87 97.13 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.78 0.324 . . . . 0.0 110.692 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.4 ' HB2' ' HG ' ' A' ' 39' ' ' LEU . 20.3 tm0? -57.27 -41.42 79.7 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.9 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.3 -32.44 38.05 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.733 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -29.3 60.65 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.923 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.16 173.92 2.25 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.966 0.412 . . . . 0.0 111.283 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.488 ' O ' HG22 ' A' ' 17' ' ' ILE . 14.5 pt-20 -135.2 -49.54 0.74 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.412 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -169.41 -41.72 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.246 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -108.35 106.87 17.21 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.717 0.294 . . . . 0.0 111.02 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -152.94 161.9 41.98 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.199 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.7 t -140.43 156.8 46.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.323 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.855 HG22 ' HA ' ' A' ' 61' ' ' PHE . 0.8 OUTLIER -143.72 157.99 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.158 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -115.81 92.88 4.04 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.517 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.535 HG13 HD12 ' A' ' 83' ' ' ILE . 34.3 m -83.95 111.3 19.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 111.592 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -99.24 156.4 16.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.103 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -132.04 148.43 52.5 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.145 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -95.67 173.56 7.42 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.91 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.96 38.42 3.94 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.476 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.63 94.08 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.432 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -100.92 -154.46 26.85 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.048 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.195 0 CA-C-O 118.671 -1.072 . . . . 0.0 113.119 -179.933 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 120.685 0.278 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -151.04 145.18 25.34 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.927 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -124.47 116.8 23.1 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.569 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.593 HG22 ' HA ' ' A' ' 79' ' ' ASP . 8.1 pt -86.48 117.0 30.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 111.136 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -90.02 92.56 9.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.309 0.576 . . . . 0.0 111.211 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.24 126.71 38.49 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.417 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -84.18 128.45 34.57 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.808 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.553 HG22 HD11 ' A' ' 83' ' ' ILE . 21.8 t -109.94 114.38 46.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.796 0.332 . . . . 0.0 111.334 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -103.0 120.81 41.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.985 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.33 144.7 26.01 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.691 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 86' ' ' PHE . 5.2 pm0 -54.98 -33.07 62.19 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -70.0 -25.84 63.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.87 -5.53 6.49 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 121.098 -0.573 . . . . 0.0 113.059 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.1 p -66.85 154.24 41.42 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.536 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -141.13 108.53 2.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.23 146.13 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.168 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -104.32 148.66 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.215 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -148.66 151.08 34.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.083 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 1.6 ptmm? -136.0 134.72 38.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.089 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.744 HG12 HD12 ' A' ' 42' ' ' LEU . 4.7 pt -145.35 178.11 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.365 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.03 139.7 32.34 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.62 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.39 54.74 2.68 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.853 0.359 . . . . 0.0 111.109 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -158.97 32.87 0.21 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -151.92 157.19 34.39 Favored Pre-proline 0 N--CA 1.466 0.358 0 CA-C-O 120.632 0.253 . . . . 0.0 111.142 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.575 ' HA ' HG23 ' A' ' 71' ' ' THR . 32.1 Cg_exo -58.32 163.98 9.46 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.932 2.421 . . . . 0.0 112.775 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.754 HD12 ' HB3' ' A' ' 70' ' ' ASP . 7.8 mt -62.46 -23.32 66.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.699 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -52.93 -32.1 43.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.831 -0.168 . . . . 0.0 111.335 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -53.23 60.26 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.652 0.263 . . . . 0.0 110.867 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.744 HD12 HG12 ' A' ' 33' ' ' ILE . 0.7 OUTLIER -75.18 -35.76 61.52 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.897 179.478 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.585 ' HE1' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -62.51 -52.0 65.2 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.365 -179.873 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -60.31 -52.84 63.56 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.76 -34.52 62.68 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.248 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -71.49 -54.59 10.09 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.022 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.86 -37.07 75.69 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.107 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -49.73 34.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.238 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.577 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -65.29 -69.76 0.27 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.344 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.08 45.66 0.07 OUTLIER Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.048 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 mt -114.41 -157.89 0.65 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.2 m -126.05 156.04 40.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.846 0.355 . . . . 0.0 111.063 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.57 28.78 2.18 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.174 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -129.31 3.27 5.15 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.712 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -157.68 77.52 0.83 Allowed 'General case' 0 CA--C 1.521 -0.153 0 CA-C-O 121.068 0.461 . . . . 0.0 109.903 179.414 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.712 HD13 ' O ' ' A' ' 56' ' ' GLN . 7.4 mm -145.3 154.95 13.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.772 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.85 143.83 33.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.715 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.617 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.5 OUTLIER -118.2 129.69 55.65 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.414 179.492 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 21.3 mtt-85 -124.07 100.12 6.57 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.243 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.491 ' HA ' HG22 ' A' ' 83' ' ' ILE . 37.4 t80 -89.82 109.38 20.38 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.699 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 t70 56.9 37.15 28.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.134 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.25 25.55 59.16 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.923 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.53 125.02 26.97 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.875 0.337 . . . . 0.0 110.851 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.0 127.27 14.93 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.885 2.39 . . . . 0.0 112.738 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.545 HD12 HD13 ' A' ' 39' ' ' LEU . 3.7 pt -146.49 161.55 9.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.379 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -107.9 174.14 6.01 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.977 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.93 1.14 32.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.655 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.2 p -92.38 0.87 57.48 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.754 ' HB3' HD12 ' A' ' 39' ' ' LEU . 3.8 t0 -64.69 173.64 2.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.812 0.339 . . . . 0.0 111.328 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.575 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -167.75 -56.53 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.357 -179.661 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -49.46 -44.37 35.04 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.438 2.092 . . . . 0.0 112.808 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.456 ' HB3' ' OD2' ' A' ' 70' ' ' ASP . . . -71.57 -41.54 68.9 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.707 0.289 . . . . 0.0 110.799 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -38.05 89.64 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -78.72 -33.4 46.76 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.719 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -68.79 -21.3 64.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.243 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.0 mtt -61.85 177.52 0.43 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.983 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -116.09 -63.5 1.44 Allowed 'General case' 0 C--O 1.233 0.203 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.593 ' HA ' HG22 ' A' ' 17' ' ' ILE . 15.1 t0 -170.86 -54.44 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.167 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -86.81 108.6 18.8 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.173 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -151.56 164.28 37.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.208 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 6.2 t -144.14 149.53 36.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.927 0.394 . . . . 0.0 111.5 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.617 HD13 ' CE2' ' A' ' 59' ' ' PHE . 1.0 OUTLIER -140.0 175.07 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.629 -179.416 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.52 102.63 6.95 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.415 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.421 HG13 ' O ' ' A' ' 85' ' ' VAL . 14.8 p -79.97 121.64 33.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 111.184 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.402 ' HA ' ' OE1' ' A' ' 24' ' ' GLN . 3.7 m-85 -115.37 143.13 45.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.797 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -136.51 129.92 31.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.746 0.308 . . . . 0.0 111.242 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.36 172.02 3.85 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.124 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.3 -52.54 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.914 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.1 p -84.57 65.56 9.07 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.776 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 128.15 133.35 3.7 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 121.074 -0.584 . . . . 0.0 112.44 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.969 0 CA-C-O 118.351 -1.249 . . . . 0.0 112.729 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 120.747 0.308 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.45 179.2 5.94 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.036 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.412 ' HB3' ' HB2' ' A' ' 32' ' ' LYS . 7.4 m80 -149.99 148.19 28.77 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.12 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.617 HG13 HD13 ' A' ' 19' ' ' LEU . 14.9 pt -98.75 123.89 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 111.061 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -83.76 102.02 12.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.617 HD13 HG13 ' A' ' 17' ' ' ILE . 8.0 mp -109.78 130.04 55.56 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.12 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -96.66 93.56 6.81 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.514 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.428 HG22 HD13 ' A' ' 83' ' ' ILE . 17.5 t -82.78 122.37 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.127 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.81 118.22 36.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.7 138.15 14.45 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.605 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -56.69 -43.56 80.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.559 0.218 . . . . 0.0 111.332 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.68 -28.02 66.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.526 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.66 54.18 0.22 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.275 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.6 p -134.89 103.81 5.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.9 95.89 4.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.05 137.16 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.197 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -94.19 87.26 5.2 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -91.37 142.24 27.9 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HB2' ' HB3' ' A' ' 16' ' ' HIS . 1.5 pttt -114.64 138.72 50.33 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.214 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.854 HG12 HD12 ' A' ' 42' ' ' LEU . 1.7 pp -144.32 -179.74 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.471 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.585 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.98 148.65 26.78 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.256 -179.885 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.95 28.44 1.57 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.799 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -126.31 29.4 5.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.695 0.283 . . . . 0.0 111.015 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.65 151.71 29.06 Favored Pre-proline 0 N--CA 1.463 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.63 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.51 ' HA ' HG23 ' A' ' 71' ' ' THR . 41.3 Cg_endo -67.71 156.8 64.57 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.559 2.173 . . . . 0.0 112.242 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.551 HD12 ' OD2' ' A' ' 70' ' ' ASP . 8.2 mt -57.91 -22.46 48.62 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.155 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' MET . 41.8 t -49.76 -36.16 24.92 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.725 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -46.55 61.95 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.538 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.854 HD12 HG12 ' A' ' 33' ' ' ILE . 6.9 tt -62.6 -52.64 62.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.696 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.426 ' HG3' ' O ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -58.59 -35.43 72.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.076 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.86 6.76 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.008 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -43.04 95.22 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.586 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.429 ' HE2' HG11 ' A' ' 85' ' ' VAL . 78.7 t80 -60.15 -48.34 82.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.338 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.3 m -74.41 -34.81 63.37 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.234 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.03 -50.15 51.28 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.108 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -56.09 -36.45 68.15 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.011 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.81 -55.48 8.44 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.466 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.5 -18.43 0.89 Allowed Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.492 -179.304 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.476 ' HB3' HD11 ' A' ' 57' ' ' ILE . 4.5 mm? -62.41 -178.73 0.2 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.945 0.402 . . . . 0.0 110.894 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -107.12 173.77 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.285 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.3 ptt? -104.35 26.35 9.03 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.419 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.62 13.38 2.74 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.458 ' O ' HD13 ' A' ' 57' ' ' ILE . 2.9 tt0 -160.66 77.88 0.61 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.221 0.534 . . . . 0.0 110.225 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 58' ' ' ARG . 9.9 mm -149.12 160.88 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.418 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.485 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -156.77 139.6 15.21 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.612 0.244 . . . . 0.0 111.469 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.421 ' CE2' ' HB ' ' A' ' 85' ' ' VAL . 15.1 m-85 -117.47 160.83 20.57 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.776 0.322 . . . . 0.0 111.378 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -137.35 127.19 25.61 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.138 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.44 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 24.4 t80 -106.16 91.76 3.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.457 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 58.18 37.04 26.25 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.261 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 89.32 23.04 35.55 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.021 -0.609 . . . . 0.0 113.02 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 0.0 OUTLIER -114.81 103.95 54.49 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.756 0.278 . . . . 0.0 110.484 179.802 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.7 93.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.807 2.338 . . . . 0.0 112.138 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.7 pt -103.01 135.71 39.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.097 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -79.93 157.73 26.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.829 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.33 51.7 0.72 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.821 0.343 . . . . 0.0 110.978 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.1 t -166.56 25.36 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.717 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.551 ' OD2' HD12 ' A' ' 39' ' ' LEU . 3.2 p30 -77.03 -175.16 3.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.635 0.255 . . . . 0.0 110.922 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.51 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -167.82 -58.05 0.01 OUTLIER Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.271 -179.627 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -45.7 -50.74 9.1 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.591 2.194 . . . . 0.0 113.065 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.62 -49.46 66.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.7 -29.31 69.26 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.261 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -33.71 47.42 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.749 0.309 . . . . 0.0 110.414 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.53 -50.26 74.43 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.74 148.25 26.46 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.537 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.616 ' CG ' HG22 ' A' ' 17' ' ' ILE . 3.8 tt0 -164.81 61.29 0.13 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.036 -179.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -179.27 -60.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.45 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -142.22 96.74 3.0 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.753 0.311 . . . . 0.0 110.859 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.459 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 9.8 t70 -127.71 114.32 17.17 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.736 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.29 131.37 36.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.882 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.428 HD13 HG22 ' A' ' 21' ' ' VAL . 0.3 OUTLIER -129.91 166.73 26.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.1 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.525 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 2.6 m-20 -133.84 105.87 7.01 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.663 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 85' ' ' VAL . 9.8 p -92.83 112.99 27.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.143 0.497 . . . . 0.0 111.324 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.525 ' CE1' ' HB3' ' A' ' 84' ' ' ASP . 92.6 m-85 -105.37 166.53 10.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.774 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -167.29 156.16 10.0 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.192 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 63.07 93.85 0.05 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.233 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -127.97 -176.9 3.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.916 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.8 26.77 15.77 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.733 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.1 78.03 0.21 Allowed Glycine 0 C--N 1.337 0.624 0 C-N-CA 121.192 -0.528 . . . . 0.0 113.049 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.45 -1.194 . . . . 0.0 112.688 179.742 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 120.582 0.23 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -157.02 86.39 0.97 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.382 -179.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.455 ' CG ' ' HG2' ' A' ' 32' ' ' LYS . 1.3 m-70 -161.56 119.83 2.35 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.714 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.755 HG12 HG23 ' A' ' 33' ' ' ILE . 13.1 pt -80.96 130.06 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 111.063 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -81.5 116.72 21.42 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.041 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.422 HD21 ' CG1' ' A' ' 83' ' ' ILE . 7.9 tt -131.52 135.95 47.48 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.091 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.778 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.9 OUTLIER -104.25 106.04 16.4 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.293 179.49 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 23.4 t -82.42 124.44 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.14 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.657 ' O ' HG12 ' A' ' 85' ' ' VAL . . . -104.83 177.67 4.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.13 148.95 20.87 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.787 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLN . . . . . 0.41 ' HG3' ' CE2' ' A' ' 86' ' ' PHE . 1.4 tt0 -52.37 -38.51 58.99 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 111.433 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.45 33.27 2.51 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.588 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.77 83.72 0.2 Allowed Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.785 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.59 68.18 1.31 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.726 0.298 . . . . 0.0 111.493 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.6 t -84.54 107.8 16.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.988 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -124.56 148.98 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.433 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -93.07 110.88 22.37 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.844 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -112.75 165.66 12.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.455 ' HG2' ' CG ' ' A' ' 16' ' ' HIS . 6.9 tttt -130.36 143.62 50.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.01 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.755 HG23 HG12 ' A' ' 17' ' ' ILE . 3.7 tt -154.91 148.44 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.08 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -77.77 176.56 8.93 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.044 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -112.07 49.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.895 0.378 . . . . 0.0 111.453 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -157.59 33.24 0.27 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.237 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.03 143.88 10.56 Favored Pre-proline 0 N--CA 1.466 0.344 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.981 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.33 164.29 7.12 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.809 2.339 . . . . 0.0 112.65 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.656 HD12 ' CB ' ' A' ' 70' ' ' ASP . 12.6 mt -60.24 -14.78 19.61 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 p -51.98 -33.14 36.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.467 0.175 . . . . 0.0 111.16 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -57.06 -58.63 7.36 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.671 0.272 . . . . 0.0 110.543 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 tp -61.76 -38.11 86.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.72 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.53 -55.13 32.37 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.988 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -61.41 -43.92 98.04 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.234 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.31 -42.0 94.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.565 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.636 ' CE1' HG11 ' A' ' 85' ' ' VAL . 51.3 t80 -78.13 -42.53 31.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.448 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.5 p -65.47 -43.01 91.61 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.473 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.58 -34.89 62.98 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.902 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.42 -57.09 12.64 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.579 0.228 . . . . 0.0 111.464 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -82.86 -47.8 11.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.226 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.33 57.09 0.63 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.718 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.48 HD12 ' OE1' ' A' ' 87' ' ' GLN . 3.5 mm? -91.15 -78.92 0.38 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.607 0.241 . . . . 0.0 110.4 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -172.06 157.97 4.5 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.698 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -37.34 7.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.692 0.282 . . . . 0.0 110.523 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -101.57 27.29 6.47 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.62 77.83 0.61 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.084 0.468 . . . . 0.0 110.518 179.076 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.464 HG22 ' N ' ' A' ' 58' ' ' ARG . 10.8 mm -152.59 157.58 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.466 179.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.464 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -159.02 123.31 3.98 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.166 179.318 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -93.63 151.9 19.36 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.767 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.03 127.09 35.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.246 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -103.44 91.87 4.24 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.326 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.5 39.56 30.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.127 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.83 21.12 29.28 Favored Glycine 0 CA--C 1.522 0.518 0 C-N-CA 121.07 -0.586 . . . . 0.0 113.032 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -118.46 94.8 47.9 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 116.855 0.327 . . . . 0.0 110.436 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -52.96 105.88 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.972 2.448 . . . . 0.0 112.47 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.7 pt -113.03 160.29 12.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.325 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -103.68 164.4 11.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.096 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -68.13 -15.06 63.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.39 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 14.9 p -91.29 30.49 1.26 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.656 ' CB ' HD12 ' A' ' 39' ' ' LEU . 3.0 t70 -75.08 155.97 36.58 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 111.35 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.419 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.2 OUTLIER -160.68 -55.27 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.422 179.903 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.419 ' HD2' ' H ' ' A' ' 71' ' ' THR . 54.8 Cg_exo -52.41 -53.75 6.36 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.356 2.037 . . . . 0.0 112.759 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.84 -37.42 86.75 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.868 0.366 . . . . 0.0 110.493 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.05 -20.11 65.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.452 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -81.58 -35.19 30.47 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.92 -40.2 91.22 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.976 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.16 122.9 47.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.579 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.553 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -146.83 31.29 0.95 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.523 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -148.62 -51.29 0.16 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.28 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.13 99.45 4.13 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.652 0.263 . . . . 0.0 110.905 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -140.33 133.14 29.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.778 HG22 ' HB2' ' A' ' 20' ' ' LYS . 24.7 p -125.47 136.48 53.42 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.545 -179.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.422 ' CG1' HD21 ' A' ' 19' ' ' LEU . 0.6 OUTLIER -138.2 161.6 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.35 179.802 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.411 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 8.0 t0 -125.63 118.72 26.27 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.636 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.657 HG12 ' O ' ' A' ' 22' ' ' ALA . 13.6 p -82.7 121.34 35.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.232 0.539 . . . . 0.0 111.148 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.418 ' HB2' ' CD ' ' A' ' 58' ' ' ARG . 9.4 m-85 -107.46 164.35 12.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.78 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLN . . . . . 0.48 ' OE1' HD12 ' A' ' 52' ' ' LEU . 19.2 mt-30 -129.11 126.25 38.93 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.239 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.86 178.87 0.2 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.45 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -138.85 99.89 3.91 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.15 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 23.6 m -63.99 -38.0 89.46 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.926 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -167.08 -50.94 0.03 OUTLIER Glycine 0 C--N 1.333 0.387 0 C-N-CA 121.172 -0.537 . . . . 0.0 112.307 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.14 0 CA-C-O 118.654 -1.081 . . . . 0.0 112.758 -179.81 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.3 m120 . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.47 148.96 25.3 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.453 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -147.21 175.18 10.94 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.26 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.3 pt -104.77 128.66 58.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -82.21 119.68 24.39 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.235 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 42' ' ' LEU . 1.4 mt -123.86 116.95 23.77 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.75 0.309 . . . . 0.0 111.362 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -96.54 93.33 6.72 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.483 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.569 HG22 HD13 ' A' ' 83' ' ' ILE . 21.9 t -94.96 122.42 46.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.003 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -93.68 123.45 37.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.268 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.431 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -83.8 148.55 24.81 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.831 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.95 -37.83 72.1 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.49 0.186 . . . . 0.0 111.238 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.21 -28.37 67.93 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.469 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.6 31.96 2.63 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.205 -0.521 . . . . 0.0 112.592 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.0 m -110.86 144.86 39.24 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.756 0.312 . . . . 0.0 110.852 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.46 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.8 p -112.02 117.13 54.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.178 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.15 133.03 69.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.934 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -117.82 106.55 13.13 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.007 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -97.86 155.56 17.0 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.4 mtmm -131.95 113.09 13.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.992 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.656 HD13 ' HB2' ' A' ' 42' ' ' LEU . 45.4 pt -129.29 178.54 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.412 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -80.66 147.37 30.69 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.941 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -89.02 54.72 3.09 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.232 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.6 m170 -159.84 35.27 0.18 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.094 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.5 145.15 16.64 Favored Pre-proline 0 N--CA 1.465 0.308 0 CA-C-N 116.704 -0.225 . . . . 0.0 110.962 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.666 ' HA ' HG23 ' A' ' 71' ' ' THR . 47.8 Cg_exo -56.12 158.69 14.09 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.902 2.402 . . . . 0.0 112.801 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.661 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.6 mt -57.62 -23.74 52.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.805 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 t -47.77 -35.02 9.27 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.99 0.181 . . . . 0.0 111.342 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmt -60.08 -57.63 12.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.958 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 19' ' ' LEU . 5.4 tt -71.11 -36.83 72.31 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.128 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.536 ' CE ' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -58.37 -49.79 75.99 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.239 -179.855 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -62.6 -48.47 79.29 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.601 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.06 92.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.485 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.63 ' CE1' HG11 ' A' ' 85' ' ' VAL . 21.5 t80 -69.87 -45.62 67.29 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.02 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 t -68.35 -47.53 67.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.444 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -59.66 -40.66 88.46 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.99 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -66.65 -39.42 88.21 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.057 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -66.1 0.65 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.293 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.63 46.06 0.1 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.292 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 15.0 mt -119.78 -154.64 0.58 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . 0.408 ' O ' HD11 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -127.49 166.0 18.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.795 0.331 . . . . 0.0 111.077 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -95.88 25.98 4.37 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.263 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 56' ' ' GLN . 20.2 mtt180 -134.75 9.8 3.63 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.673 ' O ' HD13 ' A' ' 57' ' ' ILE . 4.3 mp0 -157.96 77.63 0.82 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.109 0.481 . . . . 0.0 109.738 178.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.673 HD13 ' O ' ' A' ' 56' ' ' GLN . 8.4 mm -144.66 155.22 14.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.814 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -144.79 116.77 8.3 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.167 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.55 101.64 13.13 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.128 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -85.19 143.24 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.072 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.423 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 54.0 t80 -137.21 86.25 2.19 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.656 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.67 37.61 20.53 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.001 0.429 . . . . 0.0 111.115 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.48 36.19 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.143 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 1.7 mm100 -115.94 98.47 51.18 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.996 0.398 . . . . 0.0 110.84 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -68.51 107.3 1.59 Allowed 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.685 2.257 . . . . 0.0 112.265 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.9 pt -122.84 144.82 30.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.503 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -86.95 178.21 7.02 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.165 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.51 36.48 0.31 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.881 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.2 p -136.71 17.38 3.08 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.661 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.1 t70 -67.25 162.88 21.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.006 0.431 . . . . 0.0 111.785 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.666 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -163.13 -54.95 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.551 179.836 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.429 ' HD2' ' H ' ' A' ' 71' ' ' THR . 76.4 Cg_exo -50.45 -52.22 9.43 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.441 2.094 . . . . 0.0 113.247 -179.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.19 96.75 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.802 0.334 . . . . 0.0 110.956 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.93 -33.96 71.18 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.23 -34.56 59.22 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.593 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.85 -36.35 72.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 4.8 mmt -70.09 179.25 2.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.242 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -132.03 -58.14 0.96 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.484 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -145.82 -66.91 0.3 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.373 0.13 . . . . 0.0 111.317 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.0 119.85 20.52 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.94 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -146.72 143.26 28.58 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.274 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 132.07 55.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.579 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -138.11 167.79 21.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.919 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.464 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 2.7 m-20 -142.47 110.47 5.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.256 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.63 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.9 p -92.45 113.86 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.022 0.439 . . . . 0.0 111.11 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.464 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 22.6 m-85 -130.8 170.48 14.33 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.883 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -85.89 151.51 23.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.898 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -74.14 0.08 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.255 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -116.85 -33.37 4.8 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.252 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.7 t 42.86 82.29 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.238 0.615 . . . . 0.0 111.755 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.82 42.32 0.62 Allowed Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.633 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.477 -1.179 . . . . 0.0 112.514 -179.983 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m120 . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 120.57 0.224 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 59.19 59.83 2.58 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.525 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.434 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 29.3 m80 -155.42 107.68 2.67 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.609 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.676 HG12 HG23 ' A' ' 33' ' ' ILE . 6.8 pt -79.76 128.07 38.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.724 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -84.05 119.09 24.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.195 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.478 HD11 ' HG2' ' A' ' 77' ' ' MET . 0.4 OUTLIER -122.28 137.26 54.91 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.859 0.362 . . . . 0.0 111.498 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.0 OUTLIER -101.73 97.26 7.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.365 179.472 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.586 HG22 HD11 ' A' ' 83' ' ' ILE . 21.5 t -85.51 118.46 32.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.262 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.49 113.58 27.02 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.0 156.12 39.56 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.569 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -92.72 29.76 1.7 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -133.38 26.05 4.13 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.257 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.98 61.74 4.71 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.604 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -162.21 114.15 1.67 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.797 0.332 . . . . 0.0 111.409 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.16 130.19 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 t -147.36 153.38 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.43 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -119.87 137.05 54.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.702 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -122.96 154.09 38.86 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.434 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -104.83 113.14 26.54 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.738 179.837 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.676 HG23 HG12 ' A' ' 17' ' ' ILE . 8.9 tp -124.49 153.81 31.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.346 -179.556 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.91 153.54 18.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.872 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.78 58.1 3.76 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.371 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.415 ' O ' HG23 ' A' ' 37' ' ' THR . 0.3 OUTLIER -164.62 32.63 0.07 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.534 179.64 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 36' ' ' HIS . 6.1 p -157.62 153.22 22.46 Favored Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.885 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.57 155.09 22.46 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.735 2.29 . . . . 0.0 112.622 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.634 HD13 HD12 ' A' ' 66' ' ' ILE . 0.6 OUTLIER -61.4 -20.02 62.57 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.979 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.84 -34.22 26.94 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.519 0.199 . . . . 0.0 110.957 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.1 mmmt -54.19 -42.95 70.29 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.908 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.57 -45.54 30.01 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.746 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.1 ttp -57.08 -36.8 71.0 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.053 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HD3' ' HB2' ' A' ' 54' ' ' MET . 27.9 mmtm -77.97 -54.0 6.79 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.051 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.59 -32.34 62.98 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.476 ' CE1' HG11 ' A' ' 85' ' ' VAL . 56.4 t80 -79.47 -52.69 7.71 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.485 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.9 p -66.31 -37.02 84.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.299 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.08 -47.27 68.73 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.062 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 mtt180 -59.87 -49.09 79.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.376 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -64.39 -69.15 0.3 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.28 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.2 38.24 0.13 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.943 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.617 HD22 ' N ' ' A' ' 52' ' ' LEU . 0.7 OUTLIER -107.99 -153.54 0.51 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.743 0.272 . . . . 0.0 110.563 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.9 p -95.96 119.68 34.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.932 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' MET . . . . . 0.401 ' HB2' ' HD3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -72.86 -4.69 33.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.802 179.557 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -120.01 23.45 11.01 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.502 0.191 . . . . 0.0 111.216 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.468 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.76 77.78 0.6 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.199 0.523 . . . . 0.0 110.452 179.173 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 58' ' ' ARG . 15.4 mm -150.86 160.11 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.149 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.485 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -152.14 150.65 30.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.447 179.752 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.484 ' CD1' HD12 ' A' ' 83' ' ' ILE . 64.8 m-85 -116.37 161.06 19.62 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.76 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -139.59 114.79 9.71 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.438 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -108.46 101.42 10.6 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.306 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 53.18 46.95 25.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.076 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 74.33 19.88 79.74 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.001 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.21 86.65 33.17 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.83 0.315 . . . . 0.0 110.84 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.38 150.96 31.64 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.037 2.491 . . . . 0.0 112.667 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.634 HD12 HD13 ' A' ' 39' ' ' LEU . 14.5 pt -141.01 171.57 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.634 -179.584 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -119.19 171.13 8.5 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -30.82 63.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.887 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 42.4 p -78.92 8.22 5.91 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.575 ' HB3' HD12 ' A' ' 39' ' ' LEU . 1.1 m-20 -65.47 175.89 1.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.869 0.366 . . . . 0.0 111.457 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.82 -55.74 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.522 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -46.91 -51.99 8.39 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.346 2.031 . . . . 0.0 112.919 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.9 91.48 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.828 0.347 . . . . 0.0 110.64 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.505 ' NE2' HD11 ' A' ' 17' ' ' ILE . 15.9 tp60 -58.71 -34.5 71.38 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.192 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 tt -79.48 -33.24 42.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -62.76 -26.11 68.54 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.237 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.482 ' HB3' HD12 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -58.34 160.23 5.42 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 111.492 -179.929 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.619 ' O ' HG22 ' A' ' 17' ' ' ILE . 1.5 tt0 -125.02 -76.98 0.59 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.879 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.57 26.62 0.23 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -174.86 102.87 0.09 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.524 0.202 . . . . 0.0 111.259 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 3.7 m-20 -146.9 130.4 16.79 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.875 0.369 . . . . 0.0 111.54 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.436 HG22 ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -102.92 144.33 31.36 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.367 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.586 HD11 HG22 ' A' ' 21' ' ' VAL . 3.3 pt -150.35 168.07 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.575 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -127.1 106.92 9.59 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.295 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.476 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.8 p -83.06 119.13 31.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.052 0.453 . . . . 0.0 111.242 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -102.67 125.41 49.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.36 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -137.09 97.92 3.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.175 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 60.85 98.08 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.473 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -157.58 -54.47 0.07 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.098 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.46 94.44 2.51 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.641 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -145.72 -149.24 4.96 Favored Glycine 0 C--N 1.334 0.421 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.759 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.497 179.921 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 120.62 0.248 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -93.41 73.84 4.49 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.56 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.4 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 73.3 m80 -150.23 130.44 13.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.931 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.72 HG12 HG23 ' A' ' 33' ' ' ILE . 6.6 pt -86.63 127.14 40.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.709 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -81.35 94.37 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.299 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -93.01 132.14 37.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.205 -179.93 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -113.56 104.75 12.56 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.492 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.875 HG22 HD11 ' A' ' 83' ' ' ILE . 36.5 t -87.92 128.6 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.184 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -127.24 147.12 50.22 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.19 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -108.78 158.71 14.52 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.58 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -63.74 -45.6 89.14 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.594 0.235 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.96 -28.2 67.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.303 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.9 50.63 0.16 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.366 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -98.7 151.76 20.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.702 0.287 . . . . 0.0 111.118 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 28' ' ' VAL . 8.3 p -152.05 111.62 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.358 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.54 HG21 ' CE1' ' A' ' 46' ' ' TYR . 14.7 m -137.25 156.87 34.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.402 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -127.35 128.56 46.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -137.65 151.5 48.34 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -104.23 125.2 50.31 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.72 HG23 HG12 ' A' ' 17' ' ' ILE . 8.9 tp -136.62 153.1 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.187 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.02 148.24 22.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.755 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.74 53.99 2.55 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.006 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -150.58 29.32 0.69 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.323 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.6 153.06 25.67 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.972 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.32 162.02 42.27 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.639 2.226 . . . . 0.0 112.287 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.605 HD12 ' HB3' ' A' ' 70' ' ' ASP . 8.3 mt -63.31 -19.54 64.69 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.94 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -48.71 -36.13 15.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.565 0.221 . . . . 0.0 111.23 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.18 -62.24 2.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.124 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.425 ' CD2' HD22 ' A' ' 19' ' ' LEU . 12.6 tp -62.82 -33.86 76.1 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.883 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.414 ' HG2' ' CD1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -55.68 -61.97 2.0 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.685 179.548 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -59.5 -37.54 78.55 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.137 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.508 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.634 ' HE2' HG21 ' A' ' 85' ' ' VAL . 66.9 t80 -73.47 -45.54 53.5 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.439 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.7 m -61.78 -50.01 74.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.409 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.51 72.12 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.997 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.16 68.5 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.892 179.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.11 -52.11 15.46 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.084 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.73 -11.85 3.69 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.71 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.7 mt -74.71 -166.0 0.41 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.751 0.276 . . . . 0.0 110.631 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.18 169.17 9.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.092 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.5 29.62 3.21 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.113 179.396 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.22 3.05 5.18 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.512 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.48 77.99 0.63 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.082 0.468 . . . . 0.0 110.275 179.318 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.512 HD13 ' O ' ' A' ' 56' ' ' GLN . 9.9 mm -141.97 157.78 20.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.996 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.417 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -136.63 133.48 36.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.933 0.397 . . . . 0.0 111.454 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.414 ' CD1' ' HG2' ' A' ' 43' ' ' MET . 2.4 m-85 -123.63 109.84 14.25 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.054 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -109.45 139.71 44.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.757 0.313 . . . . 0.0 111.4 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.508 ' HA ' HG22 ' A' ' 83' ' ' ILE . 43.9 t80 -114.41 102.24 9.9 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.109 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 52.18 35.12 15.87 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.077 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.71 24.93 19.35 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.022 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.3 104.67 54.58 Favored Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.878 0.339 . . . . 0.0 110.962 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.84 109.04 2.23 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.754 2.302 . . . . 0.0 112.848 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.8 pt -131.71 150.17 33.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.139 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -89.63 174.85 7.52 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.984 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' A' ' 40' ' ' SER . 2.0 pt-20 -73.58 51.73 0.37 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.341 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.8 p -151.7 19.33 0.71 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.491 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.605 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.8 OUTLIER -68.75 173.02 5.59 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.84 0.352 . . . . 0.0 111.805 -179.572 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.11 -56.85 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.606 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.13 -51.68 9.01 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 122.548 2.165 . . . . 0.0 113.044 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.55 91.34 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.931 0.396 . . . . 0.0 110.593 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -61.5 -38.73 88.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.012 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.18 -34.84 37.18 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.695 0.283 . . . . 0.0 110.642 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -59.2 -29.72 67.69 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.926 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.434 ' HG2' ' HB2' ' A' ' 81' ' ' ASP . 0.3 OUTLIER -66.77 -177.81 0.65 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.405 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.46 -53.91 0.25 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.275 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -146.12 -53.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -87.82 128.33 35.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.842 0.354 . . . . 0.0 110.868 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.434 ' HB2' ' HG2' ' A' ' 77' ' ' MET . 42.4 t0 -149.78 126.3 10.9 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.907 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.5 p -125.6 131.58 52.68 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.14 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.875 HD11 HG22 ' A' ' 21' ' ' VAL . 0.9 OUTLIER -136.52 164.18 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.725 179.805 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -126.2 106.36 9.49 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.332 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.634 HG21 ' HE2' ' A' ' 46' ' ' TYR . 33.1 m -84.83 118.48 31.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.027 0.442 . . . . 0.0 111.181 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.29 173.58 6.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.513 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -133.49 165.34 25.11 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.058 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.78 130.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.175 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.52 -68.24 0.94 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.194 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.5 m 60.65 97.43 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.779 0.323 . . . . 0.0 111.116 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -75.29 -137.73 0.59 Allowed Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.825 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.475 -1.181 . . . . 0.0 112.443 -179.712 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 120.74 0.305 . . . . 0.0 111.629 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -70.0 149.86 47.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.175 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -133.46 139.25 46.59 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.563 HG22 ' HA ' ' A' ' 79' ' ' ASP . 18.8 pt -80.54 126.9 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 121.048 0.451 . . . . 0.0 111.539 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -87.57 105.27 17.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.021 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.404 ' HG ' ' HB3' ' A' ' 81' ' ' ASP . 1.5 mp -111.62 124.94 53.36 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.03 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.451 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.3 OUTLIER -96.79 102.43 14.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.45 179.649 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.674 HG22 HD11 ' A' ' 83' ' ' ILE . 13.4 t -82.4 123.16 38.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.42 102.95 9.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.098 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.76 153.67 31.55 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.468 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -59.91 -33.6 72.07 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -61.29 -31.65 71.49 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.443 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.15 83.4 0.97 Allowed Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.548 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.7 t -157.93 152.06 24.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.674 0.273 . . . . 0.0 111.247 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.3 t -141.28 93.11 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -112.19 137.15 46.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.067 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -99.65 87.29 3.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.949 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.32 132.64 35.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.018 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 13.8 mtmm -111.97 96.51 6.09 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.479 HD11 HD11 ' A' ' 17' ' ' ILE . 3.1 pt -107.0 179.02 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.223 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.62 149.39 22.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.823 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -85.93 51.49 2.22 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.856 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -154.96 34.13 0.39 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.906 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.17 153.31 29.36 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.785 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.543 ' HA ' HG23 ' A' ' 71' ' ' THR . 57.7 Cg_endo -70.7 163.84 37.59 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.63 2.22 . . . . 0.0 112.405 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.654 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.6 mt -59.58 -24.68 63.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.52 -33.73 46.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.638 0.256 . . . . 0.0 111.287 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -57.62 7.38 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.276 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.415 HD12 HG12 ' A' ' 33' ' ' ILE . 9.6 tt -63.64 -43.57 96.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.116 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.665 ' SD ' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -58.2 -50.18 74.46 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.415 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.62 -53.25 58.68 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.69 65.87 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.722 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -79.63 -53.67 6.61 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.045 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.0 t -58.83 -36.35 74.4 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.12 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -72.93 -41.99 63.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.421 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -43.01 93.5 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.498 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -71.83 -76.27 0.11 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.267 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 152.18 39.86 0.03 OUTLIER Glycine 0 C--N 1.334 0.451 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.158 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.554 HD22 ' N ' ' A' ' 52' ' ' LEU . 2.9 mm? -96.78 -166.78 1.45 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.256 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.64 159.34 23.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.949 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.93 25.81 3.95 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.358 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 -139.61 14.7 2.53 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.458 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.662 ' O ' HD13 ' A' ' 57' ' ' ILE . 2.5 pt20 -160.8 77.66 0.59 Allowed 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.269 0.557 . . . . 0.0 110.076 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.665 HG21 ' SD ' ' A' ' 43' ' ' MET . 9.4 mm -145.47 157.2 13.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.795 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.413 ' N ' HG22 ' A' ' 57' ' ' ILE . 54.6 ttt180 -157.37 130.23 7.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.82 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.427 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -103.43 148.5 25.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.576 179.468 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -145.43 127.15 15.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.194 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -100.14 98.74 9.41 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.246 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.72 37.7 28.99 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.081 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.47 24.95 31.98 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.114 -0.565 . . . . 0.0 113.069 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -117.03 108.79 43.6 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.98 0.39 . . . . 0.0 110.659 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -52.1 115.8 2.39 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.044 2.496 . . . . 0.0 112.679 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.427 HG13 ' HB3' ' A' ' 59' ' ' PHE . 10.6 pt -139.16 148.0 24.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.267 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -94.9 170.45 9.42 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.734 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.412 ' HB3' ' HG3' ' A' ' 43' ' ' MET . 0.3 OUTLIER -83.11 23.77 0.84 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.539 179.225 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 p -116.46 11.76 14.97 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 122.457 -0.152 . . . . 0.0 111.111 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.654 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.7 t70 -65.79 168.64 7.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.898 0.38 . . . . 0.0 111.188 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.543 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -168.39 -55.22 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.341 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.92 -48.05 21.04 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.53 2.153 . . . . 0.0 112.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.87 89.07 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.627 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.25 -33.38 69.32 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.905 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.33 -32.49 49.2 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.725 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -58.66 -39.78 81.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.734 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.26 175.85 2.5 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.201 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.481 ' O ' HG22 ' A' ' 17' ' ' ILE . 4.2 pt-20 -123.47 -52.44 1.82 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.573 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASP . . . . . 0.563 ' HA ' HG22 ' A' ' 17' ' ' ILE . 11.2 m-20 -159.73 -57.13 0.06 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.875 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.07 117.06 16.49 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.145 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.404 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 27.4 t70 -158.92 153.15 23.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.451 HG22 ' HB2' ' A' ' 20' ' ' LYS . 32.6 p -137.7 145.65 42.81 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.399 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.674 HD11 HG22 ' A' ' 21' ' ' VAL . 1.0 OUTLIER -145.25 154.37 13.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.528 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -118.42 121.19 39.73 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.078 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.486 ' O ' HG13 ' A' ' 85' ' ' VAL . 13.8 p -94.12 111.56 25.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 121.19 0.519 . . . . 0.0 110.849 178.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -95.88 146.26 24.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.112 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -125.06 107.78 11.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.038 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.77 163.77 16.38 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.074 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -140.07 -70.42 0.39 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.021 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 19.1 m -149.85 102.34 3.13 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.768 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -84.05 111.2 3.42 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.509 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.535 -1.147 . . . . 0.0 112.485 179.961 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASN . . . . . 0.601 ' N ' HD21 ' A' ' 14' ' ' ASN . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 120.83 0.348 . . . . 0.0 111.255 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -109.9 129.0 55.7 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.977 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -167.29 123.9 1.16 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.324 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.696 HG22 ' O ' ' A' ' 78' ' ' GLU . 22.6 pt -80.65 129.64 37.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -98.81 104.65 16.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.399 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.75 139.3 35.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.466 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.606 ' HB2' HG23 ' A' ' 82' ' ' THR . 0.0 OUTLIER -111.3 105.46 14.12 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.354 179.549 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.674 HG13 ' CD1' ' A' ' 83' ' ' ILE . 22.0 t -90.32 129.7 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.307 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -115.98 113.7 23.61 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.372 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.432 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -79.86 146.18 28.02 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.01 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -56.15 -51.83 66.57 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.503 0.192 . . . . 0.0 111.428 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -63.42 -23.72 67.53 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.407 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.13 88.94 1.03 Allowed Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.579 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.4 p -153.76 127.38 8.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.705 0.288 . . . . 0.0 111.252 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.86 97.11 5.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.874 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.43 135.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.24 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -110.09 115.86 30.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.082 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -104.75 165.04 11.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.113 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.9 mtpp -135.23 111.59 9.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.47 ' O ' HG12 ' A' ' 17' ' ' ILE . 27.1 pt -129.14 173.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.371 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 158.99 19.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.809 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ARG . . . . . 0.453 ' HD3' ' HA ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -90.76 52.56 2.21 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.831 0.348 . . . . 0.0 111.265 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -160.59 35.48 0.16 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -155.88 148.26 17.68 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 120.485 0.183 . . . . 0.0 111.142 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 35.6 Cg_exo -62.08 165.03 15.41 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.977 2.451 . . . . 0.0 112.878 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.51 HD12 ' CB ' ' A' ' 70' ' ' ASP . 8.8 mt -62.77 -17.87 61.74 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.885 179.728 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.9 p -50.94 -34.59 29.29 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -54.44 45.51 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.47 -41.12 89.5 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.346 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.616 ' HE3' ' HB3' ' A' ' 68' ' ' GLU . 7.4 mmm -59.3 -53.72 55.0 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.521 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -55.12 -54.0 48.78 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.095 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.3 81.28 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.409 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.437 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 71.6 t80 -69.6 -37.15 76.77 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.414 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -76.94 -34.36 57.64 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.668 0.271 . . . . 0.0 111.03 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -78.16 -37.14 46.58 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.389 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -60.17 -36.31 77.3 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.773 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.93 -70.62 0.62 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.396 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.33 46.27 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.944 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -112.02 -160.03 0.7 Allowed 'General case' 0 C--O 1.233 0.227 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 t -130.47 163.33 27.22 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.9 0.381 . . . . 0.0 111.191 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.6 ttp -93.11 26.75 2.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.289 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -135.49 14.36 3.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.474 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.508 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -160.85 77.93 0.59 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.267 0.556 . . . . 0.0 110.541 179.049 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.548 HG21 ' SD ' ' A' ' 43' ' ' MET . 8.3 mm -148.46 158.78 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.747 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.455 ' N ' HG22 ' A' ' 57' ' ' ILE . 6.3 tpt180 -142.28 134.24 27.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.155 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.45 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -121.83 124.97 45.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.302 179.411 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -124.4 120.82 33.19 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.055 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -100.55 95.29 6.61 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.455 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.49 41.65 32.07 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.119 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.46 25.66 32.56 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.969 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -114.98 94.5 38.54 Favored Pre-proline 0 C--O 1.232 0.177 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -56.16 93.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.901 2.401 . . . . 0.0 112.458 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 27.1 pt -114.34 166.11 8.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.191 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -110.14 175.23 5.51 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.777 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.616 ' HB3' ' HE3' ' A' ' 43' ' ' MET . 1.4 pm0 -65.48 -14.9 62.0 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.654 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 80.5 p -91.08 29.39 1.4 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.51 ' CB ' HD12 ' A' ' 39' ' ' LEU . 3.0 t70 -73.59 167.48 21.26 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 120.407 0.146 . . . . 0.0 111.114 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.492 ' N ' ' HD2' ' A' ' 72' ' ' PRO . 17.2 m -169.0 -58.59 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 71' ' ' THR . 5.3 Cg_endo -47.24 -51.22 9.82 Favored 'Trans proline' 0 C--N 1.358 1.04 0 C-N-CA 122.943 2.428 . . . . 0.0 112.773 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.404 ' HB3' ' OD2' ' A' ' 70' ' ' ASP . . . -60.22 -41.16 92.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.053 0.454 . . . . 0.0 110.261 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.7 tt0 -67.94 -33.14 74.11 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.092 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -75.68 -38.94 58.27 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 110.426 179.779 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.74 -40.66 88.81 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.059 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 30.9 mmt -70.61 176.35 4.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.322 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.696 ' O ' HG22 ' A' ' 17' ' ' ILE . 1.4 pm0 -129.71 -47.17 1.15 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.481 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -149.16 -64.54 0.23 Allowed 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 120.523 0.201 . . . . 0.0 111.219 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.62 106.73 2.28 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.006 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -145.76 117.28 8.04 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.832 0.349 . . . . 0.0 111.111 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.606 HG23 ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -115.22 146.26 41.61 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.467 -179.426 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.674 ' CD1' HG13 ' A' ' 21' ' ' VAL . 2.2 pp -146.88 161.33 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.586 179.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -115.76 100.01 7.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.738 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 85' ' ' VAL . 14.3 p -79.85 113.59 19.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.164 0.506 . . . . 0.0 110.874 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -104.71 125.59 50.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.112 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -84.92 121.5 27.84 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.812 0.339 . . . . 0.0 111.177 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.9 tp60 -83.39 112.49 19.98 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.713 179.693 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.2 141.2 58.74 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.096 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.4 m -123.76 103.48 8.4 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.762 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -162.99 -53.78 0.02 OUTLIER Glycine 0 CA--C 1.519 0.29 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.497 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.303 -1.276 . . . . 0.0 112.403 179.882 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 120.633 0.254 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -125.65 149.15 48.68 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.968 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' HIS . . . . . 0.404 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 5.7 m170 -160.93 143.55 12.69 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.672 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.698 HG12 HG23 ' A' ' 33' ' ' ILE . 8.5 pt -92.45 129.6 42.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-O 121.152 0.501 . . . . 0.0 111.174 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.3 m-80 -82.36 119.6 24.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.286 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.753 HD23 HD11 ' A' ' 83' ' ' ILE . 0.5 OUTLIER -129.93 124.74 33.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.079 179.668 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -107.93 108.87 20.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.261 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.9 t -81.07 113.1 19.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.036 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.404 ' O ' ' HA ' ' A' ' 84' ' ' ASP . . . -101.4 105.26 16.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.051 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.47 146.27 27.24 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.384 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -24.52 47.73 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.73 40.71 1.05 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.738 0.304 . . . . 0.0 111.455 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.29 39.04 89.62 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.061 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 t -102.05 114.56 28.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.778 0.289 . . . . 0.0 110.97 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.33 98.95 6.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.983 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -126.79 134.6 65.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -84.39 149.48 25.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -154.31 132.91 12.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.016 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.404 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -94.69 149.65 21.02 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.744 179.794 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.698 HG23 HG12 ' A' ' 17' ' ' ILE . 7.8 tp -157.12 148.52 10.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.563 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.4 pttt -76.96 165.77 24.23 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.947 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -101.23 48.88 0.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.126 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.05 32.83 0.34 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.198 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.45 149.25 22.33 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.94 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.16 170.31 17.36 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.786 2.324 . . . . 0.0 112.722 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.833 HD12 ' HB2' ' A' ' 70' ' ' ASP . 6.2 mt -58.14 -22.34 50.7 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.544 179.542 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 t -49.9 -39.2 39.06 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.638 0.256 . . . . 0.0 110.758 178.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -46.46 87.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.173 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 tp -70.66 -47.52 59.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.732 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -43.7 86.73 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.122 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -60.68 -50.76 72.19 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.949 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.65 -45.72 74.48 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.69 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.479 ' CE2' HG11 ' A' ' 85' ' ' VAL . 81.7 t80 -61.97 -45.41 93.77 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.248 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -69.53 -37.79 77.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -72.74 -37.63 67.66 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.164 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -63.77 -33.8 76.47 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.506 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -81.34 -75.13 0.3 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.612 0.244 . . . . 0.0 111.312 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.49 45.8 0.02 OUTLIER Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.9 mt -114.27 -160.31 0.73 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.713 0.292 . . . . 0.0 110.254 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.9 -179.49 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.905 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 mtm -100.04 30.61 3.67 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.093 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.46 0.26 8.24 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.543 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.32 77.75 0.63 Allowed 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 121.251 0.548 . . . . 0.0 110.242 179.266 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.543 HD13 ' O ' ' A' ' 56' ' ' GLN . 8.1 mm -144.28 156.7 15.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.668 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.407 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.2 tpt180 -158.65 126.84 5.22 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.972 179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.63 144.14 42.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.283 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.468 ' O ' HG22 ' A' ' 83' ' ' ILE . 4.7 mtt180 -131.66 135.98 47.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.109 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -123.85 113.63 18.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.532 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 t0 56.25 37.05 28.47 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.66 22.67 63.84 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 121.043 -0.599 . . . . 0.0 113.11 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -119.21 127.41 26.5 Favored Pre-proline 0 C--O 1.231 0.128 0 CA-C-N 116.775 0.287 . . . . 0.0 110.871 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.25 110.07 2.56 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.759 2.306 . . . . 0.0 112.34 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.511 HD12 ' CD1' ' A' ' 39' ' ' LEU . 31.4 pt -116.61 176.61 2.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.132 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -133.28 179.41 6.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.155 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.87 40.08 0.45 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.474 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -141.14 16.59 2.26 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.149 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.833 ' HB2' HD12 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -72.94 168.8 18.23 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 120.762 0.315 . . . . 0.0 111.453 -179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.38 -57.34 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.421 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -47.76 -51.42 9.82 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.433 2.089 . . . . 0.0 113.095 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.39 98.78 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.835 0.35 . . . . 0.0 110.73 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -29.34 69.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.267 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.98 -31.8 39.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 110.709 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.85 -40.49 95.54 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.28 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.49 149.27 25.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.94 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.81 51.34 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.844 0.354 . . . . 0.0 111.647 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -170.79 -54.4 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.131 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -142.07 95.03 2.74 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -127.98 135.14 49.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.146 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -117.23 133.45 55.98 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.73 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.753 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -123.96 165.01 21.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.859 -179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.476 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -129.43 104.04 7.26 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.767 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.479 HG11 ' CE2' ' A' ' 46' ' ' TYR . 14.6 p -86.46 117.48 31.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.132 0.492 . . . . 0.0 111.136 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' PHE . . . . . 0.476 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 79.6 m-85 -108.43 150.88 26.8 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.454 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -119.66 166.08 13.66 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.021 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 67.49 179.25 0.23 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.299 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -86.24 -62.51 1.5 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.976 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 45.7 p 44.97 78.03 0.07 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.399 0.437 . . . . 0.0 111.713 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -96.76 36.78 3.71 Favored Glycine 0 CA--C 1.522 0.469 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.857 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.369 -1.24 . . . . 0.0 112.832 179.514 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 54.9 t30 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 120.52 0.2 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.42 119.17 28.61 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.941 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.99 124.1 16.43 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.904 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 32' ' ' LYS . 14.4 pt -80.23 126.51 39.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-O 120.958 0.409 . . . . 0.0 111.221 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -92.62 93.45 8.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.513 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.04 122.1 40.76 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.806 0.336 . . . . 0.0 111.006 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 103.56 13.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.577 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.441 HG11 ' CD1' ' A' ' 46' ' ' TYR . 17.2 t -88.69 110.52 21.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.205 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -116.36 111.81 20.61 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.9 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.0 149.63 22.33 Favored Glycine 0 C--N 1.333 0.393 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.545 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.08 -31.97 61.59 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -64.18 -28.2 69.59 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.411 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 114.12 48.3 0.57 Allowed Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.617 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -125.69 113.27 17.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.594 0.235 . . . . 0.0 110.998 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 m -112.29 125.71 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.228 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.51 168.2 23.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -122.61 95.66 4.72 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.04 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -92.85 137.5 32.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.01 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 35.3 mtpt -126.85 111.87 14.68 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.994 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.4 178.88 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.416 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 155.36 35.08 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.06 30.16 2.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.424 179.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -136.29 35.23 2.76 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.709 0.29 . . . . 0.0 110.808 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.6 t -145.93 138.22 13.59 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.743 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.41 156.51 8.17 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.694 2.263 . . . . 0.0 112.572 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.864 HD12 ' HB2' ' A' ' 70' ' ' ASP . 12.7 mt -54.03 -22.51 10.79 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.944 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 t -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.572 0.225 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.15 -53.66 55.6 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.655 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.9 tt -67.08 -41.37 86.5 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.791 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.421 ' HG2' ' HB3' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -56.0 -58.12 9.25 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.133 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -56.64 -42.2 78.5 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.83 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.58 -35.25 77.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.32 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.441 ' CD1' HG11 ' A' ' 21' ' ' VAL . 83.1 t80 -77.14 -52.14 9.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.601 -179.761 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 p -60.93 -39.22 88.62 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.573 0.225 . . . . 0.0 111.195 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.16 -40.96 77.86 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.035 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -72.67 -40.67 66.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -73.66 -66.47 0.7 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.389 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.28 46.73 0.05 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.081 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -123.08 -159.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.86 163.65 21.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.913 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 5.8 mtm -97.97 27.81 4.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -132.59 8.45 4.22 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.507 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.5 77.97 0.62 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-O 121.228 0.537 . . . . 0.0 110.233 179.084 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.507 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.7 mm -143.69 158.16 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.586 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 57' ' ' ILE . 4.1 tpt180 -142.12 123.38 14.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.145 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.666 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -107.13 136.04 47.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.655 179.494 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.4 mtm-85 -135.42 140.3 44.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.367 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.456 ' CD2' HG23 ' A' ' 83' ' ' ILE . 1.8 t80 -120.23 101.63 7.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.273 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.45 34.76 24.83 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.22 -179.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 102.26 -27.94 18.13 Favored Glycine 0 CA--C 1.522 0.485 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.983 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -68.51 113.44 15.61 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.906 0.353 . . . . 0.0 111.007 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -75.13 118.9 5.39 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.592 2.195 . . . . 0.0 112.366 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.601 HD12 ' CD1' ' A' ' 39' ' ' LEU . 25.3 pt -124.32 174.39 8.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.316 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -112.76 178.12 4.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.282 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HB3' ' HG2' ' A' ' 43' ' ' MET . 0.5 OUTLIER -84.24 16.69 2.86 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.673 179.567 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.15 15.72 7.27 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.575 0.226 . . . . 0.0 111.098 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.864 ' HB2' HD12 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -72.8 118.29 15.55 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.753 0.311 . . . . 0.0 110.832 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.468 ' HB ' ' HD3' ' A' ' 72' ' ' PRO . 0.7 OUTLIER -112.0 -50.46 0.05 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.063 -179.737 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.468 ' HD3' ' HB ' ' A' ' 71' ' ' THR . 74.3 Cg_exo -50.38 -58.45 1.68 Allowed 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 122.216 1.944 . . . . 0.0 112.513 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.1 -37.95 89.14 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.9 0.381 . . . . 0.0 110.038 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.6 tm0? -54.39 -45.24 72.83 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.547 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tt -76.32 -31.93 58.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.58 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.28 -27.97 57.11 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.11 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 29.9 mmt -60.13 168.55 1.89 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.723 0.297 . . . . 0.0 110.92 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.19 -62.01 1.31 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.138 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -156.41 -60.96 0.1 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.453 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.85 111.71 22.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.995 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -140.14 146.71 39.17 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.239 -179.526 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.78 137.92 51.85 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.283 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.666 HD13 ' CE2' ' A' ' 59' ' ' PHE . 0.4 OUTLIER -152.33 158.71 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -131.17 120.02 22.71 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.649 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.4 p -85.68 120.95 36.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 121.048 0.451 . . . . 0.0 111.083 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -108.14 158.37 17.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.217 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.5 169.45 8.45 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.058 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -96.27 33.1 1.82 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.29 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.7 tp60 -135.52 76.87 1.64 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.657 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.3 m -134.05 -62.65 0.75 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.007 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.62 -104.83 2.56 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.748 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.335 -1.258 . . . . 0.0 112.514 -179.743 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.832 0.348 . . . . 0.0 110.962 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -122.19 90.67 3.35 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.967 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m80 -146.76 158.97 44.04 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.154 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.553 HD11 HG13 ' A' ' 33' ' ' ILE . 12.8 pt -100.92 124.78 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.773 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -90.69 111.1 22.31 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.113 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.453 HD22 HG13 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -109.65 125.38 52.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.465 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.735 ' HB2' HG22 ' A' ' 82' ' ' THR . 8.3 mttp -95.91 104.68 16.63 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.366 179.438 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.628 ' HA ' HD12 ' A' ' 83' ' ' ILE . 12.6 t -89.31 120.11 37.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.158 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -118.08 92.14 3.75 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.03 166.03 49.7 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -84.75 48.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.73 0.3 . . . . 0.0 111.19 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -148.58 32.5 0.79 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.071 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.98 30.58 66.86 Favored Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.541 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.25 135.47 54.02 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.702 0.287 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 28' ' ' VAL . 15.6 m -144.23 103.71 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.194 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.3 t -125.13 141.52 44.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.185 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.85 102.75 12.56 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.99 0.424 . . . . 0.0 110.954 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.15 143.27 31.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.787 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -119.95 136.18 54.62 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.844 0.354 . . . . 0.0 111.27 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.553 HG13 HD11 ' A' ' 17' ' ' ILE . 2.3 pt -135.12 179.55 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.022 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.7 159.46 26.65 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.69 43.59 1.1 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 110.932 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -151.3 35.46 0.58 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -148.44 141.91 15.82 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.752 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' HG23 ' A' ' 71' ' ' THR . 37.1 Cg_endo -65.19 173.59 5.96 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.728 2.285 . . . . 0.0 112.525 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.683 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.2 mt -56.1 -24.18 38.7 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.382 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.4 t -50.4 -40.52 50.2 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.342 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -58.72 -58.6 7.86 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.022 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 42' ' ' LEU . 1.3 tm? -59.44 -42.93 93.08 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.818 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' MET . . . . . 0.469 ' HG2' ' CE1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -60.59 -54.7 42.28 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.141 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -60.7 -50.52 73.17 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.007 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.94 81.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.382 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.444 ' CZ ' HG11 ' A' ' 21' ' ' VAL . 67.7 t80 -69.61 -53.17 20.08 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -44.58 92.21 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.135 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.99 -45.59 92.22 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.851 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.77 78.55 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.126 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -74.9 -75.81 0.16 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.224 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.77 46.63 0.02 OUTLIER Glycine 0 C--N 1.334 0.45 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.196 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 mt -124.9 -163.26 1.16 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.625 0.25 . . . . 0.0 110.416 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.5 m -115.96 170.97 8.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.032 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ptm -102.38 22.89 12.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.432 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.67 15.72 2.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.568 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -160.62 78.03 0.62 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.168 179.174 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.568 HD13 ' O ' ' A' ' 56' ' ' GLN . 14.6 mm -146.44 157.98 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.604 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.447 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.7 tpt180 -142.93 109.0 5.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.328 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.469 ' CE1' ' HG2' ' A' ' 43' ' ' MET . 9.3 m-85 -105.23 151.17 24.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.342 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 56.2 mtt180 -146.21 136.87 24.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.882 0.372 . . . . 0.0 111.294 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' PHE . . . . . 0.586 ' HA ' HG22 ' A' ' 83' ' ' ILE . 67.0 t80 -96.58 94.81 7.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.155 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.03 35.78 20.38 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 112.9 -30.21 7.58 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.946 -0.645 . . . . 0.0 113.253 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -75.56 112.98 22.04 Favored Pre-proline 0 CA--C 1.533 0.312 0 CA-C-N 116.859 0.33 . . . . 0.0 111.431 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -59.96 137.62 77.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.914 2.409 . . . . 0.0 112.988 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.469 HD12 ' CD1' ' A' ' 39' ' ' LEU . 17.8 pt -147.56 158.68 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.996 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -137.44 176.18 8.94 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.302 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.85 81.35 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.316 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.0 t -177.66 -28.09 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.018 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.683 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.6 t70 -51.89 167.15 0.12 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.933 0.397 . . . . 0.0 111.733 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.471 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -162.17 -55.99 0.01 OUTLIER Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.263 179.844 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . 0.471 ' HD2' ' H ' ' A' ' 71' ' ' THR . 93.6 Cg_exo -45.19 -48.29 11.47 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.385 2.057 . . . . 0.0 112.806 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.36 87.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.056 0.455 . . . . 0.0 110.063 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' GLN . . . . . 0.664 ' HG2' ' HE3' ' A' ' 77' ' ' MET . 13.9 tm0? -58.25 -34.61 70.65 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.819 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -32.4 61.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.472 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -43.62 84.45 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.836 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' MET . . . . . 0.664 ' HE3' ' HG2' ' A' ' 74' ' ' GLN . 3.8 ptt? -74.77 150.8 39.25 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.843 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.68 -43.9 0.48 Allowed 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.94 -67.74 0.93 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -179.565 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -94.46 127.59 40.47 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.869 0.366 . . . . 0.0 111.312 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -157.76 143.86 17.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.591 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' THR . . . . . 0.735 HG22 ' HB2' ' A' ' 20' ' ' LYS . 57.8 p -137.36 149.06 46.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.915 0.388 . . . . 0.0 111.477 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' A' ' 21' ' ' VAL . 1.1 pp -154.6 152.76 9.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.619 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -109.79 133.11 53.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.127 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.515 ' O ' HG13 ' A' ' 85' ' ' VAL . 8.4 p -107.95 103.6 15.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.273 0.559 . . . . 0.0 111.239 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -103.38 169.07 8.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.653 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -137.19 139.77 41.32 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.162 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.3 168.4 12.72 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.117 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -161.53 160.73 29.42 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.026 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.86 78.65 1.14 Allowed 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.455 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -85.02 133.07 11.5 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.751 -179.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.377 -1.235 . . . . 0.0 112.48 179.999 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -127.53 74.99 1.56 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.877 0.37 . . . . 0.0 110.94 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -144.77 152.02 39.73 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.653 HG22 ' O ' ' A' ' 78' ' ' GLU . 18.2 pt -98.86 124.32 52.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.119 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASN . . . . . 0.451 ' C ' HD22 ' A' ' 19' ' ' LEU . 29.5 m-20 -84.41 122.4 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.056 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.492 HD12 HD11 ' A' ' 83' ' ' ILE . 4.3 mm? -119.56 117.28 27.94 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.258 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 95.27 10.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.325 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' VAL . . . . . 0.649 HG22 HD12 ' A' ' 83' ' ' ILE . 21.3 t -83.88 122.1 37.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.3 -179.538 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.68 119.29 37.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.227 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . 0.403 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -83.6 136.38 14.91 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.752 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.23 -35.81 81.58 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -58.4 -32.68 68.86 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.292 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.89 45.67 0.2 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 121.193 -0.527 . . . . 0.0 112.389 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.52 160.8 38.66 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.662 0.268 . . . . 0.0 110.969 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.0 t -142.03 101.57 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' VAL . . . . . 0.401 ' HB ' ' CE1' ' A' ' 46' ' ' TYR . 21.4 t -105.59 147.17 11.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.075 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -114.86 122.77 47.34 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.221 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -129.99 146.36 51.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.92 144.42 51.0 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.37 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.8 pt -145.11 178.96 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.367 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.49 148.25 26.06 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.629 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.8 56.65 4.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.884 0.373 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -165.05 35.41 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.95 146.85 16.38 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-O 120.629 0.252 . . . . 0.0 111.307 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.4 161.63 7.09 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.051 2.5 . . . . 0.0 113.102 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.576 ' CD1' HD12 ' A' ' 66' ' ' ILE . 10.5 mt -59.74 -22.31 61.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.739 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.08 -31.36 18.68 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.245 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -61.63 2.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.902 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tt -66.78 -45.26 79.01 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.5 mmm -53.86 -41.55 67.62 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.328 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -66.09 -57.9 6.67 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.949 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 49' ' ' ARG . . . -59.55 -34.24 72.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.927 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.401 ' CE1' ' HB ' ' A' ' 29' ' ' VAL . 35.0 t80 -60.34 -60.81 3.22 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.231 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.52 -28.3 69.86 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.271 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.43 -56.6 4.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -57.13 -41.32 78.83 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.467 -179.636 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.16 -72.41 0.25 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.137 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.06 41.81 0.09 OUTLIER Glycine 0 C--N 1.335 0.492 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.779 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LEU . . . . . 0.609 HD22 ' N ' ' A' ' 52' ' ' LEU . 1.4 mm? -103.74 -152.5 0.45 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 110.559 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.83 122.44 47.67 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.747 0.308 . . . . 0.0 110.929 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.2 tpt -63.34 -26.43 68.76 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.487 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.3 25.9 7.75 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLN . . . . . 0.591 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.7 78.04 0.61 Allowed 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.126 0.488 . . . . 0.0 110.467 179.125 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.591 HD13 ' O ' ' A' ' 56' ' ' GLN . 20.2 mm -146.88 159.14 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.847 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ARG . . . . . 0.484 ' N ' HG22 ' A' ' 57' ' ' ILE . 1.9 ttm-85 -141.0 135.34 31.04 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.732 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PHE . . . . . 0.425 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -120.96 143.03 49.22 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -135.04 119.33 17.78 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.378 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -107.15 103.52 12.94 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.268 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.74 38.2 29.34 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.91 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.94 28.52 49.97 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.159 -0.543 . . . . 0.0 112.966 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -124.72 107.1 29.11 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-N 116.849 0.324 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.06 129.34 32.82 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.082 2.521 . . . . 0.0 112.855 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ILE . . . . . 0.576 HD12 ' CD1' ' A' ' 39' ' ' LEU . 11.0 pt -146.95 145.83 19.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.467 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -99.31 173.72 6.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.712 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.78 47.9 0.44 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.672 0.273 . . . . 0.0 111.608 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.5 p -148.35 18.01 1.06 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.572 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . 0.53 ' CB ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -74.41 176.7 6.53 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -179.826 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.23 -56.7 0.01 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.365 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -48.37 -48.63 16.46 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.562 2.175 . . . . 0.0 112.887 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.15 -42.14 76.36 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.759 0.314 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.73 -37.99 74.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.684 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.69 -31.99 57.61 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.518 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.48 -30.93 67.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.831 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.5 mtt -62.47 170.78 2.24 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.407 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 0.653 ' O ' HG22 ' A' ' 17' ' ' ILE . 25.5 tt0 -137.92 -52.97 0.63 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.425 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -156.61 -61.71 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -96.82 120.47 37.21 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.755 0.312 . . . . 0.0 111.172 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 159.28 43.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.266 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -122.91 151.1 42.1 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.458 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.649 HD12 HG22 ' A' ' 21' ' ' VAL . 1.2 mt -144.51 168.07 10.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.923 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ASP . . . . . 0.453 ' H ' HG22 ' A' ' 83' ' ' ILE . 16.4 m-20 -137.86 97.2 3.37 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.677 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' VAL . . . . . 0.503 HG12 HG12 ' A' ' 21' ' ' VAL . 13.4 p -82.08 119.8 32.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.033 0.444 . . . . 0.0 111.138 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -99.34 129.13 45.52 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.983 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -109.46 143.34 39.21 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -132.61 152.66 51.57 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 -115.37 -55.2 2.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.195 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.0 m -101.02 -60.28 1.55 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.129 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 139.16 160.38 8.34 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.793 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.496 -1.169 . . . . 0.0 112.453 -179.894 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.767 0.318 . . . . 0.0 110.818 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -142.22 146.14 34.88 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.465 HD12 HD11 ' A' ' 19' ' ' LEU . 16.5 pt -93.27 125.63 45.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.055 0.455 . . . . 0.0 111.208 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -94.18 89.37 5.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.836 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.465 HD11 HD12 ' A' ' 17' ' ' ILE . 6.8 mp -90.25 123.68 34.24 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.25 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.85 93.18 4.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.261 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.755 HG22 HD13 ' A' ' 83' ' ' ILE . 31.9 t -85.52 125.34 40.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.17 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.73 117.07 33.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.953 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.67 149.75 27.42 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.634 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -19.59 54.15 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.06 31.84 0.96 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.24 41.07 94.69 Favored Glycine 0 C--N 1.338 0.655 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.846 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.2 t -115.67 127.32 55.09 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.607 0.242 . . . . 0.0 111.094 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.3 m -117.09 115.29 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.118 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.2 t -136.95 134.23 48.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.248 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -105.56 154.64 20.1 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.159 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -135.78 146.18 47.33 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -119.02 111.94 18.94 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.144 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.1 pt -145.86 178.87 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.2 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.4 159.98 18.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.729 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.86 31.86 2.54 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.331 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.31 31.6 5.01 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.127 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.18 157.96 42.04 Favored Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.844 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.674 ' HA ' HG23 ' A' ' 71' ' ' THR . 57.8 Cg_endo -70.83 163.27 39.71 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.63 2.22 . . . . 0.0 112.645 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.686 HD12 ' HB3' ' A' ' 70' ' ' ASP . 10.1 mt -66.15 -12.98 59.36 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.832 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 61.8 m -51.29 -33.81 30.39 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.524 0.202 . . . . 0.0 111.26 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -56.43 5.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.559 -0.292 . . . . 0.0 110.958 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.81 -46.61 88.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.094 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -48.7 80.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.77 -54.28 44.56 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.79 -34.71 67.91 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.462 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.466 ' CE1' HG11 ' A' ' 85' ' ' VAL . 39.4 t80 -74.65 -54.85 6.64 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.978 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.448 ' HA ' HD12 ' A' ' 52' ' ' LEU . 42.5 t -59.8 -41.24 90.77 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.295 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -68.51 -37.06 79.72 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.317 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.65 -39.67 44.3 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.521 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -67.11 -64.91 0.76 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.348 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.39 46.96 0.05 OUTLIER Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.063 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 47' ' ' SER . 2.6 mt -122.25 -161.39 0.93 Allowed 'General case' 0 C--O 1.234 0.253 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.406 ' O ' HD11 ' A' ' 57' ' ' ILE . 0.9 OUTLIER -123.59 166.92 14.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.915 179.86 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 68.7 mtp -96.08 24.51 5.54 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.308 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -136.7 12.85 3.18 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.458 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.597 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.5 OUTLIER -160.84 78.12 0.6 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.121 0.486 . . . . 0.0 110.334 179.157 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.597 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.8 mm -141.94 156.86 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.037 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.412 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -156.89 116.28 3.42 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.944 179.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -95.8 123.6 39.44 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.721 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -106.53 117.86 35.15 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.253 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -121.6 101.98 7.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.345 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.9 38.75 29.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 76.84 25.35 64.9 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.102 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -125.51 91.11 49.39 Favored Pre-proline 0 C--O 1.233 0.19 0 CA-C-N 116.859 0.329 . . . . 0.0 110.737 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 115.82 2.63 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.01 2.474 . . . . 0.0 112.32 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.521 HD12 ' CD1' ' A' ' 39' ' ' LEU . 18.1 pt -117.51 140.92 38.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.341 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -90.44 172.73 8.52 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.752 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.79 -20.11 65.88 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.393 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 21.7 p -85.93 28.06 0.83 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.686 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -84.34 168.02 16.0 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.658 0.266 . . . . 0.0 111.149 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.674 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -171.01 -57.85 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.253 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -47.16 -50.28 11.35 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.624 2.216 . . . . 0.0 113.009 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.96 -45.41 85.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.792 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -60.87 -31.73 71.19 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.189 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 tt -75.96 -37.22 58.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.807 0.337 . . . . 0.0 110.347 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.79 -33.87 70.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.03 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 16.1 mtt -64.6 169.56 4.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.396 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -111.71 -54.68 2.59 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.989 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -175.01 -48.46 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.432 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -84.92 93.31 8.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.997 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -141.14 138.25 33.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.903 0.383 . . . . 0.0 111.366 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.87 142.23 39.78 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.22 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.755 HD13 HG22 ' A' ' 21' ' ' VAL . 0.1 OUTLIER -135.34 167.84 24.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.665 179.854 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.438 ' H ' HG22 ' A' ' 83' ' ' ILE . 65.4 m-20 -133.62 108.49 8.6 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.566 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.466 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.0 p -82.15 121.92 36.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.042 0.449 . . . . 0.0 111.203 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -123.14 167.45 13.67 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.319 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 . . . . . 0 CA--C 1.533 0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.733 -179.816 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.233 0.212 0 CA-C-O 120.746 0.308 . . . . 0.0 110.638 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 m80 -135.83 158.79 43.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.049 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.46 HD11 HG13 ' A' ' 33' ' ' ILE . 14.5 pt -96.63 124.63 49.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.272 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -89.17 91.01 8.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.465 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 1.013 HD23 HD11 ' A' ' 83' ' ' ILE . 2.0 mp -107.43 124.23 49.56 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.282 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.878 ' HB2' HG22 ' A' ' 82' ' ' THR . 8.7 mttt -90.6 116.37 28.44 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.687 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.5 t -101.03 112.34 33.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.102 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.84 124.05 44.72 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.183 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.08 139.2 20.27 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.511 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -58.61 -30.64 67.39 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.11 -32.26 67.95 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.56 0.219 . . . . 0.0 111.536 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 125.25 45.03 0.26 Allowed Glycine 0 C--N 1.334 0.422 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.461 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.7 m -140.41 160.67 39.47 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.623 0.249 . . . . 0.0 110.89 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -140.76 114.14 5.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 120.818 0.342 . . . . 0.0 111.158 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 t -113.67 140.59 33.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.259 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -90.15 113.46 25.22 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.902 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.37 160.53 25.22 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 pttm -154.08 148.56 26.17 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.388 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.46 HG13 HD11 ' A' ' 17' ' ' ILE . 24.7 pt -146.91 178.04 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.321 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.43 148.38 25.01 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.419 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -82.95 55.64 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.962 0.41 . . . . 0.0 111.055 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m170 -156.93 31.29 0.3 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.955 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.43 150.78 25.89 Favored Pre-proline 0 N--CA 1.463 0.218 0 CA-C-O 120.625 0.25 . . . . 0.0 111.32 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.04 174.22 10.07 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.082 2.522 . . . . 0.0 112.794 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 66' ' ' ILE . 9.5 mt -61.21 -24.77 66.58 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.7 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 -36.46 64.89 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.527 0.203 . . . . 0.0 110.763 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -46.63 84.78 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.541 179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.434 ' HB2' HD13 ' A' ' 33' ' ' ILE . 3.4 tt -66.48 -51.71 53.86 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.448 ' HG3' ' CE1' ' A' ' 59' ' ' PHE . 5.4 ttp -60.28 -35.97 76.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.624 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -62.89 -58.89 5.83 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.585 0.231 . . . . 0.0 110.777 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.23 88.88 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.597 ' CE2' HG11 ' A' ' 85' ' ' VAL . 77.1 t80 -66.36 -37.43 85.3 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.419 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -80.66 -31.38 36.43 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.0 -55.95 4.75 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.95 -33.19 62.07 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.599 0.238 . . . . 0.0 111.372 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 3.7 tt0 -74.62 -54.82 6.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.274 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.25 -6.26 3.05 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.907 -0.663 . . . . 0.0 113.063 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.5 mt -71.45 -167.72 0.27 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.923 0.392 . . . . 0.0 110.753 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.7 m -116.1 159.53 21.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.56 29.73 2.2 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.49 6.67 4.12 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.582 ' O ' HD13 ' A' ' 57' ' ' ILE . 1.5 tt0 -160.79 77.7 0.59 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 110.427 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.582 HD13 ' O ' ' A' ' 56' ' ' GLN . 5.8 mm -147.21 155.99 10.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.726 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -159.59 154.91 25.36 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.213 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.53 ' HB3' HD11 ' A' ' 66' ' ' ILE . 3.4 m-85 -120.48 155.49 33.46 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.974 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.57 119.42 10.58 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 71.8 t80 -105.6 98.89 8.52 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.239 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 54.95 39.08 31.43 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 111.162 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.17 22.75 43.56 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.102 -0.571 . . . . 0.0 113.161 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 3.3 mt-30 -115.01 92.85 32.54 Favored Pre-proline 0 C--O 1.233 0.196 0 CA-C-N 116.991 0.396 . . . . 0.0 110.659 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.98 113.48 1.35 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.887 2.391 . . . . 0.0 111.99 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.687 HD12 HD11 ' A' ' 39' ' ' LEU . 21.5 pt -116.7 143.93 25.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.953 0.406 . . . . 0.0 111.461 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -92.7 170.35 9.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.076 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.51 -3.19 32.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.688 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 20.9 p -96.21 18.13 14.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.576 ' CB ' HD12 ' A' ' 39' ' ' LEU . 11.2 t0 -72.92 160.09 32.68 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.08 -55.49 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.54 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.25 -50.23 14.58 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 122.394 2.063 . . . . 0.0 112.958 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.82 86.73 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.936 0.398 . . . . 0.0 110.755 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -27.11 68.68 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.4 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.4 -34.37 41.92 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.559 0.218 . . . . 0.0 110.565 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -65.4 -47.89 74.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.878 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.93 114.21 27.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.73 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.455 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -152.73 69.68 0.87 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.869 0.366 . . . . 0.0 111.794 -179.746 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -172.63 -69.38 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.963 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -143.07 92.2 2.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.6 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -139.64 146.4 39.68 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.996 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.878 HG22 ' HB2' ' A' ' 20' ' ' LYS . 71.2 p -119.41 147.67 44.11 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.628 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 1.013 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -133.2 167.06 27.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.813 179.549 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.413 ' H ' HG22 ' A' ' 83' ' ' ILE . 1.8 t0 -116.14 97.74 6.23 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.489 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.597 HG11 ' CE2' ' A' ' 46' ' ' TYR . 11.0 p -81.38 114.28 22.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 121.269 0.557 . . . . 0.0 111.504 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -98.8 131.44 44.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.667 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 . . . . . 0 CA--C 1.534 0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 179.636 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 t70 . . . . . 0 C--O 1.233 0.203 0 CA-C-O 120.825 0.345 . . . . 0.0 111.075 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -153.89 125.53 7.63 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.755 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.3 pt -80.95 129.87 36.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 111.234 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -89.74 113.42 24.94 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.289 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.8 mp -122.83 133.2 54.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.257 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.673 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.0 OUTLIER -101.62 112.93 25.65 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.45 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.826 HG22 HD11 ' A' ' 83' ' ' ILE . 16.3 t -90.5 124.4 43.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.07 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.7 115.48 30.32 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.74 149.82 32.04 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.691 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -54.56 -33.5 60.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.416 0.287 . . . . 0.0 111.552 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.45 32.3 2.04 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.75 53.67 15.02 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.966 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -107.29 101.18 10.58 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.545 0.212 . . . . 0.0 110.891 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -97.63 109.25 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 120.735 0.302 . . . . 0.0 111.344 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 t -139.78 151.99 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.51 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -112.47 147.55 36.29 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.316 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -142.62 137.94 30.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.106 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -110.11 116.21 31.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.869 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.7 pt -133.95 178.45 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.485 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.99 156.48 16.3 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.821 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.48 39.62 1.03 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.39 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -147.17 33.39 0.9 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.74 0.305 . . . . 0.0 111.133 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -142.07 155.41 65.33 Favored Pre-proline 0 C--O 1.232 0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.828 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.415 ' HA ' HG23 ' A' ' 71' ' ' THR . 54.8 Cg_endo -69.13 165.97 28.42 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.526 2.151 . . . . 0.0 112.243 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.719 HD11 HD12 ' A' ' 66' ' ' ILE . 10.4 mt -58.21 -24.39 58.99 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 24.7 p -53.39 -32.89 51.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.362 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.57 -58.96 5.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.824 -0.171 . . . . 0.0 110.694 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.63 -39.6 91.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.636 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.6 -43.1 85.76 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.352 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -63.51 -38.67 92.01 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.767 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.19 -34.2 61.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.579 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.579 ' CE1' HG11 ' A' ' 85' ' ' VAL . 53.5 t80 -80.86 -37.11 30.48 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 t -79.39 -41.08 28.56 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -72.67 -45.05 60.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.733 -0.212 . . . . 0.0 111.519 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -62.22 -35.65 79.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.299 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . 0.434 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 1.9 tt0 -75.47 -66.86 0.72 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.078 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.16 46.21 0.11 Allowed Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.188 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 13.7 mt -112.2 -154.38 0.54 Allowed 'General case' 0 C--O 1.233 0.198 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.6 166.1 10.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.946 0.403 . . . . 0.0 111.284 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.64 -36.75 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.221 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.9 28.53 2.69 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.69 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.444 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -160.67 77.56 0.6 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.104 0.478 . . . . 0.0 110.28 178.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.473 HG22 ' N ' ' A' ' 58' ' ' ARG . 10.0 mm -152.02 158.64 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.511 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.473 ' N ' HG22 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -156.64 129.95 8.05 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.957 0.408 . . . . 0.0 111.21 179.307 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -106.4 136.99 45.19 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.655 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -113.47 121.32 43.94 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.256 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -113.61 89.07 2.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.99 39.09 31.48 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.05 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.88 23.19 39.47 Favored Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.081 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -119.82 92.68 46.85 Favored Pre-proline 0 C--O 1.233 0.216 0 CA-C-N 116.976 0.388 . . . . 0.0 110.603 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.09 106.82 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.957 2.438 . . . . 0.0 112.25 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.719 HD12 HD11 ' A' ' 39' ' ' LEU . 14.3 pt -111.47 133.41 57.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.374 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -87.68 177.04 7.15 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 40' ' ' SER . 1.2 pm0 -83.49 23.74 0.91 Allowed 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.9 p -126.6 13.97 7.55 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 122.508 -0.12 . . . . 0.0 111.284 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.713 ' HB2' HD12 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -73.44 175.78 6.67 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.649 0.261 . . . . 0.0 111.297 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.415 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -168.43 -55.19 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.351 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -49.6 -50.18 13.79 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 122.39 2.06 . . . . 0.0 113.16 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.01 -44.86 87.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.67 0.271 . . . . 0.0 110.86 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -39.51 75.47 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 tt -81.88 -33.22 30.64 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.002 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.51 -29.88 62.37 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.361 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.3 mtt -62.77 170.96 2.31 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.249 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -117.34 -51.49 2.52 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.253 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.07 -56.36 0.02 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 120.657 0.265 . . . . 0.0 111.032 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -83.1 107.68 15.84 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.66 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.44 157.6 43.21 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.266 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.673 HG22 ' HB2' ' A' ' 20' ' ' LYS . 21.9 p -146.09 149.04 33.3 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.377 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.826 HD11 HG22 ' A' ' 21' ' ' VAL . 1.2 pp -144.26 160.57 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.967 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.61 106.8 14.95 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.579 HG11 ' CE1' ' A' ' 46' ' ' TYR . 9.6 p -79.91 114.99 21.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.126 0.489 . . . . 0.0 110.996 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.412 ' O ' ' HG3' ' A' ' 58' ' ' ARG . 3.8 m-85 -110.7 169.38 8.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.973 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 . . . . . 0 N--CA 1.465 0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.348 -179.882 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.465 0.291 0 CA-C-O 120.76 0.314 . . . . 0.0 111.05 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -141.33 164.71 29.52 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.039 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 78' ' ' GLU . 16.3 pt -105.71 124.55 60.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.417 . . . . 0.0 111.202 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -85.57 122.73 30.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mp -119.44 134.17 55.35 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.366 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.568 ' HB2' HG22 ' A' ' 82' ' ' THR . 11.6 mmtt -104.91 94.01 5.03 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.456 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.766 HG22 HD11 ' A' ' 83' ' ' ILE . 16.4 t -83.45 112.11 20.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.156 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.24 112.42 25.44 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.053 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.95 128.57 8.58 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.398 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -57.1 -36.0 70.11 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.509 0.195 . . . . 0.0 111.197 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -62.31 -30.54 71.22 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.132 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.53 57.47 0.19 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.581 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -149.76 107.57 3.69 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.709 0.29 . . . . 0.0 111.041 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.4 HG13 ' O ' ' A' ' 28' ' ' VAL . 13.2 p -107.99 123.39 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.231 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.1 t -139.96 138.72 37.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.111 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -92.55 130.67 38.14 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.9 158.93 22.25 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.13 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 mtpm? -132.35 94.8 3.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.955 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 HD23 ' A' ' 42' ' ' LEU . 4.2 pt -115.27 179.43 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.25 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.9 166.55 11.73 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.838 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.0 33.2 1.36 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.148 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -145.3 28.71 1.19 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.12 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.6 p -135.58 131.25 19.23 Favored Pre-proline 0 C--O 1.231 0.131 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' HG23 ' A' ' 71' ' ' THR . 40.5 Cg_exo -56.77 164.68 5.66 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.654 2.236 . . . . 0.0 112.509 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.794 HD11 HD12 ' A' ' 66' ' ' ILE . 9.8 mt -55.54 -23.47 26.81 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.307 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.4 p -52.44 -42.57 64.26 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.04 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -49.41 77.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 110.772 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 42' ' ' LEU . 0.3 OUTLIER -65.58 -48.59 71.85 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.635 179.617 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -50.87 71.73 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.243 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -57.47 -56.01 27.35 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.814 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.07 87.76 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.616 ' CE2' HG11 ' A' ' 85' ' ' VAL . 70.5 t80 -62.79 -51.64 66.31 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.224 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.472 ' HA ' HD12 ' A' ' 52' ' ' LEU . 97.1 p -63.31 -44.05 96.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -65.37 -37.17 86.2 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.955 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -74.25 -41.1 61.83 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.267 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -67.12 0.68 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.285 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 147.53 45.97 0.03 OUTLIER Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.202 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 47' ' ' SER . 0.9 OUTLIER -128.62 -163.42 1.28 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.743 0.306 . . . . 0.0 110.644 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 m -138.39 174.57 10.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.004 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.0 ttp -96.32 30.3 2.56 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.007 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -115.97 -5.58 11.99 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.71 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.652 ' O ' HD13 ' A' ' 57' ' ' ILE . 5.6 tt0 -160.23 78.02 0.65 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.219 0.533 . . . . 0.0 110.156 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.652 HD13 ' O ' ' A' ' 56' ' ' GLN . 15.5 mm -142.31 157.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.76 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.433 ' N ' HG22 ' A' ' 57' ' ' ILE . 4.7 tpt180 -153.6 117.07 4.64 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.023 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -98.95 143.31 29.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.343 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -133.75 134.57 43.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.344 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -117.6 104.98 11.57 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.401 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.58 37.05 25.44 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.012 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 82.6 25.37 50.67 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 121.02 -0.61 . . . . 0.0 113.042 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -119.77 101.43 48.12 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.803 0.302 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.32 122.06 10.54 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.99 2.46 . . . . 0.0 112.74 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.794 HD12 HD11 ' A' ' 39' ' ' LEU . 15.0 pt -138.24 154.95 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.228 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 36.9 m-20 -95.06 178.79 5.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.593 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.446 ' OE2' HG23 ' A' ' 69' ' ' THR . 0.0 OUTLIER -83.87 28.85 0.57 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.429 179.267 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . 0.446 HG23 ' OE2' ' A' ' 68' ' ' GLU . 41.8 p -120.38 6.24 10.66 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.75 ' HB2' HD12 ' A' ' 39' ' ' LEU . 3.2 t70 -62.02 163.14 8.25 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.863 0.363 . . . . 0.0 111.462 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.459 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -166.04 -56.72 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.212 179.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.27 -42.17 40.82 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 122.509 2.14 . . . . 0.0 112.728 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.76 -41.3 65.25 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.582 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -58.19 -37.57 75.02 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.22 -31.29 49.26 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.737 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -58.97 -34.48 71.85 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 17.7 mmt -66.62 173.67 3.29 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.324 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.45 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.7 OUTLIER -126.19 -52.35 1.52 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.22 -179.931 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -148.94 -58.09 0.21 Allowed 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.307 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -80.69 121.68 26.18 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.102 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -151.89 109.24 3.58 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.905 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.568 HG22 ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -100.16 137.16 38.99 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -179.622 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.766 HD11 HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -142.82 162.43 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.337 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -129.36 112.75 14.16 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.983 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.616 HG11 ' CE2' ' A' ' 46' ' ' TYR . 7.7 p -82.66 101.38 7.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.236 0.541 . . . . 0.0 110.778 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -89.82 164.46 14.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.123 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 mm-40 . . . . . 0 C--N 1.332 -0.18 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.969 179.972 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 . . . . . 0 N--CA 1.463 0.184 0 CA-C-O 120.816 0.341 . . . . 0.0 111.3 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.407 ' HB3' ' HG2' ' A' ' 32' ' ' LYS . 13.7 m80 -156.31 109.94 2.71 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.661 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.476 HG13 HD11 ' A' ' 19' ' ' LEU . 21.3 pt -81.95 130.1 36.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 111.31 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -92.31 132.16 36.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.456 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.476 HD11 HG13 ' A' ' 17' ' ' ILE . 4.9 mp -137.94 132.07 31.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.082 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.66 100.47 11.17 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.487 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.72 117.76 29.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.323 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.89 115.97 26.01 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.17 143.72 24.18 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.824 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -60.23 -27.65 67.38 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.62 39.1 1.03 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.71 93.44 0.04 OUTLIER Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.588 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 62.1 p -168.44 161.68 11.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.802 0.334 . . . . 0.0 111.538 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 28' ' ' VAL . 8.3 p -152.27 109.65 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.14 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.7 t -137.62 135.28 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.222 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -104.71 139.62 39.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.118 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -128.72 153.12 47.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.196 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.407 ' HG2' ' HB3' ' A' ' 16' ' ' HIS . 2.7 tttt -129.46 124.14 33.31 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.904 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.3 pt -140.47 177.02 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.61 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 152.6 34.82 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.198 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -88.32 55.53 3.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 111.16 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.03 40.89 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.934 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.2 t -149.33 142.59 16.09 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.032 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.465 ' CA ' HG23 ' A' ' 71' ' ' THR . 55.4 Cg_endo -69.37 167.78 22.93 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.795 2.33 . . . . 0.0 112.613 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.649 HD12 ' CB ' ' A' ' 70' ' ' ASP . 12.4 mt -66.51 -12.83 59.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.851 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.3 t -53.97 -36.23 62.65 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.605 0.24 . . . . 0.0 111.285 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -39.09 24.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.374 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.503 HD23 ' CD2' ' A' ' 39' ' ' LEU . 20.3 tp -68.23 -40.9 81.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.76 0.314 . . . . 0.0 110.547 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.488 ' HG3' ' CD1' ' A' ' 59' ' ' PHE . 2.0 ttm -67.14 -34.39 77.49 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.19 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -69.93 -47.8 60.98 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.635 0.255 . . . . 0.0 110.828 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.89 97.86 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.263 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.593 ' CE2' HG11 ' A' ' 85' ' ' VAL . 88.5 t80 -59.99 -44.52 94.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -38.82 88.34 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.119 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.96 -38.83 61.61 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.603 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.03 -46.6 73.93 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -68.35 -64.6 0.83 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.528 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 146.77 47.0 0.03 OUTLIER Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.267 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.6 mt -127.33 -161.0 1.04 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.96 157.89 28.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.769 0.318 . . . . 0.0 110.954 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.8 mtm -97.62 29.51 3.3 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -127.24 4.74 6.36 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.628 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.481 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.69 77.75 0.6 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.147 0.499 . . . . 0.0 110.314 179.634 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.481 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.4 mm -147.12 158.96 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.663 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.47 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.7 ptp85 -154.92 145.45 22.21 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.239 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.488 ' CD1' ' HG3' ' A' ' 43' ' ' MET . 2.8 m-85 -117.28 164.78 14.3 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.006 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -148.96 119.77 7.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -91.43 94.77 9.64 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.453 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 56.23 39.73 30.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 85.92 21.37 53.17 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.336 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -108.79 114.87 58.17 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.97 0.385 . . . . 0.0 110.373 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.96 96.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.825 2.35 . . . . 0.0 112.329 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.412 HD11 ' HB3' ' A' ' 59' ' ' PHE . 10.7 pt -114.32 133.75 59.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.272 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -90.66 176.25 6.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.935 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -15.88 63.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.509 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 6.6 p -89.42 32.74 0.84 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.563 0.22 . . . . 0.0 111.543 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.649 ' CB ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -74.25 155.7 37.99 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-O 120.484 0.183 . . . . 0.0 110.793 179.752 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.465 HG23 ' CA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -166.0 -57.15 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.376 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.434 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -46.67 -53.66 5.85 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.48 2.12 . . . . 0.0 113.152 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.34 96.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.757 0.313 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.42 -32.07 70.99 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.137 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.99 -33.2 51.46 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.688 0.28 . . . . 0.0 110.537 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -41.34 85.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.766 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -177.3 1.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.227 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -148.35 -59.21 0.24 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.415 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -136.85 23.34 3.09 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -166.14 93.71 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.788 0.328 . . . . 0.0 111.346 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.401 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 39.7 t0 -121.34 109.22 14.64 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.67 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.2 p -91.81 125.4 36.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.398 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.476 HD13 ' HE2' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -145.49 146.31 19.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.389 179.793 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -109.25 107.3 17.48 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.91 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.593 HG11 ' CE2' ' A' ' 46' ' ' TYR . 9.0 p -80.79 112.84 19.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 121.243 0.544 . . . . 0.0 111.159 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -96.47 158.86 15.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.954 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.53 0.189 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.731 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.239 0 CA-C-O 120.602 0.239 . . . . 0.0 110.613 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -139.36 129.66 25.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.134 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.676 HG22 ' O ' ' A' ' 78' ' ' GLU . 18.8 pt -80.29 126.51 39.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.118 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -85.94 106.21 16.97 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.348 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.614 HD13 HD22 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -105.23 125.23 50.75 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.416 179.866 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -93.17 90.27 6.78 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.138 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.454 ' HA ' HD12 ' A' ' 83' ' ' ILE . 18.8 t -81.52 100.16 5.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.152 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.27 111.93 24.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.18 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.24 146.31 27.6 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.455 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.04 55.76 1.86 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 111.064 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -178.14 41.17 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.276 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.72 73.79 0.61 Allowed Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.073 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.4 p -166.53 106.22 0.64 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.761 0.281 . . . . 0.0 111.43 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -122.52 108.48 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.944 0.402 . . . . 0.0 111.302 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.1 t -121.01 149.93 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.316 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.96 113.85 26.91 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.159 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.78 150.32 24.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.05 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 mttp -130.74 124.62 31.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.41 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 pt -145.85 -180.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.395 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.13 152.43 34.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.114 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.07 59.49 2.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -168.62 39.84 0.03 OUTLIER 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.677 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 t -151.27 145.01 17.56 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.021 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.34 163.92 24.86 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.99 2.46 . . . . 0.0 112.509 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.773 HD23 HD21 ' A' ' 42' ' ' LEU . 12.3 mt -56.61 -27.45 58.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.046 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.3 p -51.66 -36.35 45.91 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -58.48 -63.46 1.27 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.556 0.217 . . . . 0.0 110.927 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.773 HD21 HD23 ' A' ' 39' ' ' LEU . 3.5 pp -65.53 -29.42 70.06 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.867 179.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.5 mmt -59.21 -49.06 79.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.607 0.241 . . . . 0.0 110.618 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -66.57 -39.1 88.32 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.876 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.33 -45.77 68.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.506 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -61.86 -47.04 86.8 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.422 ' HA ' HD12 ' A' ' 52' ' ' LEU . 42.3 p -62.08 -37.73 86.12 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.748 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.01 -38.9 56.76 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.412 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.65 64.69 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -73.45 -70.19 0.38 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.714 0.292 . . . . 0.0 111.514 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 156.05 46.09 0.02 OUTLIER Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.068 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 47' ' ' SER . 1.5 mt -119.43 -159.92 0.79 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -128.32 161.36 29.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.85 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.08 27.81 3.47 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.121 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -131.09 8.49 4.75 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.494 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.21 77.71 0.64 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.251 0.548 . . . . 0.0 110.08 178.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.494 HD13 ' O ' ' A' ' 56' ' ' GLN . 10.8 mm -144.8 158.39 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.636 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 57' ' ' ILE . 26.2 ttt85 -149.53 141.71 24.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -119.29 160.7 21.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.894 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -146.17 109.99 4.89 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.464 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.621 ' HA ' HG22 ' A' ' 83' ' ' ILE . 56.7 t80 -89.27 101.91 14.58 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.118 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 t0 53.13 40.61 31.51 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.979 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 99.39 -35.15 4.89 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.961 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.44 112.77 14.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.658 0.229 . . . . 0.0 111.269 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.2 144.45 37.31 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.74 2.293 . . . . 0.0 112.873 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.544 ' N ' HD13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -144.94 173.87 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 179.593 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -109.16 178.52 4.43 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.456 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.82 -12.78 61.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.431 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.8 p -89.79 28.32 1.37 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.678 ' CB ' HD12 ' A' ' 39' ' ' LEU . 9.2 t0 -76.15 169.04 18.94 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.647 0.26 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.3 -54.82 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.367 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.89 -53.31 5.86 Favored 'Trans proline' 0 C--N 1.358 1.033 0 C-N-CA 122.669 2.246 . . . . 0.0 113.242 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.503 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . . . -61.3 -35.45 77.38 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.12 0.486 . . . . 0.0 110.647 179.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.421 HE22 HD23 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -73.49 -26.21 60.8 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.477 179.567 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 75' ' ' LEU . 0.3 OUTLIER -85.94 -36.61 19.76 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.621 0.248 . . . . 0.0 110.976 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 73' ' ' ALA . 11.5 pt-20 -66.23 -34.53 78.22 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.991 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.491 ' HE1' HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -69.28 178.18 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.822 179.661 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.676 ' O ' HG22 ' A' ' 17' ' ' ILE . 17.5 tt0 -136.48 -64.54 0.59 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -134.24 -48.17 0.78 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.318 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -92.76 114.37 26.91 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.691 0.281 . . . . 0.0 111.418 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -138.8 137.83 37.01 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -123.33 130.01 52.13 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.48 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.621 HG22 ' HA ' ' A' ' 61' ' ' PHE . 1.2 pp -147.84 152.43 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.145 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.23 111.54 22.67 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.122 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 85' ' ' VAL . 11.7 p -82.62 111.8 19.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.253 0.549 . . . . 0.0 111.369 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -97.97 152.27 19.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.015 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 . . . . . 0 CA--C 1.532 0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.059 179.913 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.233 0.2 0 CA-C-O 120.811 0.339 . . . . 0.0 111.346 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -152.27 138.44 18.31 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.882 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.628 HG22 ' HB2' ' A' ' 78' ' ' GLU . 25.4 pt -80.91 130.53 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.605 ' O ' HD13 ' A' ' 19' ' ' LEU . 2.8 m-20 -106.31 111.91 24.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.899 HD12 ' HB3' ' A' ' 81' ' ' ASP . 0.4 OUTLIER -124.48 136.4 53.98 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.785 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.4 mttp -97.25 97.4 9.13 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.553 HG22 HD11 ' A' ' 83' ' ' ILE . 24.3 t -82.5 108.49 15.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.55 123.56 38.06 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.96 153.27 32.43 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.458 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -28.0 53.55 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -93.59 29.79 1.92 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.43 72.6 0.63 Allowed Glycine 0 C--N 1.337 0.588 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.098 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 m -150.5 92.97 1.91 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.756 0.312 . . . . 0.0 111.245 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.489 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.5 p -91.35 113.98 27.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.933 0.397 . . . . 0.0 111.054 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -116.61 138.65 46.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.159 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -86.24 143.93 27.69 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.129 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -138.0 149.3 45.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -135.51 115.7 13.38 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.161 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.544 HD12 ' O ' ' A' ' 34' ' ' LYS . 1.2 pt -147.16 -179.83 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.834 0.349 . . . . 0.0 111.559 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.544 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.13 151.43 25.73 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.848 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.435 ' HD2' HD13 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -93.16 29.16 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.797 0.332 . . . . 0.0 111.517 179.668 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -122.44 37.48 4.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.7 t -154.64 142.63 14.19 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.631 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.697 ' HA ' HG23 ' A' ' 71' ' ' THR . 33.9 Cg_endo -64.06 168.83 11.55 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.656 2.237 . . . . 0.0 112.34 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.638 HD11 HD12 ' A' ' 66' ' ' ILE . 13.1 mt -55.0 -24.65 25.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.617 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.5 t -51.72 -39.61 58.72 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -60.16 -54.95 39.84 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.602 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 tp -65.99 -34.15 77.44 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.84 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.404 ' HG2' ' CE2' ' A' ' 59' ' ' PHE . 0.1 OUTLIER -59.87 -61.19 2.8 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.957 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -59.52 -40.74 88.11 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -44.38 89.15 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.667 0.27 . . . . 0.0 111.373 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -65.68 -39.0 90.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.489 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.483 ' HA ' HD12 ' A' ' 52' ' ' LEU . 17.7 m -79.09 -48.27 14.65 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.358 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -58.69 -37.63 76.48 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.102 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -68.85 -45.05 72.09 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.31 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -66.89 0.58 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.481 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.87 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.038 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 47' ' ' SER . 1.6 mt -120.6 -159.32 0.79 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.7 125.85 48.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.79 0.329 . . . . 0.0 110.91 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.5 -21.27 64.07 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.44 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -90.73 17.98 7.0 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.562 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.49 77.9 0.62 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 121.289 0.566 . . . . 0.0 110.438 178.531 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.562 HD13 ' O ' ' A' ' 56' ' ' GLN . 13.5 mm -148.17 158.67 7.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.721 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.471 ' N ' HG22 ' A' ' 57' ' ' ILE . 17.7 ttt85 -150.19 142.42 24.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.054 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.564 ' CD1' HD12 ' A' ' 83' ' ' ILE . 4.9 m-85 -117.82 130.77 56.48 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.419 179.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.1 mmm-85 -116.59 102.31 9.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.784 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -90.44 105.1 17.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.726 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 45.18 43.37 7.78 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.914 0.486 . . . . 0.0 111.906 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . 0.448 ' O ' ' HD3' ' A' ' 65' ' ' PRO . . . 82.86 2.17 90.64 Favored Glycine 0 CA--C 1.526 0.724 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.318 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -99.47 104.55 27.9 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 117.21 0.505 . . . . 0.0 110.842 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 63' ' ' GLY . 52.9 Cg_exo -56.02 121.72 10.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.999 2.466 . . . . 0.0 112.366 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.638 HD12 HD11 ' A' ' 39' ' ' LEU . 24.6 pt -131.67 150.32 33.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.603 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.59 165.86 11.34 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.264 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -57.85 -26.1 61.61 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.412 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.87 -14.48 53.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.784 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.568 ' CB ' HD12 ' A' ' 39' ' ' LEU . 5.8 t70 -53.32 150.63 6.12 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.033 0.444 . . . . 0.0 111.655 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.697 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -163.35 -56.27 0.01 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.151 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.52 -52.34 9.23 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 122.46 2.107 . . . . 0.0 112.71 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.99 79.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.992 0.425 . . . . 0.0 110.509 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -69.33 -21.62 63.83 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.432 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.435 HD13 ' HD2' ' A' ' 35' ' ' ARG . 1.1 mm? -78.07 -36.95 47.63 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -70.02 -36.38 75.04 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 8.1 mmt -106.76 97.02 6.86 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.328 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.628 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -139.96 67.91 1.37 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.408 -179.462 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -173.29 -64.07 0.02 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.977 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -135.2 83.22 2.01 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.477 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.899 ' HB3' HD12 ' A' ' 19' ' ' LEU . 11.8 t70 -127.07 135.17 50.41 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.878 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 30.2 p -115.98 144.32 44.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.405 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.564 HD12 ' CD1' ' A' ' 59' ' ' PHE . 2.4 pt -141.05 165.13 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.604 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -115.57 104.65 11.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.748 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 85' ' ' VAL . 13.3 p -80.17 115.5 22.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.168 0.509 . . . . 0.0 111.418 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -109.14 154.2 22.66 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.066 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 . . . . . 0 C--O 1.233 0.189 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.841 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 . . . . . 0 CA--C 1.531 0.235 0 CA-C-O 120.588 0.232 . . . . 0.0 111.148 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.482 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 47.2 m80 -142.88 160.57 40.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.729 0.3 . . . . 0.0 111.21 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.73 HG12 HG23 ' A' ' 33' ' ' ILE . 6.8 pt -108.14 122.06 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 121.1 0.476 . . . . 0.0 110.98 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -80.33 102.04 9.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.339 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mp -103.57 138.17 40.62 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.873 0.368 . . . . 0.0 111.571 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -96.61 100.04 11.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.237 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.483 HG22 HD11 ' A' ' 83' ' ' ILE . 22.4 t -83.39 93.8 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.59 125.23 39.11 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.286 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.77 161.2 17.77 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.593 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -92.32 43.11 1.12 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.944 0.402 . . . . 0.0 110.852 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.92 34.38 0.21 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.4 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.12 56.68 7.65 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.713 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 p -140.83 98.28 3.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.723 0.297 . . . . 0.0 111.185 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.8 m -115.07 92.65 2.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.944 0.402 . . . . 0.0 110.928 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.84 145.69 28.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.321 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -118.2 116.9 27.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -114.72 170.6 8.2 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.482 ' HG2' ' HB2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -110.41 151.99 26.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.73 HG23 HG12 ' A' ' 17' ' ' ILE . 6.2 tp -158.64 149.0 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.247 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.7 144.84 26.34 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.794 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ptp85 -81.92 57.67 3.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.97 0.414 . . . . 0.0 111.021 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.95 23.73 0.66 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.461 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.516 HG22 ' HD2' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -162.17 148.93 11.02 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 120.512 0.196 . . . . 0.0 110.764 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.516 ' HD2' HG22 ' A' ' 37' ' ' THR . 50.7 Cg_exo -54.08 161.18 5.28 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.886 2.39 . . . . 0.0 112.59 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.686 HD12 ' HB3' ' A' ' 70' ' ' ASP . 11.0 mt -61.28 -17.22 52.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.875 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.05 -37.58 54.12 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.478 0.18 . . . . 0.0 111.082 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -43.01 88.02 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.893 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.8 -47.42 46.62 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.6 tmm? -59.65 -44.51 93.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.252 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -59.5 -49.71 76.71 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.746 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.33 -34.6 78.34 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.491 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -72.5 -53.32 12.4 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.503 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -60.21 -43.72 95.72 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.147 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.27 -42.88 99.38 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.706 0.289 . . . . 0.0 110.827 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.437 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -78.48 -71.99 0.4 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.672 0.273 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.24 45.58 0.02 OUTLIER Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.118 -0.563 . . . . 0.0 112.151 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.4 mt -127.24 -164.94 1.41 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.695 0.283 . . . . 0.0 110.516 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -143.72 176.45 9.23 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.979 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -93.59 28.13 2.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.266 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -118.31 -3.67 10.98 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.564 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -160.48 77.92 0.63 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.192 0.52 . . . . 0.0 110.206 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.564 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.6 mm -144.98 157.86 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.921 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.436 ' N ' HG22 ' A' ' 57' ' ' ILE . 5.6 tpt180 -141.2 121.98 14.38 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -111.8 127.47 55.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -127.49 103.31 7.28 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.423 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.855 ' HA ' HG22 ' A' ' 83' ' ' ILE . 61.3 t80 -81.12 101.38 9.59 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.01 35.04 24.85 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.099 -179.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 103.71 -38.14 3.39 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 121.004 -0.617 . . . . 0.0 113.132 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.03 110.61 3.41 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.671 0.235 . . . . 0.0 111.202 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.17 129.5 16.21 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.086 2.524 . . . . 0.0 112.787 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 pp -145.79 163.07 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.494 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -103.86 177.32 4.88 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.854 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -64.73 -17.79 64.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.584 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.3 p -88.81 33.39 0.78 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.686 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -83.46 177.46 8.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.658 0.266 . . . . 0.0 111.312 179.77 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.409 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -169.89 -54.25 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.409 ' HD2' ' H ' ' A' ' 71' ' ' THR . 82.9 Cg_exo -47.63 -57.28 2.42 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 122.409 2.073 . . . . 0.0 112.802 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.95 -41.87 97.13 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.78 0.324 . . . . 0.0 110.692 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.4 ' HB2' ' HG ' ' A' ' 39' ' ' LEU . 20.3 tm0? -57.27 -41.42 79.7 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.9 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.3 -32.44 38.05 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.733 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -29.3 60.65 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.923 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.16 173.92 2.25 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.966 0.412 . . . . 0.0 111.283 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.488 ' O ' HG22 ' A' ' 17' ' ' ILE . 14.5 pt-20 -135.2 -49.54 0.74 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.412 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -169.41 -41.72 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.246 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -108.35 106.87 17.21 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.717 0.294 . . . . 0.0 111.02 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -152.94 161.9 41.98 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.199 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.7 t -140.43 156.8 46.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.323 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.855 HG22 ' HA ' ' A' ' 61' ' ' PHE . 0.8 OUTLIER -143.72 157.99 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.158 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -115.81 92.88 4.04 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.517 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.535 HG13 HD12 ' A' ' 83' ' ' ILE . 34.3 m -83.95 111.3 19.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 111.592 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -99.24 156.4 16.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.103 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 . . . . . 0 N--CA 1.464 0.247 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.145 -179.94 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 . . . . . 0 C--O 1.232 0.175 0 CA-C-O 120.785 0.326 . . . . 0.0 110.927 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -124.47 116.8 23.1 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.569 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.593 HG22 ' HA ' ' A' ' 79' ' ' ASP . 8.1 pt -86.48 117.0 30.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 111.136 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -90.02 92.56 9.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.309 0.576 . . . . 0.0 111.211 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.24 126.71 38.49 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.417 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -84.18 128.45 34.57 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.808 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.553 HG22 HD11 ' A' ' 83' ' ' ILE . 21.8 t -109.94 114.38 46.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.796 0.332 . . . . 0.0 111.334 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -103.0 120.81 41.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.985 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.33 144.7 26.01 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.691 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 86' ' ' PHE . 5.2 pm0 -54.98 -33.07 62.19 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -70.0 -25.84 63.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.87 -5.53 6.49 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 121.098 -0.573 . . . . 0.0 113.059 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.1 p -66.85 154.24 41.42 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.536 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -141.13 108.53 2.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.23 146.13 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.168 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -104.32 148.66 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.215 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -148.66 151.08 34.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.083 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 1.6 ptmm? -136.0 134.72 38.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.089 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.744 HG12 HD12 ' A' ' 42' ' ' LEU . 4.7 pt -145.35 178.11 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.365 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.03 139.7 32.34 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.62 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.39 54.74 2.68 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.853 0.359 . . . . 0.0 111.109 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.425 ' HD2' HD21 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -158.97 32.87 0.21 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -151.92 157.19 34.39 Favored Pre-proline 0 N--CA 1.466 0.358 0 CA-C-O 120.632 0.253 . . . . 0.0 111.142 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.575 ' HA ' HG23 ' A' ' 71' ' ' THR . 32.1 Cg_exo -58.32 163.98 9.46 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.932 2.421 . . . . 0.0 112.775 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.754 HD12 ' HB3' ' A' ' 70' ' ' ASP . 7.8 mt -62.46 -23.32 66.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.699 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -52.93 -32.1 43.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.831 -0.168 . . . . 0.0 111.335 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -53.23 60.26 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.652 0.263 . . . . 0.0 110.867 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.744 HD12 HG12 ' A' ' 33' ' ' ILE . 0.7 OUTLIER -75.18 -35.76 61.52 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.897 179.478 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.585 ' HE1' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -62.51 -52.0 65.2 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.365 -179.873 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -60.31 -52.84 63.56 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.76 -34.52 62.68 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.248 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -71.49 -54.59 10.09 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.022 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.86 -37.07 75.69 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.107 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -49.73 34.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.238 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.577 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -65.29 -69.76 0.27 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.344 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.08 45.66 0.07 OUTLIER Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.048 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 mt -114.41 -157.89 0.65 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.2 m -126.05 156.04 40.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.846 0.355 . . . . 0.0 111.063 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.57 28.78 2.18 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.174 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -129.31 3.27 5.15 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.712 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -157.68 77.52 0.83 Allowed 'General case' 0 CA--C 1.521 -0.153 0 CA-C-O 121.068 0.461 . . . . 0.0 109.903 179.414 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.712 HD13 ' O ' ' A' ' 56' ' ' GLN . 7.4 mm -145.3 154.95 13.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.772 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.85 143.83 33.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.715 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.617 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.5 OUTLIER -118.2 129.69 55.65 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.414 179.492 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 21.3 mtt-85 -124.07 100.12 6.57 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.243 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.491 ' HA ' HG22 ' A' ' 83' ' ' ILE . 37.4 t80 -89.82 109.38 20.38 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.699 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 t70 56.9 37.15 28.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.134 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.25 25.55 59.16 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.923 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.53 125.02 26.97 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.875 0.337 . . . . 0.0 110.851 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.0 127.27 14.93 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.885 2.39 . . . . 0.0 112.738 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.545 HD12 HD13 ' A' ' 39' ' ' LEU . 3.7 pt -146.49 161.55 9.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.379 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -107.9 174.14 6.01 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.977 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.93 1.14 32.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.655 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.2 p -92.38 0.87 57.48 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.754 ' HB3' HD12 ' A' ' 39' ' ' LEU . 3.8 t0 -64.69 173.64 2.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.812 0.339 . . . . 0.0 111.328 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.575 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -167.75 -56.53 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.357 -179.661 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -49.46 -44.37 35.04 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.438 2.092 . . . . 0.0 112.808 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.456 ' HB3' ' OD2' ' A' ' 70' ' ' ASP . . . -71.57 -41.54 68.9 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.707 0.289 . . . . 0.0 110.799 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -38.05 89.64 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.425 HD21 ' HD2' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -78.72 -33.4 46.76 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.719 179.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -68.79 -21.3 64.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.243 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.0 mtt -61.85 177.52 0.43 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.983 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -116.09 -63.5 1.44 Allowed 'General case' 0 C--O 1.233 0.203 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.593 ' HA ' HG22 ' A' ' 17' ' ' ILE . 15.1 t0 -170.86 -54.44 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.167 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -86.81 108.6 18.8 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.173 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -151.56 164.28 37.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.208 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 6.2 t -144.14 149.53 36.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.927 0.394 . . . . 0.0 111.5 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.617 HD13 ' CE2' ' A' ' 59' ' ' PHE . 1.0 OUTLIER -140.0 175.07 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.629 -179.416 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.52 102.63 6.95 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.415 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.421 HG13 ' O ' ' A' ' 85' ' ' VAL . 14.8 p -79.97 121.64 33.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 111.184 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.402 ' HA ' ' OE1' ' A' ' 24' ' ' GLN . 3.7 m-85 -115.37 143.13 45.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.797 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 . . . . . 0 C--N 1.332 -0.195 0 CA-C-O 120.746 0.308 . . . . 0.0 111.242 179.995 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.234 0.257 0 CA-C-O 120.623 0.249 . . . . 0.0 111.036 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.412 ' HB3' ' HB2' ' A' ' 32' ' ' LYS . 7.4 m80 -149.99 148.19 28.77 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.12 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.617 HG13 HD13 ' A' ' 19' ' ' LEU . 14.9 pt -98.75 123.89 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 111.061 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -83.76 102.02 12.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.617 HD13 HG13 ' A' ' 17' ' ' ILE . 8.0 mp -109.78 130.04 55.56 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.12 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -96.66 93.56 6.81 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.514 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.428 HG22 HD13 ' A' ' 83' ' ' ILE . 17.5 t -82.78 122.37 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.127 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.81 118.22 36.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.7 138.15 14.45 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.605 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -56.69 -43.56 80.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.559 0.218 . . . . 0.0 111.332 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.68 -28.02 66.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.526 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.66 54.18 0.22 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.275 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.6 p -134.89 103.81 5.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.9 95.89 4.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.05 137.16 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.197 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -94.19 87.26 5.2 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -91.37 142.24 27.9 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HB2' ' HB3' ' A' ' 16' ' ' HIS . 1.5 pttt -114.64 138.72 50.33 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.214 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.854 HG12 HD12 ' A' ' 42' ' ' LEU . 1.7 pp -144.32 -179.74 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.471 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.585 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.98 148.65 26.78 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.256 -179.885 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.95 28.44 1.57 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.799 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -126.31 29.4 5.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.695 0.283 . . . . 0.0 111.015 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.65 151.71 29.06 Favored Pre-proline 0 N--CA 1.463 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.63 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.51 ' HA ' HG23 ' A' ' 71' ' ' THR . 41.3 Cg_endo -67.71 156.8 64.57 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.559 2.173 . . . . 0.0 112.242 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.551 HD12 ' OD2' ' A' ' 70' ' ' ASP . 8.2 mt -57.91 -22.46 48.62 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.155 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' MET . 41.8 t -49.76 -36.16 24.92 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.725 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -46.55 61.95 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.538 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.854 HD12 HG12 ' A' ' 33' ' ' ILE . 6.9 tt -62.6 -52.64 62.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.696 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.426 ' HG3' ' O ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -58.59 -35.43 72.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.076 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.86 6.76 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.008 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -43.04 95.22 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.586 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.429 ' HE2' HG11 ' A' ' 85' ' ' VAL . 78.7 t80 -60.15 -48.34 82.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.338 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.3 m -74.41 -34.81 63.37 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.234 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.03 -50.15 51.28 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.108 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -56.09 -36.45 68.15 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.011 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.81 -55.48 8.44 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.466 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.5 -18.43 0.89 Allowed Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.492 -179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.476 ' HB3' HD11 ' A' ' 57' ' ' ILE . 4.5 mm? -62.41 -178.73 0.2 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.945 0.402 . . . . 0.0 110.894 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -107.12 173.77 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.285 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.3 ptt? -104.35 26.35 9.03 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.419 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.62 13.38 2.74 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.458 ' O ' HD13 ' A' ' 57' ' ' ILE . 2.9 tt0 -160.66 77.88 0.61 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.221 0.534 . . . . 0.0 110.225 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 58' ' ' ARG . 9.9 mm -149.12 160.88 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.418 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.485 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -156.77 139.6 15.21 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.612 0.244 . . . . 0.0 111.469 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.421 ' CE2' ' HB ' ' A' ' 85' ' ' VAL . 15.1 m-85 -117.47 160.83 20.57 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.776 0.322 . . . . 0.0 111.378 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -137.35 127.19 25.61 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.138 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.44 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 24.4 t80 -106.16 91.76 3.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.457 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 58.18 37.04 26.25 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.261 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 89.32 23.04 35.55 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.021 -0.609 . . . . 0.0 113.02 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 0.0 OUTLIER -114.81 103.95 54.49 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.756 0.278 . . . . 0.0 110.484 179.802 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.7 93.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.807 2.338 . . . . 0.0 112.138 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.7 pt -103.01 135.71 39.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.097 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -79.93 157.73 26.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.829 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.33 51.7 0.72 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.821 0.343 . . . . 0.0 110.978 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.1 t -166.56 25.36 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.717 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.551 ' OD2' HD12 ' A' ' 39' ' ' LEU . 3.2 p30 -77.03 -175.16 3.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.635 0.255 . . . . 0.0 110.922 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.51 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -167.82 -58.05 0.01 OUTLIER Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.271 -179.627 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -45.7 -50.74 9.1 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.591 2.194 . . . . 0.0 113.065 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.62 -49.46 66.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.7 -29.31 69.26 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.261 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -33.71 47.42 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.749 0.309 . . . . 0.0 110.414 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.53 -50.26 74.43 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.74 148.25 26.46 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.537 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.616 ' CG ' HG22 ' A' ' 17' ' ' ILE . 3.8 tt0 -164.81 61.29 0.13 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.036 -179.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -179.27 -60.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.45 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -142.22 96.74 3.0 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.753 0.311 . . . . 0.0 110.859 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.459 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 9.8 t70 -127.71 114.32 17.17 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.736 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.29 131.37 36.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.882 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.428 HD13 HG22 ' A' ' 21' ' ' VAL . 0.3 OUTLIER -129.91 166.73 26.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.1 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.525 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 2.6 m-20 -133.84 105.87 7.01 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.663 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 85' ' ' VAL . 9.8 p -92.83 112.99 27.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.143 0.497 . . . . 0.0 111.324 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.525 ' CE1' ' HB3' ' A' ' 84' ' ' ASP . 92.6 m-85 -105.37 166.53 10.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.774 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 . . . . . 0 C--O 1.233 0.187 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.192 179.756 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 t70 . . . . . 0 CA--C 1.531 0.236 0 CA-C-O 120.696 0.284 . . . . 0.0 111.382 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.455 ' CG ' ' HG2' ' A' ' 32' ' ' LYS . 2.4 m170 -161.56 119.83 2.35 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.714 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.755 HG12 HG23 ' A' ' 33' ' ' ILE . 13.1 pt -80.96 130.06 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 111.063 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -81.5 116.72 21.42 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.041 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.422 HD21 ' CG1' ' A' ' 83' ' ' ILE . 7.9 tt -131.52 135.95 47.48 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.091 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.778 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.9 OUTLIER -104.25 106.04 16.4 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.293 179.49 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 23.4 t -82.42 124.44 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.14 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.657 ' O ' HG12 ' A' ' 85' ' ' VAL . . . -104.83 177.67 4.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.13 148.95 20.87 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.787 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . 0.41 ' HG3' ' CE2' ' A' ' 86' ' ' PHE . 1.4 tt0 -52.37 -38.51 58.99 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 111.433 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.45 33.27 2.51 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.588 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.77 83.72 0.2 Allowed Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.785 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.59 68.18 1.31 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.726 0.298 . . . . 0.0 111.493 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.6 t -84.54 107.8 16.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.988 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -124.56 148.98 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.433 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -93.07 110.88 22.37 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.844 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -112.75 165.66 12.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.455 ' HG2' ' CG ' ' A' ' 16' ' ' HIS . 6.9 tttt -130.36 143.62 50.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.01 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.755 HG23 HG12 ' A' ' 17' ' ' ILE . 3.7 tt -154.91 148.44 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.08 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -77.77 176.56 8.93 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.044 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -112.07 49.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.895 0.378 . . . . 0.0 111.453 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -157.59 33.24 0.27 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.237 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.03 143.88 10.56 Favored Pre-proline 0 N--CA 1.466 0.344 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.981 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.33 164.29 7.12 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.809 2.339 . . . . 0.0 112.65 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.656 HD12 ' CB ' ' A' ' 70' ' ' ASP . 12.6 mt -60.24 -14.78 19.61 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 p -51.98 -33.14 36.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.467 0.175 . . . . 0.0 111.16 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -57.06 -58.63 7.36 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.671 0.272 . . . . 0.0 110.543 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 tp -61.76 -38.11 86.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.72 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.53 -55.13 32.37 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.988 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -61.41 -43.92 98.04 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.234 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.31 -42.0 94.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.565 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.636 ' CE1' HG11 ' A' ' 85' ' ' VAL . 51.3 t80 -78.13 -42.53 31.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.448 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.5 p -65.47 -43.01 91.61 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.473 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.58 -34.89 62.98 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.902 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.42 -57.09 12.64 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.579 0.228 . . . . 0.0 111.464 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.86 -47.8 11.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.226 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.33 57.09 0.63 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.718 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.48 HD12 ' OE1' ' A' ' 87' ' ' GLN . 3.5 mm? -91.15 -78.92 0.38 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.607 0.241 . . . . 0.0 110.4 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -172.06 157.97 4.5 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.698 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -37.34 7.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.692 0.282 . . . . 0.0 110.523 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -101.57 27.29 6.47 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.62 77.83 0.61 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.084 0.468 . . . . 0.0 110.518 179.076 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.464 HG22 ' N ' ' A' ' 58' ' ' ARG . 10.8 mm -152.59 157.58 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.466 179.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.464 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -159.02 123.31 3.98 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.166 179.318 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -93.63 151.9 19.36 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.767 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.03 127.09 35.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.246 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -103.44 91.87 4.24 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.326 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.5 39.56 30.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.127 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.83 21.12 29.28 Favored Glycine 0 CA--C 1.522 0.518 0 C-N-CA 121.07 -0.586 . . . . 0.0 113.032 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -118.46 94.8 47.9 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 116.855 0.327 . . . . 0.0 110.436 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -52.96 105.88 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.972 2.448 . . . . 0.0 112.47 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.7 pt -113.03 160.29 12.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.325 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -103.68 164.4 11.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.096 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -68.13 -15.06 63.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.39 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 14.9 p -91.29 30.49 1.26 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.656 ' CB ' HD12 ' A' ' 39' ' ' LEU . 3.0 t70 -75.08 155.97 36.58 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 111.35 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.419 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.2 OUTLIER -160.68 -55.27 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.422 179.903 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.419 ' HD2' ' H ' ' A' ' 71' ' ' THR . 54.8 Cg_exo -52.41 -53.75 6.36 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.356 2.037 . . . . 0.0 112.759 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.84 -37.42 86.75 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.868 0.366 . . . . 0.0 110.493 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.05 -20.11 65.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.452 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -81.58 -35.19 30.47 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.92 -40.2 91.22 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.976 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.16 122.9 47.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.579 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.553 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -146.83 31.29 0.95 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.523 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -148.62 -51.29 0.16 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.28 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.13 99.45 4.13 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.652 0.263 . . . . 0.0 110.905 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -140.33 133.14 29.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.778 HG22 ' HB2' ' A' ' 20' ' ' LYS . 24.7 p -125.47 136.48 53.42 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.545 -179.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.422 ' CG1' HD21 ' A' ' 19' ' ' LEU . 0.6 OUTLIER -138.2 161.6 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.35 179.802 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.411 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 8.0 t0 -125.63 118.72 26.27 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.636 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.657 HG12 ' O ' ' A' ' 22' ' ' ALA . 13.6 p -82.7 121.34 35.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.232 0.539 . . . . 0.0 111.148 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.418 ' HB2' ' CD ' ' A' ' 58' ' ' ARG . 9.4 m-85 -107.46 164.35 12.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.78 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . 0.48 ' OE1' HD12 ' A' ' 52' ' ' LEU . 19.2 mt-30 . . . . . 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.239 -179.944 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.235 0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.453 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -147.21 175.18 10.94 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.26 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.3 pt -104.77 128.66 58.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -82.21 119.68 24.39 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.235 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 42' ' ' LEU . 1.4 mt -123.86 116.95 23.77 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.75 0.309 . . . . 0.0 111.362 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -96.54 93.33 6.72 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.483 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.569 HG22 HD13 ' A' ' 83' ' ' ILE . 21.9 t -94.96 122.42 46.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.003 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -93.68 123.45 37.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.268 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.431 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -83.8 148.55 24.81 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.831 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.95 -37.83 72.1 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.49 0.186 . . . . 0.0 111.238 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.21 -28.37 67.93 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.469 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.6 31.96 2.63 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.205 -0.521 . . . . 0.0 112.592 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.0 m -110.86 144.86 39.24 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.756 0.312 . . . . 0.0 110.852 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.46 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.8 p -112.02 117.13 54.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.178 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.15 133.03 69.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.934 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -117.82 106.55 13.13 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.007 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -97.86 155.56 17.0 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.4 mtmm -131.95 113.09 13.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.992 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.656 HD13 ' HB2' ' A' ' 42' ' ' LEU . 45.4 pt -129.29 178.54 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.412 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -80.66 147.37 30.69 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.941 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -89.02 54.72 3.09 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.232 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.6 m170 -159.84 35.27 0.18 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.094 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.5 145.15 16.64 Favored Pre-proline 0 N--CA 1.465 0.308 0 CA-C-N 116.704 -0.225 . . . . 0.0 110.962 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.666 ' HA ' HG23 ' A' ' 71' ' ' THR . 47.8 Cg_exo -56.12 158.69 14.09 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.902 2.402 . . . . 0.0 112.801 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.661 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.6 mt -57.62 -23.74 52.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.805 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 t -47.77 -35.02 9.27 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.99 0.181 . . . . 0.0 111.342 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmt -60.08 -57.63 12.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.958 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 19' ' ' LEU . 5.4 tt -71.11 -36.83 72.31 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.128 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.536 ' CE ' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -58.37 -49.79 75.99 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.239 -179.855 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -62.6 -48.47 79.29 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.601 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.06 92.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.485 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.63 ' CE1' HG11 ' A' ' 85' ' ' VAL . 21.5 t80 -69.87 -45.62 67.29 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.02 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 t -68.35 -47.53 67.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.444 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -59.66 -40.66 88.46 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.99 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -66.65 -39.42 88.21 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.057 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -66.1 0.65 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.293 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.63 46.06 0.1 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.292 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 15.0 mt -119.78 -154.64 0.58 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . 0.408 ' O ' HD11 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -127.49 166.0 18.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.795 0.331 . . . . 0.0 111.077 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -95.88 25.98 4.37 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.263 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 56' ' ' GLN . 20.2 mtt180 -134.75 9.8 3.63 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.673 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -157.96 77.63 0.82 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.109 0.481 . . . . 0.0 109.738 178.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.673 HD13 ' O ' ' A' ' 56' ' ' GLN . 8.4 mm -144.66 155.22 14.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.814 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -144.79 116.77 8.3 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.167 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.55 101.64 13.13 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.128 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -85.19 143.24 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.072 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.423 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 54.0 t80 -137.21 86.25 2.19 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.656 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.67 37.61 20.53 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.001 0.429 . . . . 0.0 111.115 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.48 36.19 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.143 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 1.7 mm100 -115.94 98.47 51.18 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.996 0.398 . . . . 0.0 110.84 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -68.51 107.3 1.59 Allowed 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.685 2.257 . . . . 0.0 112.265 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.9 pt -122.84 144.82 30.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.503 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -86.95 178.21 7.02 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.165 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.51 36.48 0.31 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.881 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.2 p -136.71 17.38 3.08 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.661 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.1 t70 -67.25 162.88 21.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.006 0.431 . . . . 0.0 111.785 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.666 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -163.13 -54.95 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.551 179.836 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.429 ' HD2' ' H ' ' A' ' 71' ' ' THR . 76.4 Cg_exo -50.45 -52.22 9.43 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.441 2.094 . . . . 0.0 113.247 -179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.19 96.75 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.802 0.334 . . . . 0.0 110.956 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.93 -33.96 71.18 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.23 -34.56 59.22 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.593 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.85 -36.35 72.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 4.8 mmt -70.09 179.25 2.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.242 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -132.03 -58.14 0.96 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.484 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -145.82 -66.91 0.3 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.373 0.13 . . . . 0.0 111.317 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.0 119.85 20.52 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.94 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -146.72 143.26 28.58 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.274 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 132.07 55.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.579 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -138.11 167.79 21.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.919 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.464 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 2.7 m-20 -142.47 110.47 5.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.256 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.63 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.9 p -92.45 113.86 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.022 0.439 . . . . 0.0 111.11 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.464 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 22.6 m-85 -130.8 170.48 14.33 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.883 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 . . . . . 0 N--CA 1.464 0.259 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.898 179.8 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.464 0.27 0 CA-C-O 120.847 0.356 . . . . 0.0 111.525 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.434 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 29.3 m80 -155.42 107.68 2.67 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.609 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.676 HG12 HG23 ' A' ' 33' ' ' ILE . 6.8 pt -79.76 128.07 38.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.724 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -84.05 119.09 24.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.195 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.478 HD11 ' HG2' ' A' ' 77' ' ' MET . 0.4 OUTLIER -122.28 137.26 54.91 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.859 0.362 . . . . 0.0 111.498 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.0 OUTLIER -101.73 97.26 7.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.365 179.472 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.586 HG22 HD11 ' A' ' 83' ' ' ILE . 21.5 t -85.51 118.46 32.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.262 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.49 113.58 27.02 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.0 156.12 39.56 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.569 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -92.72 29.76 1.7 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -133.38 26.05 4.13 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.257 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.98 61.74 4.71 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.604 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -162.21 114.15 1.67 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.797 0.332 . . . . 0.0 111.409 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.16 130.19 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 t -147.36 153.38 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.43 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -119.87 137.05 54.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.702 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -122.96 154.09 38.86 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.434 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -104.83 113.14 26.54 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.738 179.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.676 HG23 HG12 ' A' ' 17' ' ' ILE . 8.9 tp -124.49 153.81 31.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.346 -179.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.91 153.54 18.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.872 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.78 58.1 3.76 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.371 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.415 ' O ' HG23 ' A' ' 37' ' ' THR . 0.3 OUTLIER -164.62 32.63 0.07 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.534 179.64 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 36' ' ' HIS . 6.1 p -157.62 153.22 22.46 Favored Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.885 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.57 155.09 22.46 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.735 2.29 . . . . 0.0 112.622 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.634 HD13 HD12 ' A' ' 66' ' ' ILE . 0.6 OUTLIER -61.4 -20.02 62.57 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.979 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.84 -34.22 26.94 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.519 0.199 . . . . 0.0 110.957 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.1 mmmt -54.19 -42.95 70.29 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.908 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.57 -45.54 30.01 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.746 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.1 ttp -57.08 -36.8 71.0 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.053 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HD3' ' HB2' ' A' ' 54' ' ' MET . 27.9 mmtm -77.97 -54.0 6.79 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.051 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.59 -32.34 62.98 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.476 ' CE1' HG11 ' A' ' 85' ' ' VAL . 56.4 t80 -79.47 -52.69 7.71 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.485 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.9 p -66.31 -37.02 84.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.299 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.08 -47.27 68.73 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.062 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 mtt180 -59.87 -49.09 79.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.376 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -64.39 -69.15 0.3 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.28 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.2 38.24 0.13 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.943 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.617 HD22 ' N ' ' A' ' 52' ' ' LEU . 0.7 OUTLIER -107.99 -153.54 0.51 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.743 0.272 . . . . 0.0 110.563 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.9 p -95.96 119.68 34.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.932 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . 0.401 ' HB2' ' HD3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -72.86 -4.69 33.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.802 179.557 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -120.01 23.45 11.01 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.502 0.191 . . . . 0.0 111.216 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.468 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.76 77.78 0.6 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.199 0.523 . . . . 0.0 110.452 179.173 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 58' ' ' ARG . 15.4 mm -150.86 160.11 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.149 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.485 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -152.14 150.65 30.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.447 179.752 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.484 ' CD1' HD12 ' A' ' 83' ' ' ILE . 64.8 m-85 -116.37 161.06 19.62 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.76 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -139.59 114.79 9.71 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.438 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -108.46 101.42 10.6 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.306 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 53.18 46.95 25.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.076 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 74.33 19.88 79.74 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.001 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.21 86.65 33.17 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.83 0.315 . . . . 0.0 110.84 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.38 150.96 31.64 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.037 2.491 . . . . 0.0 112.667 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.634 HD12 HD13 ' A' ' 39' ' ' LEU . 14.5 pt -141.01 171.57 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.634 -179.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -119.19 171.13 8.5 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -30.82 63.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.887 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 42.4 p -78.92 8.22 5.91 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.575 ' HB3' HD12 ' A' ' 39' ' ' LEU . 1.1 m-20 -65.47 175.89 1.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.869 0.366 . . . . 0.0 111.457 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.82 -55.74 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.522 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -46.91 -51.99 8.39 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.346 2.031 . . . . 0.0 112.919 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.9 91.48 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.828 0.347 . . . . 0.0 110.64 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.505 ' NE2' HD11 ' A' ' 17' ' ' ILE . 15.9 tp60 -58.71 -34.5 71.38 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.192 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 tt -79.48 -33.24 42.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -62.76 -26.11 68.54 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.237 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.482 ' HB3' HD12 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -58.34 160.23 5.42 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 111.492 -179.929 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.619 ' O ' HG22 ' A' ' 17' ' ' ILE . 1.5 tt0 -125.02 -76.98 0.59 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.879 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.57 26.62 0.23 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -174.86 102.87 0.09 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.524 0.202 . . . . 0.0 111.259 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 3.7 m-20 -146.9 130.4 16.79 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.875 0.369 . . . . 0.0 111.54 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.436 HG22 ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -102.92 144.33 31.36 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.367 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.586 HD11 HG22 ' A' ' 21' ' ' VAL . 3.3 pt -150.35 168.07 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.575 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -127.1 106.92 9.59 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.295 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.476 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.8 p -83.06 119.13 31.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.052 0.453 . . . . 0.0 111.242 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -102.67 125.41 49.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.36 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 . . . . . 0 C--O 1.233 0.218 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.175 -179.674 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 . . . . . 0 CA--C 1.53 0.198 0 CA-C-O 120.674 0.273 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.4 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 73.3 m80 -150.23 130.44 13.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.931 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.72 HG12 HG23 ' A' ' 33' ' ' ILE . 6.6 pt -86.63 127.14 40.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.709 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -81.35 94.37 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.299 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -93.01 132.14 37.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.205 -179.93 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -113.56 104.75 12.56 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.492 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.875 HG22 HD11 ' A' ' 83' ' ' ILE . 36.5 t -87.92 128.6 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.184 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -127.24 147.12 50.22 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.19 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -108.78 158.71 14.52 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.58 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -63.74 -45.6 89.14 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.594 0.235 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.96 -28.2 67.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.303 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.9 50.63 0.16 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.366 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -98.7 151.76 20.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.702 0.287 . . . . 0.0 111.118 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 28' ' ' VAL . 8.3 p -152.05 111.62 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.358 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.54 HG21 ' CE1' ' A' ' 46' ' ' TYR . 14.7 m -137.25 156.87 34.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.402 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -127.35 128.56 46.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -137.65 151.5 48.34 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -104.23 125.2 50.31 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.72 HG23 HG12 ' A' ' 17' ' ' ILE . 8.9 tp -136.62 153.1 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.187 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.02 148.24 22.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.755 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.74 53.99 2.55 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.006 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -150.58 29.32 0.69 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.323 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.6 153.06 25.67 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.972 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.32 162.02 42.27 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.639 2.226 . . . . 0.0 112.287 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.605 HD12 ' HB3' ' A' ' 70' ' ' ASP . 8.3 mt -63.31 -19.54 64.69 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.94 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -48.71 -36.13 15.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.565 0.221 . . . . 0.0 111.23 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.18 -62.24 2.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.124 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.425 ' CD2' HD22 ' A' ' 19' ' ' LEU . 12.6 tp -62.82 -33.86 76.1 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.883 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.414 ' HG2' ' CD1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -55.68 -61.97 2.0 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.685 179.548 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -59.5 -37.54 78.55 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.137 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.508 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.634 ' HE2' HG21 ' A' ' 85' ' ' VAL . 66.9 t80 -73.47 -45.54 53.5 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.439 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.7 m -61.78 -50.01 74.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.409 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.51 72.12 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.997 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.16 68.5 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.892 179.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.11 -52.11 15.46 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.084 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.73 -11.85 3.69 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.71 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.7 mt -74.71 -166.0 0.41 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.751 0.276 . . . . 0.0 110.631 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.18 169.17 9.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.092 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.5 29.62 3.21 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.113 179.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.22 3.05 5.18 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.512 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.48 77.99 0.63 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.082 0.468 . . . . 0.0 110.275 179.318 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.512 HD13 ' O ' ' A' ' 56' ' ' GLN . 9.9 mm -141.97 157.78 20.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.996 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.417 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -136.63 133.48 36.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.933 0.397 . . . . 0.0 111.454 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.414 ' CD1' ' HG2' ' A' ' 43' ' ' MET . 2.4 m-85 -123.63 109.84 14.25 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.054 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -109.45 139.71 44.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.757 0.313 . . . . 0.0 111.4 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.508 ' HA ' HG22 ' A' ' 83' ' ' ILE . 43.9 t80 -114.41 102.24 9.9 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.109 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 52.18 35.12 15.87 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.077 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.71 24.93 19.35 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.022 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.3 104.67 54.58 Favored Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.878 0.339 . . . . 0.0 110.962 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.84 109.04 2.23 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.754 2.302 . . . . 0.0 112.848 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.8 pt -131.71 150.17 33.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.139 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -89.63 174.85 7.52 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.984 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' A' ' 40' ' ' SER . 2.0 pt-20 -73.58 51.73 0.37 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.341 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.8 p -151.7 19.33 0.71 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.491 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.605 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.8 OUTLIER -68.75 173.02 5.59 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.84 0.352 . . . . 0.0 111.805 -179.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.11 -56.85 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.606 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.13 -51.68 9.01 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 122.548 2.165 . . . . 0.0 113.044 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.55 91.34 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.931 0.396 . . . . 0.0 110.593 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -61.5 -38.73 88.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.012 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.18 -34.84 37.18 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.695 0.283 . . . . 0.0 110.642 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -59.2 -29.72 67.69 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.926 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.434 ' HG2' ' HB2' ' A' ' 81' ' ' ASP . 0.3 OUTLIER -66.77 -177.81 0.65 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.405 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.46 -53.91 0.25 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.275 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -146.12 -53.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -87.82 128.33 35.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.842 0.354 . . . . 0.0 110.868 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.434 ' HB2' ' HG2' ' A' ' 77' ' ' MET . 42.4 t0 -149.78 126.3 10.9 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.907 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.5 p -125.6 131.58 52.68 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.14 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.875 HD11 HG22 ' A' ' 21' ' ' VAL . 0.9 OUTLIER -136.52 164.18 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.725 179.805 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -126.2 106.36 9.49 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.332 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.634 HG21 ' HE2' ' A' ' 46' ' ' TYR . 33.1 m -84.83 118.48 31.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.027 0.442 . . . . 0.0 111.181 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.29 173.58 6.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.513 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 CA--C 1.532 0.276 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.058 179.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.3 t70 . . . . . 0 C--O 1.234 0.26 0 CA-C-O 120.738 0.304 . . . . 0.0 111.175 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -133.46 139.25 46.59 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.563 HG22 ' HA ' ' A' ' 79' ' ' ASP . 18.8 pt -80.54 126.9 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 121.048 0.451 . . . . 0.0 111.539 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -87.57 105.27 17.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.021 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.404 ' HG ' ' HB3' ' A' ' 81' ' ' ASP . 1.5 mp -111.62 124.94 53.36 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.03 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.451 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.3 OUTLIER -96.79 102.43 14.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.45 179.649 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.674 HG22 HD11 ' A' ' 83' ' ' ILE . 13.4 t -82.4 123.16 38.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.42 102.95 9.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.098 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.76 153.67 31.55 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.468 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -59.91 -33.6 72.07 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -61.29 -31.65 71.49 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.443 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.15 83.4 0.97 Allowed Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.548 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.7 t -157.93 152.06 24.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.674 0.273 . . . . 0.0 111.247 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.3 t -141.28 93.11 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -112.19 137.15 46.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.067 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -99.65 87.29 3.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.949 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.32 132.64 35.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.018 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 13.8 mtmm -111.97 96.51 6.09 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.479 HD11 HD11 ' A' ' 17' ' ' ILE . 3.1 pt -107.0 179.02 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.223 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.62 149.39 22.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.823 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -85.93 51.49 2.22 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.856 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -154.96 34.13 0.39 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.906 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.17 153.31 29.36 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.785 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.543 ' HA ' HG23 ' A' ' 71' ' ' THR . 57.7 Cg_endo -70.7 163.84 37.59 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.63 2.22 . . . . 0.0 112.405 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.654 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.6 mt -59.58 -24.68 63.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.52 -33.73 46.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.638 0.256 . . . . 0.0 111.287 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -57.62 7.38 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.276 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.415 HD12 HG12 ' A' ' 33' ' ' ILE . 9.6 tt -63.64 -43.57 96.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.116 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.665 ' SD ' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -58.2 -50.18 74.46 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.415 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.62 -53.25 58.68 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.69 65.87 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.722 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -79.63 -53.67 6.61 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.045 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.0 t -58.83 -36.35 74.4 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.12 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -72.93 -41.99 63.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.421 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -43.01 93.5 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.498 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -71.83 -76.27 0.11 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.267 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 152.18 39.86 0.03 OUTLIER Glycine 0 C--N 1.334 0.451 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.158 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.554 HD22 ' N ' ' A' ' 52' ' ' LEU . 2.9 mm? -96.78 -166.78 1.45 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.256 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.64 159.34 23.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.949 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.93 25.81 3.95 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.358 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 -139.61 14.7 2.53 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.458 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.662 ' O ' HD13 ' A' ' 57' ' ' ILE . 2.5 pt20 -160.8 77.66 0.59 Allowed 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.269 0.557 . . . . 0.0 110.076 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.665 HG21 ' SD ' ' A' ' 43' ' ' MET . 9.4 mm -145.47 157.2 13.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.795 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.413 ' N ' HG22 ' A' ' 57' ' ' ILE . 54.6 ttt180 -157.37 130.23 7.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.82 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.427 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -103.43 148.5 25.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.576 179.468 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -145.43 127.15 15.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.194 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -100.14 98.74 9.41 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.246 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.72 37.7 28.99 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.081 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.47 24.95 31.98 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.114 -0.565 . . . . 0.0 113.069 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -117.03 108.79 43.6 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.98 0.39 . . . . 0.0 110.659 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -52.1 115.8 2.39 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.044 2.496 . . . . 0.0 112.679 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.427 HG13 ' HB3' ' A' ' 59' ' ' PHE . 10.6 pt -139.16 148.0 24.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.267 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -94.9 170.45 9.42 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.734 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.412 ' HB3' ' HG3' ' A' ' 43' ' ' MET . 0.3 OUTLIER -83.11 23.77 0.84 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.539 179.225 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 p -116.46 11.76 14.97 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 122.457 -0.152 . . . . 0.0 111.111 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.654 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.7 t70 -65.79 168.64 7.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.898 0.38 . . . . 0.0 111.188 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.543 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -168.39 -55.22 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.341 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.92 -48.05 21.04 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.53 2.153 . . . . 0.0 112.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.87 89.07 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.627 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.25 -33.38 69.32 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.905 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.33 -32.49 49.2 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.725 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -58.66 -39.78 81.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.734 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.26 175.85 2.5 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.201 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.481 ' O ' HG22 ' A' ' 17' ' ' ILE . 4.2 pt-20 -123.47 -52.44 1.82 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.573 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . 0.563 ' HA ' HG22 ' A' ' 17' ' ' ILE . 11.2 m-20 -159.73 -57.13 0.06 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.875 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.07 117.06 16.49 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.145 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.404 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 27.4 t70 -158.92 153.15 23.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.451 HG22 ' HB2' ' A' ' 20' ' ' LYS . 32.6 p -137.7 145.65 42.81 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.399 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.674 HD11 HG22 ' A' ' 21' ' ' VAL . 1.0 OUTLIER -145.25 154.37 13.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.528 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -118.42 121.19 39.73 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.078 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.486 ' O ' HG13 ' A' ' 85' ' ' VAL . 13.8 p -94.12 111.56 25.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 121.19 0.519 . . . . 0.0 110.849 178.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -95.88 146.26 24.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.112 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 C--O 1.233 0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.038 179.828 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 . . . . . 0 C--O 1.234 0.252 0 CA-C-O 120.583 0.23 . . . . 0.0 110.977 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.29 123.9 1.16 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.324 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.696 HG22 ' O ' ' A' ' 78' ' ' GLU . 22.6 pt -80.65 129.64 37.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -98.81 104.65 16.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.399 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.75 139.3 35.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.466 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.606 ' HB2' HG23 ' A' ' 82' ' ' THR . 0.0 OUTLIER -111.3 105.46 14.12 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.354 179.549 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.674 HG13 ' CD1' ' A' ' 83' ' ' ILE . 22.0 t -90.32 129.7 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.307 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -115.98 113.7 23.61 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.372 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.432 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -79.86 146.18 28.02 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.01 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -56.15 -51.83 66.57 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.503 0.192 . . . . 0.0 111.428 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -63.42 -23.72 67.53 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.407 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.13 88.94 1.03 Allowed Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.579 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.4 p -153.76 127.38 8.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.705 0.288 . . . . 0.0 111.252 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.86 97.11 5.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.874 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.43 135.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.24 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -110.09 115.86 30.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.082 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -104.75 165.04 11.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.113 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.9 mtpp -135.23 111.59 9.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.47 ' O ' HG12 ' A' ' 17' ' ' ILE . 27.1 pt -129.14 173.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.371 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 158.99 19.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.809 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . 0.453 ' HD3' ' HA ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -90.76 52.56 2.21 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.831 0.348 . . . . 0.0 111.265 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -160.59 35.48 0.16 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -155.88 148.26 17.68 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 120.485 0.183 . . . . 0.0 111.142 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 35.6 Cg_exo -62.08 165.03 15.41 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.977 2.451 . . . . 0.0 112.878 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.51 HD12 ' CB ' ' A' ' 70' ' ' ASP . 8.8 mt -62.77 -17.87 61.74 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.885 179.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.9 p -50.94 -34.59 29.29 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -54.44 45.51 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.47 -41.12 89.5 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.346 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.616 ' HE3' ' HB3' ' A' ' 68' ' ' GLU . 7.4 mmm -59.3 -53.72 55.0 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.521 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -55.12 -54.0 48.78 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.095 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.3 81.28 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.409 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.437 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 71.6 t80 -69.6 -37.15 76.77 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.414 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -76.94 -34.36 57.64 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.668 0.271 . . . . 0.0 111.03 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -78.16 -37.14 46.58 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.389 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -60.17 -36.31 77.3 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.773 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.93 -70.62 0.62 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.396 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.33 46.27 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.944 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -112.02 -160.03 0.7 Allowed 'General case' 0 C--O 1.233 0.227 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 t -130.47 163.33 27.22 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.9 0.381 . . . . 0.0 111.191 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.6 ttp -93.11 26.75 2.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.289 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -135.49 14.36 3.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.474 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.508 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -160.85 77.93 0.59 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.267 0.556 . . . . 0.0 110.541 179.049 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.548 HG21 ' SD ' ' A' ' 43' ' ' MET . 8.3 mm -148.46 158.78 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.747 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.455 ' N ' HG22 ' A' ' 57' ' ' ILE . 6.3 tpt180 -142.28 134.24 27.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.155 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.45 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -121.83 124.97 45.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.302 179.411 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -124.4 120.82 33.19 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.055 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -100.55 95.29 6.61 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.455 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.49 41.65 32.07 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.119 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.46 25.66 32.56 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.969 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -114.98 94.5 38.54 Favored Pre-proline 0 C--O 1.232 0.177 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -56.16 93.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.901 2.401 . . . . 0.0 112.458 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 27.1 pt -114.34 166.11 8.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.191 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -110.14 175.23 5.51 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.777 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.616 ' HB3' ' HE3' ' A' ' 43' ' ' MET . 1.4 pm0 -65.48 -14.9 62.0 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.654 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 80.5 p -91.08 29.39 1.4 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.51 ' CB ' HD12 ' A' ' 39' ' ' LEU . 3.0 t70 -73.59 167.48 21.26 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 120.407 0.146 . . . . 0.0 111.114 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.492 ' N ' ' HD2' ' A' ' 72' ' ' PRO . 17.2 m -169.0 -58.59 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 71' ' ' THR . 5.3 Cg_endo -47.24 -51.22 9.82 Favored 'Trans proline' 0 C--N 1.358 1.04 0 C-N-CA 122.943 2.428 . . . . 0.0 112.773 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.404 ' HB3' ' OD2' ' A' ' 70' ' ' ASP . . . -60.22 -41.16 92.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.053 0.454 . . . . 0.0 110.261 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -67.94 -33.14 74.11 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.092 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -75.68 -38.94 58.27 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 110.426 179.779 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.74 -40.66 88.81 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.059 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 30.9 mmt -70.61 176.35 4.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.322 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.696 ' O ' HG22 ' A' ' 17' ' ' ILE . 1.4 pm0 -129.71 -47.17 1.15 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.481 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -149.16 -64.54 0.23 Allowed 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 120.523 0.201 . . . . 0.0 111.219 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.62 106.73 2.28 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.006 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -145.76 117.28 8.04 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.832 0.349 . . . . 0.0 111.111 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.606 HG23 ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -115.22 146.26 41.61 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.467 -179.426 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.674 ' CD1' HG13 ' A' ' 21' ' ' VAL . 2.2 pp -146.88 161.33 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.586 179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -115.76 100.01 7.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.738 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 85' ' ' VAL . 14.3 p -79.85 113.59 19.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.164 0.506 . . . . 0.0 110.874 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -104.71 125.59 50.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.112 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.812 0.339 . . . . 0.0 111.177 179.967 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 C--O 1.234 0.264 0 CA-C-O 120.655 0.264 . . . . 0.0 110.968 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . 0.404 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 5.7 m170 -160.93 143.55 12.69 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.672 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.698 HG12 HG23 ' A' ' 33' ' ' ILE . 8.5 pt -92.45 129.6 42.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-O 121.152 0.501 . . . . 0.0 111.174 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -82.36 119.6 24.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.286 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.753 HD23 HD11 ' A' ' 83' ' ' ILE . 0.5 OUTLIER -129.93 124.74 33.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.079 179.668 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -107.93 108.87 20.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.261 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.9 t -81.07 113.1 19.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.036 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.404 ' O ' ' HA ' ' A' ' 84' ' ' ASP . . . -101.4 105.26 16.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.051 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.47 146.27 27.24 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.384 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -24.52 47.73 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.73 40.71 1.05 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.738 0.304 . . . . 0.0 111.455 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.29 39.04 89.62 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.061 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 t -102.05 114.56 28.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.778 0.289 . . . . 0.0 110.97 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.33 98.95 6.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.983 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -126.79 134.6 65.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -84.39 149.48 25.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -154.31 132.91 12.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.016 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.404 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -94.69 149.65 21.02 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.744 179.794 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.698 HG23 HG12 ' A' ' 17' ' ' ILE . 7.8 tp -157.12 148.52 10.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.563 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.4 pttt -76.96 165.77 24.23 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.947 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -101.23 48.88 0.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.126 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.05 32.83 0.34 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.198 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.45 149.25 22.33 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.94 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.16 170.31 17.36 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.786 2.324 . . . . 0.0 112.722 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.833 HD12 ' HB2' ' A' ' 70' ' ' ASP . 6.2 mt -58.14 -22.34 50.7 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.544 179.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 t -49.9 -39.2 39.06 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.638 0.256 . . . . 0.0 110.758 178.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -46.46 87.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.173 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 tp -70.66 -47.52 59.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.732 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -43.7 86.73 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.122 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -60.68 -50.76 72.19 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.949 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.65 -45.72 74.48 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.69 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.479 ' CE2' HG11 ' A' ' 85' ' ' VAL . 81.7 t80 -61.97 -45.41 93.77 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.248 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -69.53 -37.79 77.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -72.74 -37.63 67.66 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.164 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -63.77 -33.8 76.47 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.506 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -81.34 -75.13 0.3 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.612 0.244 . . . . 0.0 111.312 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.49 45.8 0.02 OUTLIER Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.9 mt -114.27 -160.31 0.73 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.713 0.292 . . . . 0.0 110.254 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.9 -179.49 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.905 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 mtm -100.04 30.61 3.67 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.093 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.46 0.26 8.24 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.543 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.32 77.75 0.63 Allowed 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 121.251 0.548 . . . . 0.0 110.242 179.266 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.543 HD13 ' O ' ' A' ' 56' ' ' GLN . 8.1 mm -144.28 156.7 15.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.668 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.407 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.2 tpt180 -158.65 126.84 5.22 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.972 179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.63 144.14 42.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.283 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.468 ' O ' HG22 ' A' ' 83' ' ' ILE . 4.7 mtt180 -131.66 135.98 47.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.109 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -123.85 113.63 18.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.532 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 t0 56.25 37.05 28.47 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.66 22.67 63.84 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 121.043 -0.599 . . . . 0.0 113.11 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -119.21 127.41 26.5 Favored Pre-proline 0 C--O 1.231 0.128 0 CA-C-N 116.775 0.287 . . . . 0.0 110.871 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.25 110.07 2.56 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.759 2.306 . . . . 0.0 112.34 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.511 HD12 ' CD1' ' A' ' 39' ' ' LEU . 31.4 pt -116.61 176.61 2.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.132 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -133.28 179.41 6.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.155 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.87 40.08 0.45 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.474 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -141.14 16.59 2.26 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.149 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.833 ' HB2' HD12 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -72.94 168.8 18.23 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 120.762 0.315 . . . . 0.0 111.453 -179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.38 -57.34 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.421 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -47.76 -51.42 9.82 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.433 2.089 . . . . 0.0 113.095 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.39 98.78 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.835 0.35 . . . . 0.0 110.73 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -29.34 69.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.267 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.98 -31.8 39.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 110.709 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.85 -40.49 95.54 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.28 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.49 149.27 25.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.94 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.81 51.34 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.844 0.354 . . . . 0.0 111.647 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -170.79 -54.4 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.131 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -142.07 95.03 2.74 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -127.98 135.14 49.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.146 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -117.23 133.45 55.98 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.73 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.753 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -123.96 165.01 21.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.859 -179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.476 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -129.43 104.04 7.26 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.767 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.479 HG11 ' CE2' ' A' ' 46' ' ' TYR . 14.6 p -86.46 117.48 31.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.132 0.492 . . . . 0.0 111.136 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . 0.476 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 79.6 m-85 -108.43 150.88 26.8 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.454 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.466 0.332 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.021 179.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.636 0.255 . . . . 0.0 110.941 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.99 124.1 16.43 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.904 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 32' ' ' LYS . 14.4 pt -80.23 126.51 39.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-O 120.958 0.409 . . . . 0.0 111.221 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -92.62 93.45 8.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.513 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.04 122.1 40.76 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.806 0.336 . . . . 0.0 111.006 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 103.56 13.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.577 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.441 HG11 ' CD1' ' A' ' 46' ' ' TYR . 17.2 t -88.69 110.52 21.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.205 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -116.36 111.81 20.61 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.9 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.0 149.63 22.33 Favored Glycine 0 C--N 1.333 0.393 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.545 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.08 -31.97 61.59 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -64.18 -28.2 69.59 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.411 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 114.12 48.3 0.57 Allowed Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.617 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -125.69 113.27 17.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.594 0.235 . . . . 0.0 110.998 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 m -112.29 125.71 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.228 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.51 168.2 23.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -122.61 95.66 4.72 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.04 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -92.85 137.5 32.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.01 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 35.3 mtpt -126.85 111.87 14.68 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.994 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.4 178.88 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.416 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 155.36 35.08 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.06 30.16 2.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.424 179.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -136.29 35.23 2.76 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.709 0.29 . . . . 0.0 110.808 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.6 t -145.93 138.22 13.59 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.743 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.41 156.51 8.17 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.694 2.263 . . . . 0.0 112.572 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.864 HD12 ' HB2' ' A' ' 70' ' ' ASP . 12.7 mt -54.03 -22.51 10.79 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.944 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 t -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.572 0.225 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.15 -53.66 55.6 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.655 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.9 tt -67.08 -41.37 86.5 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.791 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.421 ' HG2' ' HB3' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -56.0 -58.12 9.25 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.133 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -56.64 -42.2 78.5 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.83 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.58 -35.25 77.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.32 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.441 ' CD1' HG11 ' A' ' 21' ' ' VAL . 83.1 t80 -77.14 -52.14 9.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.601 -179.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 p -60.93 -39.22 88.62 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.573 0.225 . . . . 0.0 111.195 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.16 -40.96 77.86 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.035 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -72.67 -40.67 66.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -73.66 -66.47 0.7 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.389 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.28 46.73 0.05 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.081 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -123.08 -159.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.86 163.65 21.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.913 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 5.8 mtm -97.97 27.81 4.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -132.59 8.45 4.22 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.507 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.5 77.97 0.62 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-O 121.228 0.537 . . . . 0.0 110.233 179.084 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.507 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.7 mm -143.69 158.16 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.586 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 57' ' ' ILE . 4.1 tpt180 -142.12 123.38 14.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.145 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.666 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -107.13 136.04 47.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.655 179.494 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.4 mtm-85 -135.42 140.3 44.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.367 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.456 ' CD2' HG23 ' A' ' 83' ' ' ILE . 1.8 t80 -120.23 101.63 7.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.273 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.45 34.76 24.83 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.22 -179.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 102.26 -27.94 18.13 Favored Glycine 0 CA--C 1.522 0.485 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.983 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -68.51 113.44 15.61 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.906 0.353 . . . . 0.0 111.007 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -75.13 118.9 5.39 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.592 2.195 . . . . 0.0 112.366 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.601 HD12 ' CD1' ' A' ' 39' ' ' LEU . 25.3 pt -124.32 174.39 8.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.316 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -112.76 178.12 4.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.282 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HB3' ' HG2' ' A' ' 43' ' ' MET . 0.5 OUTLIER -84.24 16.69 2.86 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.673 179.567 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.15 15.72 7.27 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.575 0.226 . . . . 0.0 111.098 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.864 ' HB2' HD12 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -72.8 118.29 15.55 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.753 0.311 . . . . 0.0 110.832 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.468 ' HB ' ' HD3' ' A' ' 72' ' ' PRO . 0.7 OUTLIER -112.0 -50.46 0.05 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.063 -179.737 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.468 ' HD3' ' HB ' ' A' ' 71' ' ' THR . 74.3 Cg_exo -50.38 -58.45 1.68 Allowed 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 122.216 1.944 . . . . 0.0 112.513 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.1 -37.95 89.14 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.9 0.381 . . . . 0.0 110.038 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.6 tm0? -54.39 -45.24 72.83 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.547 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tt -76.32 -31.93 58.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.58 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.28 -27.97 57.11 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.11 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 29.9 mmt -60.13 168.55 1.89 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.723 0.297 . . . . 0.0 110.92 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.19 -62.01 1.31 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.138 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -156.41 -60.96 0.1 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.453 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.85 111.71 22.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.995 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -140.14 146.71 39.17 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.239 -179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.78 137.92 51.85 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.283 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.666 HD13 ' CE2' ' A' ' 59' ' ' PHE . 0.4 OUTLIER -152.33 158.71 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -131.17 120.02 22.71 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.649 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.4 p -85.68 120.95 36.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 121.048 0.451 . . . . 0.0 111.083 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -108.14 158.37 17.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.217 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.232 0.178 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.058 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 . . . . . 0 C--O 1.233 0.214 0 CA-C-O 120.775 0.321 . . . . 0.0 110.967 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m80 -146.76 158.97 44.04 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.154 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.553 HD11 HG13 ' A' ' 33' ' ' ILE . 12.8 pt -100.92 124.78 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.773 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -90.69 111.1 22.31 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.113 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.453 HD22 HG13 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -109.65 125.38 52.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.465 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.735 ' HB2' HG22 ' A' ' 82' ' ' THR . 8.3 mttp -95.91 104.68 16.63 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.366 179.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.628 ' HA ' HD12 ' A' ' 83' ' ' ILE . 12.6 t -89.31 120.11 37.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.158 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -118.08 92.14 3.75 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.03 166.03 49.7 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -84.75 48.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.73 0.3 . . . . 0.0 111.19 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -148.58 32.5 0.79 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.071 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.98 30.58 66.86 Favored Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.541 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.25 135.47 54.02 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.702 0.287 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 28' ' ' VAL . 15.6 m -144.23 103.71 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.194 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.3 t -125.13 141.52 44.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.185 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.85 102.75 12.56 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.99 0.424 . . . . 0.0 110.954 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.15 143.27 31.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.787 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -119.95 136.18 54.62 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.844 0.354 . . . . 0.0 111.27 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . 0.553 HG13 HD11 ' A' ' 17' ' ' ILE . 2.3 pt -135.12 179.55 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.022 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.7 159.46 26.65 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.69 43.59 1.1 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 110.932 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -151.3 35.46 0.58 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -148.44 141.91 15.82 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.752 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' HG23 ' A' ' 71' ' ' THR . 37.1 Cg_endo -65.19 173.59 5.96 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.728 2.285 . . . . 0.0 112.525 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.683 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.2 mt -56.1 -24.18 38.7 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.382 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.4 t -50.4 -40.52 50.2 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.342 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -58.72 -58.6 7.86 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.022 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 42' ' ' LEU . 1.3 tm? -59.44 -42.93 93.08 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.818 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . 0.469 ' HG2' ' CE1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -60.59 -54.7 42.28 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.141 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -60.7 -50.52 73.17 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.007 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.94 81.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.382 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.444 ' CZ ' HG11 ' A' ' 21' ' ' VAL . 67.7 t80 -69.61 -53.17 20.08 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -44.58 92.21 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.135 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.99 -45.59 92.22 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.851 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.77 78.55 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.126 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -74.9 -75.81 0.16 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.224 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.77 46.63 0.02 OUTLIER Glycine 0 C--N 1.334 0.45 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.196 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 mt -124.9 -163.26 1.16 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.625 0.25 . . . . 0.0 110.416 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.5 m -115.96 170.97 8.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.032 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ptm -102.38 22.89 12.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.432 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.67 15.72 2.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.568 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -160.62 78.03 0.62 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.168 179.174 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.568 HD13 ' O ' ' A' ' 56' ' ' GLN . 14.6 mm -146.44 157.98 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.604 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.447 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.7 tpt180 -142.93 109.0 5.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.328 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.469 ' CE1' ' HG2' ' A' ' 43' ' ' MET . 9.3 m-85 -105.23 151.17 24.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.342 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 56.2 mtt180 -146.21 136.87 24.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.882 0.372 . . . . 0.0 111.294 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . 0.586 ' HA ' HG22 ' A' ' 83' ' ' ILE . 67.0 t80 -96.58 94.81 7.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.155 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.03 35.78 20.38 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 112.9 -30.21 7.58 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.946 -0.645 . . . . 0.0 113.253 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -75.56 112.98 22.04 Favored Pre-proline 0 CA--C 1.533 0.312 0 CA-C-N 116.859 0.33 . . . . 0.0 111.431 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -59.96 137.62 77.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.914 2.409 . . . . 0.0 112.988 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.469 HD12 ' CD1' ' A' ' 39' ' ' LEU . 17.8 pt -147.56 158.68 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.996 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -137.44 176.18 8.94 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.302 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.85 81.35 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.316 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.0 t -177.66 -28.09 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.018 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.683 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.6 t70 -51.89 167.15 0.12 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.933 0.397 . . . . 0.0 111.733 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.471 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -162.17 -55.99 0.01 OUTLIER Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.263 179.844 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . 0.471 ' HD2' ' H ' ' A' ' 71' ' ' THR . 93.6 Cg_exo -45.19 -48.29 11.47 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.385 2.057 . . . . 0.0 112.806 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.36 87.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.056 0.455 . . . . 0.0 110.063 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . 0.664 ' HG2' ' HE3' ' A' ' 77' ' ' MET . 13.9 tm0? -58.25 -34.61 70.65 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.819 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -32.4 61.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.472 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -43.62 84.45 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.836 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . 0.664 ' HE3' ' HG2' ' A' ' 74' ' ' GLN . 3.8 ptt? -74.77 150.8 39.25 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.843 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.68 -43.9 0.48 Allowed 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.94 -67.74 0.93 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -179.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -94.46 127.59 40.47 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.869 0.366 . . . . 0.0 111.312 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -157.76 143.86 17.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.591 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . 0.735 HG22 ' HB2' ' A' ' 20' ' ' LYS . 57.8 p -137.36 149.06 46.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.915 0.388 . . . . 0.0 111.477 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' A' ' 21' ' ' VAL . 1.1 pp -154.6 152.76 9.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.619 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -109.79 133.11 53.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.127 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.515 ' O ' HG13 ' A' ' 85' ' ' VAL . 8.4 p -107.95 103.6 15.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.273 0.559 . . . . 0.0 111.239 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -103.38 169.07 8.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.653 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.233 0.207 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.162 179.892 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 . . . . . 0 C--O 1.233 0.19 0 CA-C-O 120.877 0.37 . . . . 0.0 110.94 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -144.77 152.02 39.73 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.653 HG22 ' O ' ' A' ' 78' ' ' GLU . 18.2 pt -98.86 124.32 52.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.119 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASN . . . . . 0.451 ' C ' HD22 ' A' ' 19' ' ' LEU . 29.5 m-20 -84.41 122.4 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.056 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LEU . . . . . 0.492 HD12 HD11 ' A' ' 83' ' ' ILE . 4.3 mm? -119.56 117.28 27.94 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.258 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 95.27 10.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.325 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' VAL . . . . . 0.649 HG22 HD12 ' A' ' 83' ' ' ILE . 21.3 t -83.88 122.1 37.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.3 -179.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.68 119.29 37.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.227 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . 0.403 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -83.6 136.38 14.91 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.752 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.23 -35.81 81.58 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -58.4 -32.68 68.86 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.292 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.89 45.67 0.2 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 121.193 -0.527 . . . . 0.0 112.389 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.52 160.8 38.66 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.662 0.268 . . . . 0.0 110.969 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.0 t -142.03 101.57 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' VAL . . . . . 0.401 ' HB ' ' CE1' ' A' ' 46' ' ' TYR . 21.4 t -105.59 147.17 11.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.075 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -114.86 122.77 47.34 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.221 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -129.99 146.36 51.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.92 144.42 51.0 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.37 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.8 pt -145.11 178.96 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.367 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.49 148.25 26.06 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.629 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.8 56.65 4.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.884 0.373 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -165.05 35.41 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.95 146.85 16.38 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-O 120.629 0.252 . . . . 0.0 111.307 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.4 161.63 7.09 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.051 2.5 . . . . 0.0 113.102 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.576 ' CD1' HD12 ' A' ' 66' ' ' ILE . 10.5 mt -59.74 -22.31 61.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.739 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.08 -31.36 18.68 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.245 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -61.63 2.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.902 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tt -66.78 -45.26 79.01 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.5 mmm -53.86 -41.55 67.62 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.328 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -66.09 -57.9 6.67 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.949 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 49' ' ' ARG . . . -59.55 -34.24 72.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.927 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.401 ' CE1' ' HB ' ' A' ' 29' ' ' VAL . 35.0 t80 -60.34 -60.81 3.22 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.231 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.52 -28.3 69.86 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.271 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.43 -56.6 4.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -57.13 -41.32 78.83 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.467 -179.636 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.16 -72.41 0.25 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.137 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.06 41.81 0.09 OUTLIER Glycine 0 C--N 1.335 0.492 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.779 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LEU . . . . . 0.609 HD22 ' N ' ' A' ' 52' ' ' LEU . 1.4 mm? -103.74 -152.5 0.45 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 110.559 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.83 122.44 47.67 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.747 0.308 . . . . 0.0 110.929 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.2 tpt -63.34 -26.43 68.76 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.487 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.3 25.9 7.75 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLN . . . . . 0.591 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.7 78.04 0.61 Allowed 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.126 0.488 . . . . 0.0 110.467 179.125 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.591 HD13 ' O ' ' A' ' 56' ' ' GLN . 20.2 mm -146.88 159.14 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.847 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ARG . . . . . 0.484 ' N ' HG22 ' A' ' 57' ' ' ILE . 1.9 ttm-85 -141.0 135.34 31.04 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.732 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' PHE . . . . . 0.425 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -120.96 143.03 49.22 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -135.04 119.33 17.78 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.378 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -107.15 103.52 12.94 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.268 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.74 38.2 29.34 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.91 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.94 28.52 49.97 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.159 -0.543 . . . . 0.0 112.966 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -124.72 107.1 29.11 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-N 116.849 0.324 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.06 129.34 32.82 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.082 2.521 . . . . 0.0 112.855 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . 0.576 HD12 ' CD1' ' A' ' 39' ' ' LEU . 11.0 pt -146.95 145.83 19.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.467 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -99.31 173.72 6.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.712 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.78 47.9 0.44 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.672 0.273 . . . . 0.0 111.608 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.5 p -148.35 18.01 1.06 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.572 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.53 ' CB ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -74.41 176.7 6.53 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -179.826 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.23 -56.7 0.01 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.365 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -48.37 -48.63 16.46 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.562 2.175 . . . . 0.0 112.887 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.15 -42.14 76.36 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.759 0.314 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.73 -37.99 74.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.684 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.69 -31.99 57.61 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.518 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.48 -30.93 67.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.831 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.5 mtt -62.47 170.78 2.24 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.407 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 0.653 ' O ' HG22 ' A' ' 17' ' ' ILE . 25.5 tt0 -137.92 -52.97 0.63 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.425 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -156.61 -61.71 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -96.82 120.47 37.21 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.755 0.312 . . . . 0.0 111.172 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 159.28 43.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.266 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -122.91 151.1 42.1 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.458 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' ILE . . . . . 0.649 HD12 HG22 ' A' ' 21' ' ' VAL . 1.2 mt -144.51 168.07 10.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.923 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ASP . . . . . 0.453 ' H ' HG22 ' A' ' 83' ' ' ILE . 16.4 m-20 -137.86 97.2 3.37 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.677 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' VAL . . . . . 0.503 HG12 HG12 ' A' ' 21' ' ' VAL . 13.4 p -82.08 119.8 32.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.033 0.444 . . . . 0.0 111.138 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -99.34 129.13 45.52 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.983 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 . . . . . 0 C--O 1.233 0.203 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.935 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 10.2 m120 . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 120.597 0.237 . . . . 0.0 111.493 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -94.0 116.27 28.69 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.767 0.318 . . . . 0.0 110.818 179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -142.22 146.14 34.88 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.823 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.465 HD12 HD11 ' A' ' 19' ' ' LEU . 16.5 pt -93.27 125.63 45.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.055 0.455 . . . . 0.0 111.208 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.2 m120 -94.18 89.37 5.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.836 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.465 HD11 HD12 ' A' ' 17' ' ' ILE . 6.8 mp -90.25 123.68 34.24 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.25 -179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -104.85 93.18 4.59 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.261 179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.755 HG22 HD13 ' A' ' 83' ' ' ILE . 31.9 t -85.52 125.34 40.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.17 -179.514 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.73 117.07 33.07 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.953 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.67 149.75 27.42 Favored Glycine 0 C--N 1.331 0.281 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.634 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -19.59 54.15 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 112.04 0.385 . . . . 0.0 112.04 179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -90.06 31.84 0.96 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 111.644 0.238 . . . . 0.0 111.644 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.24 41.07 94.69 Favored Glycine 0 C--N 1.338 0.655 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.846 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 5.2 t -115.67 127.32 55.09 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-O 120.607 0.242 . . . . 0.0 111.094 -179.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.3 m -117.09 115.29 48.4 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.289 0 CA-C-N 116.33 -0.396 . . . . 0.0 111.118 179.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.2 t -136.95 134.23 48.1 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.248 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -105.56 154.64 20.1 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.112 -0.494 . . . . 0.0 111.159 179.626 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -135.78 146.18 47.33 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.057 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -119.02 111.94 18.94 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.135 -0.484 . . . . 0.0 111.144 -179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.1 pt -145.86 178.87 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.262 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.2 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.4 159.98 18.51 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.729 179.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.86 31.86 2.54 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.331 179.659 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -128.31 31.6 5.01 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.49 -0.323 . . . . 0.0 111.127 179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -148.18 157.96 42.04 Favored Pre-proline 0 N--CA 1.465 0.315 0 CA-C-N 116.586 -0.279 . . . . 0.0 110.844 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.674 ' HA ' HG23 ' A' ' 71' ' ' THR . 57.8 Cg_endo -70.83 163.27 39.71 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.63 2.22 . . . . 0.0 112.645 -179.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.686 HD12 ' HB3' ' A' ' 70' ' ' ASP . 10.1 mt -66.15 -12.98 59.36 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.832 179.828 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 61.8 m -51.29 -33.81 30.39 Favored 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 120.524 0.202 . . . . 0.0 111.26 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.49 -56.43 5.41 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.559 -0.292 . . . . 0.0 110.958 179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.2 tp -61.81 -46.61 88.77 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.411 -0.359 . . . . 0.0 111.094 179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -48.7 80.51 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.122 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 3.8 mtpm? -61.77 -54.28 44.56 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.688 -0.233 . . . . 0.0 110.9 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -56.79 -34.71 67.91 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.409 -0.36 . . . . 0.0 111.462 179.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.466 ' CE1' HG11 ' A' ' 85' ' ' VAL . 39.4 t80 -74.65 -54.85 6.64 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.505 -0.316 . . . . 0.0 110.978 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.448 ' HA ' HD12 ' A' ' 52' ' ' LEU . 42.5 t -59.8 -41.24 90.77 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.295 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 18.6 tt0 -68.51 -37.06 79.72 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.317 -179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -77.65 -39.67 44.3 Favored 'General case' 0 CA--C 1.53 0.212 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.521 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.8 tp60 -67.11 -64.91 0.76 Allowed 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.348 -179.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.39 46.96 0.05 OUTLIER Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.869 -0.682 . . . . 0.0 112.063 -179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 47' ' ' SER . 2.6 mt -122.25 -161.39 0.93 Allowed 'General case' 0 C--O 1.234 0.253 0 N-CA-C 110.263 -0.273 . . . . 0.0 110.263 -179.876 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.406 ' O ' HD11 ' A' ' 57' ' ' ILE . 0.9 OUTLIER -123.59 166.92 14.65 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.384 -0.371 . . . . 0.0 110.915 179.86 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 68.7 mtp -96.08 24.51 5.54 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 116.251 -0.432 . . . . 0.0 111.308 179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 37.5 mtt85 -136.7 12.85 3.18 Favored 'General case' 0 CA--C 1.535 0.365 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.458 179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.597 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.5 OUTLIER -160.84 78.12 0.6 Allowed 'General case' 0 C--O 1.233 0.226 0 CA-C-O 121.121 0.486 . . . . 0.0 110.334 179.157 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.597 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.8 mm -141.94 156.86 20.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-N 115.565 -0.743 . . . . 0.0 111.037 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.412 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -156.89 116.28 3.42 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.944 179.617 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -95.8 123.6 39.44 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 116.333 -0.394 . . . . 0.0 110.721 179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -106.53 117.86 35.15 Favored 'General case' 0 C--O 1.232 0.15 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.253 -179.735 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -121.6 101.98 7.95 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-N 115.971 -0.559 . . . . 0.0 110.345 179.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.9 38.75 29.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.174 -179.581 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 76.84 25.35 64.9 Favored Glycine 0 CA--C 1.523 0.571 0 C-N-CA 121.111 -0.566 . . . . 0.0 113.102 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 62.1 mt-30 -125.51 91.11 49.39 Favored Pre-proline 0 C--O 1.233 0.19 0 CA-C-N 116.859 0.329 . . . . 0.0 110.737 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.2 115.82 2.63 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 123.01 2.474 . . . . 0.0 112.32 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.521 HD12 ' CD1' ' A' ' 39' ' ' LEU . 18.1 pt -117.51 140.92 38.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.218 0 CA-C-N 116.075 -0.512 . . . . 0.0 111.341 -179.913 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.7 m-80 -90.44 172.73 8.52 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.752 179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -66.79 -20.11 65.88 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.647 -0.251 . . . . 0.0 111.393 179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 21.7 p -85.93 28.06 0.83 Allowed 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 111.912 0.338 . . . . 0.0 111.912 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.686 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -84.34 168.02 16.0 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 120.658 0.266 . . . . 0.0 111.149 179.814 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.674 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -171.01 -57.85 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.427 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.253 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 87.9 Cg_exo -47.16 -50.28 11.35 Favored 'Trans proline' 0 C--N 1.356 0.933 0 C-N-CA 122.624 2.216 . . . . 0.0 113.009 -179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.96 -45.41 85.85 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.583 -0.281 . . . . 0.0 110.792 179.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 10.4 tt0 -60.87 -31.73 71.19 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.189 179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 7.0 tt -75.96 -37.22 58.82 Favored 'General case' 0 C--O 1.232 0.134 0 CA-C-O 120.807 0.337 . . . . 0.0 110.347 179.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 2.1 mt-10 -58.79 -33.87 70.83 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 115.927 -0.579 . . . . 0.0 111.03 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 16.1 mtt -64.6 169.56 4.81 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.396 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -111.71 -54.68 2.59 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.989 179.245 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.6 p-10 -175.01 -48.46 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.777 -0.192 . . . . 0.0 111.432 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -84.92 93.31 8.51 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.64 -0.254 . . . . 0.0 110.997 -179.775 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -141.14 138.25 33.33 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-O 120.903 0.383 . . . . 0.0 111.366 -179.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -108.87 142.23 39.78 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.22 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.755 HD13 HG22 ' A' ' 21' ' ' VAL . 0.1 OUTLIER -135.34 167.84 24.53 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.16 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.665 179.854 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.438 ' H ' HG22 ' A' ' 83' ' ' ILE . 65.4 m-20 -133.62 108.49 8.6 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.566 179.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.466 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.0 p -82.15 121.92 36.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-O 121.042 0.449 . . . . 0.0 111.203 -179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -123.14 167.45 13.67 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.319 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 34.0 mt-30 -126.09 99.08 5.75 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.733 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 11.9 mp0 -138.3 119.79 14.93 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-O 120.568 0.223 . . . . 0.0 111.537 -179.744 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . 0.401 ' O ' ' HB ' ' A' ' 90' ' ' THR . 0.0 OUTLIER -116.9 -53.09 2.51 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.233 -0.439 . . . . 0.0 110.919 179.344 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . 0.401 ' HB ' ' O ' ' A' ' 89' ' ' GLN . 63.5 m 69.58 96.14 0.07 Allowed 'General case' 0 N--CA 1.465 0.286 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.073 -179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -101.33 121.21 7.15 Favored Glycine 0 C--N 1.336 0.558 0 CA-C-N 115.975 -0.557 . . . . 0.0 112.825 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.13 0 CA-C-O 118.547 -1.14 . . . . 0.0 112.825 179.806 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 26.1 m-20 . . . . . 0 N--CA 1.492 1.653 0 CA-C-O 120.752 0.31 . . . . 0.0 111.422 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.2 107.46 7.24 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.638 179.844 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 m80 -135.83 158.79 43.54 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.049 -179.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.46 HD11 HG13 ' A' ' 33' ' ' ILE . 14.5 pt -96.63 124.63 49.5 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.272 179.92 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 20.0 m120 -89.17 91.01 8.62 Favored 'General case' 0 C--O 1.232 0.162 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.465 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 1.013 HD23 HD11 ' A' ' 83' ' ' ILE . 2.0 mp -107.43 124.23 49.56 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.282 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.878 ' HB2' HG22 ' A' ' 82' ' ' THR . 8.7 mttt -90.6 116.37 28.44 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.252 -0.431 . . . . 0.0 110.687 179.714 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 12.5 t -101.03 112.34 33.63 Favored 'Isoleucine or valine' 0 C--O 1.234 0.261 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.102 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.84 124.05 44.72 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.183 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.08 139.2 20.27 Favored Glycine 0 C--N 1.333 0.404 0 CA-C-N 116.046 -0.524 . . . . 0.0 112.511 179.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -58.61 -30.64 67.39 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -58.11 -32.26 67.95 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 120.56 0.219 . . . . 0.0 111.536 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 125.25 45.03 0.26 Allowed Glycine 0 C--N 1.334 0.422 0 C-N-CA 121.139 -0.553 . . . . 0.0 112.461 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.7 m -140.41 160.67 39.47 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.623 0.249 . . . . 0.0 110.89 -179.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.5 m -140.76 114.14 5.18 Favored 'Isoleucine or valine' 0 C--O 1.234 0.246 0 CA-C-O 120.818 0.342 . . . . 0.0 111.158 179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.3 t -113.67 140.59 33.25 Favored 'Isoleucine or valine' 0 C--O 1.232 0.182 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.259 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -90.15 113.46 25.22 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.902 179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -122.37 160.53 25.22 Favored 'General case' 0 CA--C 1.53 0.206 0 CA-C-N 116.362 -0.381 . . . . 0.0 110.989 179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.5 pttm -154.08 148.56 26.17 Favored 'General case' 0 C--O 1.235 0.303 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.388 -179.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.46 HG13 HD11 ' A' ' 17' ' ' ILE . 24.7 pt -146.91 178.04 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.08 -0.509 . . . . 0.0 111.321 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -87.43 148.38 25.01 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.419 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 7.5 tmm_? -82.95 55.64 3.16 Favored 'General case' 0 C--O 1.234 0.261 0 CA-C-O 120.962 0.41 . . . . 0.0 111.055 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 6.5 m170 -156.93 31.29 0.3 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.955 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -152.43 150.78 25.89 Favored Pre-proline 0 N--CA 1.463 0.218 0 CA-C-O 120.625 0.25 . . . . 0.0 111.32 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.5 Cg_endo -70.04 174.22 10.07 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 123.082 2.522 . . . . 0.0 112.794 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.687 HD11 HD12 ' A' ' 66' ' ' ILE . 9.5 mt -61.21 -24.77 66.58 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.7 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.77 -36.46 64.89 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.527 0.203 . . . . 0.0 110.763 179.817 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.65 -46.63 84.78 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.541 179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.434 ' HB2' HD13 ' A' ' 33' ' ' ILE . 3.4 tt -66.48 -51.71 53.86 Favored 'General case' 0 CA--C 1.529 0.164 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.976 179.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.448 ' HG3' ' CE1' ' A' ' 59' ' ' PHE . 5.4 ttp -60.28 -35.97 76.75 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.51 -0.313 . . . . 0.0 111.624 -179.684 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.0 mttt -62.89 -58.89 5.83 Favored 'General case' 0 C--O 1.232 0.137 0 CA-C-O 120.585 0.231 . . . . 0.0 110.777 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.41 -38.23 88.88 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 116.441 -0.345 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.597 ' CE2' HG11 ' A' ' 85' ' ' VAL . 77.1 t80 -66.36 -37.43 85.3 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-N 116.594 -0.276 . . . . 0.0 111.419 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.6 m -80.66 -31.38 36.43 Favored 'General case' 0 CA--C 1.531 0.217 0 N-CA-C 111.816 0.302 . . . . 0.0 111.816 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.0 -55.95 4.75 Favored 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 111.702 0.26 . . . . 0.0 111.702 -179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.95 -33.19 62.07 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.599 0.238 . . . . 0.0 111.372 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.449 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 3.7 tt0 -74.62 -54.82 6.72 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.389 -0.369 . . . . 0.0 111.274 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.25 -6.26 3.05 Favored Glycine 0 CA--C 1.522 0.51 0 C-N-CA 120.907 -0.663 . . . . 0.0 113.063 -179.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 17.5 mt -71.45 -167.72 0.27 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.923 0.392 . . . . 0.0 110.753 179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.7 m -116.1 159.53 21.6 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.255 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.56 29.73 2.2 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 116.026 -0.534 . . . . 0.0 111.075 179.364 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -132.49 6.67 4.12 Favored 'General case' 0 CA--C 1.535 0.377 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.582 ' O ' HD13 ' A' ' 57' ' ' ILE . 1.5 tt0 -160.79 77.7 0.59 Allowed 'General case' 0 N--CA 1.454 -0.253 0 CA-C-O 121.1 0.476 . . . . 0.0 110.427 179.336 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.582 HD13 ' O ' ' A' ' 56' ' ' GLN . 5.8 mm -147.21 155.99 10.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.726 179.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.9 ptm180 -159.59 154.91 25.36 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 116.286 -0.415 . . . . 0.0 111.213 179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.53 ' HB3' HD11 ' A' ' 66' ' ' ILE . 3.4 m-85 -120.48 155.49 33.46 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.974 179.896 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -143.57 119.42 10.58 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.196 -179.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.435 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 71.8 t80 -105.6 98.89 8.52 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.239 179.326 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 54.95 39.08 31.43 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-O 121.058 0.456 . . . . 0.0 111.162 -179.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.17 22.75 43.56 Favored Glycine 0 CA--C 1.522 0.527 0 C-N-CA 121.102 -0.571 . . . . 0.0 113.161 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.435 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 3.3 mt-30 -115.01 92.85 32.54 Favored Pre-proline 0 C--O 1.233 0.196 0 CA-C-N 116.991 0.396 . . . . 0.0 110.659 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -53.98 113.48 1.35 Allowed 'Trans proline' 0 C--N 1.349 0.585 0 C-N-CA 122.887 2.391 . . . . 0.0 111.99 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.687 HD12 HD11 ' A' ' 39' ' ' LEU . 21.5 pt -116.7 143.93 25.67 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.953 0.406 . . . . 0.0 111.461 -179.717 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -92.7 170.35 9.79 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.076 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -75.51 -3.19 32.66 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.688 179.45 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 20.9 p -96.21 18.13 14.33 Favored 'General case' 0 CA--C 1.535 0.396 0 N-CA-C 111.539 0.2 . . . . 0.0 111.539 179.861 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.576 ' CB ' HD12 ' A' ' 39' ' ' LEU . 11.2 t0 -72.92 160.09 32.68 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 -179.918 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.08 -55.49 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.415 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.54 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -51.25 -50.23 14.58 Favored 'Trans proline' 0 C--N 1.358 1.027 0 C-N-CA 122.394 2.063 . . . . 0.0 112.958 -179.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.18 -37.82 86.73 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-O 120.936 0.398 . . . . 0.0 110.755 179.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.09 -27.11 68.68 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 115.814 -0.63 . . . . 0.0 111.4 179.726 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.7 tp -79.4 -34.37 41.92 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-O 120.559 0.218 . . . . 0.0 110.565 179.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.5 mm-40 -65.4 -47.89 74.74 Favored 'General case' 0 CA--C 1.529 0.169 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.878 179.73 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -99.93 114.21 27.3 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.73 179.527 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.455 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.1 OUTLIER -152.73 69.68 0.87 Allowed 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 120.869 0.366 . . . . 0.0 111.794 -179.746 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.1 t0 -172.63 -69.38 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.245 -0.434 . . . . 0.0 110.963 179.237 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -143.07 92.2 2.36 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.6 179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -139.64 146.4 39.68 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.996 -179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.878 HG22 ' HB2' ' A' ' 20' ' ' LYS . 71.2 p -119.41 147.67 44.11 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.628 -179.304 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 1.013 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -133.2 167.06 27.5 Favored 'Isoleucine or valine' 0 C--O 1.234 0.269 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.813 179.549 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.413 ' H ' HG22 ' A' ' 83' ' ' ILE . 1.8 t0 -116.14 97.74 6.23 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.489 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.597 HG11 ' CE2' ' A' ' 46' ' ' TYR . 11.0 p -81.38 114.28 22.08 Favored 'Isoleucine or valine' 0 C--O 1.235 0.302 0 CA-C-O 121.269 0.557 . . . . 0.0 111.504 -179.753 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -98.8 131.44 44.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.667 179.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 15.2 mp0 -98.88 33.25 2.38 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.196 -0.456 . . . . 0.0 110.832 179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 68.44 153.62 0.1 Allowed 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.533 179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -73.83 144.75 45.38 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.965 -179.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -136.83 84.07 2.04 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.062 -179.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 74.81 -156.87 49.88 Favored Glycine 0 CA--C 1.52 0.381 0 C-N-CA 120.929 -0.653 . . . . 0.0 112.929 179.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.113 0 CA-C-O 118.56 -1.133 . . . . 0.0 112.556 179.946 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.6 m120 . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 120.633 0.254 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -152.92 92.9 1.69 Allowed 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.075 -179.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.1 m80 -153.89 125.53 7.63 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.156 -0.474 . . . . 0.0 110.755 -179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 20.3 pt -80.95 129.87 36.81 Favored 'Isoleucine or valine' 0 C--O 1.233 0.209 0 CA-C-O 120.886 0.374 . . . . 0.0 111.234 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 6.6 p-10 -89.74 113.42 24.94 Favored 'General case' 0 N--CA 1.463 0.221 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.289 -179.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.8 mp -122.83 133.2 54.44 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.257 -179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.673 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.0 OUTLIER -101.62 112.93 25.65 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.45 179.565 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.826 HG22 HD11 ' A' ' 83' ' ' ILE . 16.3 t -90.5 124.4 43.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.07 -179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -105.7 115.48 30.32 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.125 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.74 149.82 32.04 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.691 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -54.56 -33.5 60.27 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.416 0.287 . . . . 0.0 111.552 179.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -96.45 32.3 2.04 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 69.75 53.67 15.02 Favored Glycine 0 C--N 1.336 0.53 0 C-N-CA 120.949 -0.643 . . . . 0.0 112.966 179.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.4 t -107.29 101.18 10.58 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.545 0.212 . . . . 0.0 110.891 179.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -97.63 109.25 23.13 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-O 120.735 0.302 . . . . 0.0 111.344 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.3 t -139.78 151.99 22.4 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.51 -179.693 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.4 tt0 -112.47 147.55 36.29 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.316 179.733 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -142.62 137.94 30.37 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.106 179.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 5.5 mtpt -110.11 116.21 31.13 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.869 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 3.7 pt -133.95 178.45 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.485 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -94.99 156.48 16.3 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.821 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -92.48 39.62 1.03 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 116.4 -0.364 . . . . 0.0 111.39 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 7.6 m80 -147.17 33.39 0.9 Allowed 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.74 0.305 . . . . 0.0 111.133 179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -142.07 155.41 65.33 Favored Pre-proline 0 C--O 1.232 0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 110.828 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.415 ' HA ' HG23 ' A' ' 71' ' ' THR . 54.8 Cg_endo -69.13 165.97 28.42 Favored 'Trans proline' 0 C--N 1.349 0.561 0 C-N-CA 122.526 2.151 . . . . 0.0 112.243 179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.719 HD11 HD12 ' A' ' 66' ' ' ILE . 10.4 mt -58.21 -24.39 58.99 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.112 179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 24.7 p -53.39 -32.89 51.55 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 116.612 -0.267 . . . . 0.0 111.362 179.444 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -62.57 -58.96 5.7 Favored 'General case' 0 N--CA 1.463 0.189 0 CA-C-N 116.824 -0.171 . . . . 0.0 110.694 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.7 tt -61.63 -39.6 91.88 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.475 -0.329 . . . . 0.0 110.636 179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -66.6 -43.1 85.76 Favored 'General case' 0 CA--C 1.529 0.14 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.352 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 13.2 mmmt -63.51 -38.67 92.01 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.767 179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -75.19 -34.2 61.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.666 -0.243 . . . . 0.0 111.579 179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.579 ' CE1' HG11 ' A' ' 85' ' ' VAL . 53.5 t80 -80.86 -37.11 30.48 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 111.61 0.226 . . . . 0.0 111.61 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.8 t -79.39 -41.08 28.56 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 111.726 0.269 . . . . 0.0 111.726 -179.395 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -72.67 -45.05 60.86 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 116.733 -0.212 . . . . 0.0 111.519 -179.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 21.5 ttm180 -62.22 -35.65 79.56 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 116.61 -0.268 . . . . 0.0 111.299 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.434 ' HB2' ' O ' ' A' ' 46' ' ' TYR . 1.9 tt0 -75.47 -66.86 0.72 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.665 -0.243 . . . . 0.0 111.078 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 133.16 46.21 0.11 Allowed Glycine 0 C--N 1.336 0.536 0 C-N-CA 120.886 -0.673 . . . . 0.0 112.188 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 13.7 mt -112.2 -154.38 0.54 Allowed 'General case' 0 C--O 1.233 0.198 0 N-CA-C 110.357 -0.238 . . . . 0.0 110.357 179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.6 166.1 10.69 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.946 0.403 . . . . 0.0 111.284 -179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.64 -36.75 9.04 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.221 179.85 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.9 28.53 2.69 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.69 -179.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.444 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -160.67 77.56 0.6 Allowed 'General case' 0 N--CA 1.454 -0.252 0 CA-C-O 121.104 0.478 . . . . 0.0 110.28 178.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.473 HG22 ' N ' ' A' ' 58' ' ' ARG . 10.0 mm -152.02 158.64 4.34 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 115.428 -0.805 . . . . 0.0 110.511 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.473 ' N ' HG22 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -156.64 129.95 8.05 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-O 120.957 0.408 . . . . 0.0 111.21 179.307 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -106.4 136.99 45.19 Favored 'General case' 0 C--N 1.332 -0.185 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.655 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 2.1 ttt180 -113.47 121.32 43.94 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.256 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.0 t80 -113.61 89.07 2.99 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.321 179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 54.99 39.09 31.48 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.05 -179.477 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.88 23.19 39.47 Favored Glycine 0 CA--C 1.522 0.518 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.081 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -119.82 92.68 46.85 Favored Pre-proline 0 C--O 1.233 0.216 0 CA-C-N 116.976 0.388 . . . . 0.0 110.603 179.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_exo -54.09 106.82 0.18 Allowed 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.957 2.438 . . . . 0.0 112.25 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.719 HD12 HD11 ' A' ' 39' ' ' LEU . 14.3 pt -111.47 133.41 57.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.374 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -87.68 177.04 7.15 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.74 -0.663 . . . . 0.0 110.825 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.447 ' O ' ' HB3' ' A' ' 40' ' ' SER . 1.2 pm0 -83.49 23.74 0.91 Allowed 'General case' 0 CA--C 1.537 0.46 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 179.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 53.9 p -126.6 13.97 7.55 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 122.508 -0.12 . . . . 0.0 111.284 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.713 ' HB2' HD12 ' A' ' 39' ' ' LEU . 1.0 OUTLIER -73.44 175.78 6.67 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 120.649 0.261 . . . . 0.0 111.297 -179.887 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.415 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -168.43 -55.19 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.31 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.351 179.9 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -49.6 -50.18 13.79 Favored 'Trans proline' 0 C--N 1.356 0.944 0 C-N-CA 122.39 2.06 . . . . 0.0 113.16 -179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.01 -44.86 87.81 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 120.67 0.271 . . . . 0.0 110.86 179.744 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -57.18 -39.51 75.47 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.763 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.8 tt -81.88 -33.22 30.64 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.002 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.2 mt-10 -56.51 -29.88 62.37 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.46 -0.336 . . . . 0.0 111.361 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.3 mtt -62.77 170.96 2.31 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-O 120.85 0.357 . . . . 0.0 111.249 179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 -117.34 -51.49 2.52 Favored 'General case' 0 N--CA 1.464 0.26 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.253 179.653 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.07 -56.36 0.02 OUTLIER 'General case' 0 C--O 1.231 0.102 0 CA-C-O 120.657 0.265 . . . . 0.0 111.032 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -83.1 107.68 15.84 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.66 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -150.44 157.6 43.21 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.266 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.673 HG22 ' HB2' ' A' ' 20' ' ' LYS . 21.9 p -146.09 149.04 33.3 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-N 116.367 -0.379 . . . . 0.0 111.377 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.826 HD11 HG22 ' A' ' 21' ' ' VAL . 1.2 pp -144.26 160.57 15.29 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.241 0 CA-C-N 116.008 -0.542 . . . . 0.0 110.967 179.36 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.61 106.8 14.95 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.026 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.579 HG11 ' CE1' ' A' ' 46' ' ' TYR . 9.6 p -79.91 114.99 21.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.249 0 CA-C-O 121.126 0.489 . . . . 0.0 110.996 179.738 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.412 ' O ' ' HG3' ' A' ' 58' ' ' ARG . 3.8 m-85 -110.7 169.38 8.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.973 -179.576 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 76.2 mm-40 -130.02 156.7 44.05 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.348 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -129.18 139.23 51.98 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.212 -179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 8.5 mt-30 -133.69 125.43 28.61 Favored 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.802 179.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -73.57 -60.08 2.41 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.528 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.62 -42.34 1.6 Allowed Glycine 0 C--N 1.336 0.548 0 C-N-CA 120.968 -0.634 . . . . 0.0 112.727 -179.687 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.033 0 CA-C-O 118.468 -1.184 . . . . 0.0 112.743 179.918 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 120.495 0.188 . . . . 0.0 111.202 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 63.14 97.77 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.05 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -141.33 164.71 29.52 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.039 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.45 HG22 ' O ' ' A' ' 78' ' ' GLU . 16.3 pt -105.71 124.55 60.85 Favored 'Isoleucine or valine' 0 C--O 1.233 0.235 0 CA-C-O 120.975 0.417 . . . . 0.0 111.202 179.694 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -85.57 122.73 30.11 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.883 -0.598 . . . . 0.0 111.113 -179.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 4.7 mp -119.44 134.17 55.35 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.371 -0.377 . . . . 0.0 111.366 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.568 ' HB2' HG22 ' A' ' 82' ' ' THR . 11.6 mmtt -104.91 94.01 5.03 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.456 179.782 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.766 HG22 HD11 ' A' ' 83' ' ' ILE . 16.4 t -83.45 112.11 20.54 Favored 'Isoleucine or valine' 0 C--O 1.233 0.186 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.156 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -104.24 112.42 25.44 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.053 179.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -79.95 128.57 8.58 Favored Glycine 0 C--N 1.333 0.379 0 C-N-CA 120.973 -0.632 . . . . 0.0 112.398 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -57.1 -36.0 70.11 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 120.509 0.195 . . . . 0.0 111.197 179.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -62.31 -30.54 71.22 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.132 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 123.53 57.47 0.19 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.026 -0.607 . . . . 0.0 112.581 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.1 m -149.76 107.57 3.69 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 120.709 0.29 . . . . 0.0 111.041 -179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.4 HG13 ' O ' ' A' ' 28' ' ' VAL . 13.2 p -107.99 123.39 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.226 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.231 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.1 t -139.96 138.72 37.93 Favored 'Isoleucine or valine' 0 C--O 1.233 0.21 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.111 -179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -92.55 130.67 38.14 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.879 179.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -115.9 158.93 22.25 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.13 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 4.8 mtpm? -132.35 94.8 3.5 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.955 179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.423 HD13 HD23 ' A' ' 42' ' ' LEU . 4.2 pt -115.27 179.43 1.49 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.25 179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -95.9 166.55 11.73 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.838 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.0 33.2 1.36 Allowed 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.148 179.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -145.3 28.71 1.19 Allowed 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.12 179.775 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.6 p -135.58 131.25 19.23 Favored Pre-proline 0 C--O 1.231 0.131 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.61 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' HG23 ' A' ' 71' ' ' THR . 40.5 Cg_exo -56.77 164.68 5.66 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 122.654 2.236 . . . . 0.0 112.509 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.794 HD11 HD12 ' A' ' 66' ' ' ILE . 9.8 mt -55.54 -23.47 26.81 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.402 -0.363 . . . . 0.0 111.307 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.4 p -52.44 -42.57 64.26 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.697 -0.229 . . . . 0.0 111.04 179.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.23 -49.41 77.96 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-O 120.637 0.256 . . . . 0.0 110.772 179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 42' ' ' LEU . 0.3 OUTLIER -65.58 -48.59 71.85 Favored 'General case' 0 N--CA 1.462 0.132 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.635 179.617 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -60.74 -50.87 71.73 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.243 179.936 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 66.4 mttt -57.47 -56.01 27.35 Favored 'General case' 0 C--N 1.332 -0.153 0 CA-C-N 116.434 -0.348 . . . . 0.0 110.814 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -58.7 -42.07 87.76 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.305 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.616 ' CE2' HG11 ' A' ' 85' ' ' VAL . 70.5 t80 -62.79 -51.64 66.31 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.224 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.472 ' HA ' HD12 ' A' ' 52' ' ' LEU . 97.1 p -63.31 -44.05 96.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.925 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -65.37 -37.17 86.2 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.955 179.674 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 18.8 mtp85 -74.25 -41.1 61.83 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.463 -0.335 . . . . 0.0 111.267 179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -75.0 -67.12 0.68 Allowed 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 116.547 -0.297 . . . . 0.0 111.285 -179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 147.53 45.97 0.03 OUTLIER Glycine 0 C--N 1.334 0.441 0 C-N-CA 120.893 -0.67 . . . . 0.0 112.202 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.472 HD12 ' HA ' ' A' ' 47' ' ' SER . 0.9 OUTLIER -128.62 -163.42 1.28 Allowed 'General case' 0 CA--C 1.531 0.23 0 CA-C-O 120.743 0.306 . . . . 0.0 110.644 -179.9 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 3.0 m -138.39 174.57 10.41 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.222 -0.445 . . . . 0.0 111.004 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.0 ttp -96.32 30.3 2.56 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.007 179.372 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.5 tpp180 -115.97 -5.58 11.99 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.71 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.652 ' O ' HD13 ' A' ' 57' ' ' ILE . 5.6 tt0 -160.23 78.02 0.65 Allowed 'General case' 0 N--CA 1.453 -0.288 0 CA-C-O 121.219 0.533 . . . . 0.0 110.156 179.519 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.652 HD13 ' O ' ' A' ' 56' ' ' GLN . 15.5 mm -142.31 157.48 19.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 115.397 -0.819 . . . . 0.0 110.76 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.433 ' N ' HG22 ' A' ' 57' ' ' ILE . 4.7 tpt180 -153.6 117.07 4.64 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.173 -0.467 . . . . 0.0 111.023 179.666 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 3.5 m-85 -98.95 143.31 29.39 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.343 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 25.4 mtt180 -133.75 134.57 43.11 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.344 -179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -117.6 104.98 11.57 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.401 179.677 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 58.58 37.05 25.44 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.012 -179.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 82.6 25.37 50.67 Favored Glycine 0 CA--C 1.522 0.519 0 C-N-CA 121.02 -0.61 . . . . 0.0 113.042 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -119.77 101.43 48.12 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-N 116.803 0.302 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -53.32 122.06 10.54 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.99 2.46 . . . . 0.0 112.74 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.794 HD12 HD11 ' A' ' 39' ' ' LEU . 15.0 pt -138.24 154.95 28.54 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.228 -179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 36.9 m-20 -95.06 178.79 5.43 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.593 179.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.446 ' OE2' HG23 ' A' ' 69' ' ' THR . 0.0 OUTLIER -83.87 28.85 0.57 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.605 -0.27 . . . . 0.0 111.429 179.267 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . 0.446 HG23 ' OE2' ' A' ' 68' ' ' GLU . 41.8 p -120.38 6.24 10.66 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 111.417 0.155 . . . . 0.0 111.417 179.541 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.75 ' HB2' HD12 ' A' ' 39' ' ' LEU . 3.2 t70 -62.02 163.14 8.25 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.863 0.363 . . . . 0.0 111.462 -179.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.459 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -166.04 -56.72 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.286 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.212 179.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_exo -49.27 -42.17 40.82 Favored 'Trans proline' 0 C--N 1.356 0.942 0 C-N-CA 122.509 2.14 . . . . 0.0 112.728 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -72.76 -41.3 65.25 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.582 179.278 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -58.19 -37.57 75.02 Favored 'General case' 0 CA--C 1.531 0.217 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.909 179.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.22 -31.29 49.26 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.737 179.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -58.97 -34.48 71.85 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.944 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 17.7 mmt -66.62 173.67 3.29 Favored 'General case' 0 CA--C 1.53 0.202 0 CA-C-N 116.43 -0.35 . . . . 0.0 111.324 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.45 ' O ' HG22 ' A' ' 17' ' ' ILE . 0.7 OUTLIER -126.19 -52.35 1.52 Allowed 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.22 -179.931 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -148.94 -58.09 0.21 Allowed 'General case' 0 C--N 1.334 -0.107 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.307 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -80.69 121.68 26.18 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.102 -179.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 41.9 t0 -151.89 109.24 3.58 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.905 -179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.568 HG22 ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -100.16 137.16 38.99 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.354 -179.622 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.766 HD11 HG22 ' A' ' 21' ' ' VAL . 0.5 OUTLIER -142.82 162.43 17.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.337 179.939 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -129.36 112.75 14.16 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.983 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.616 HG11 ' CE2' ' A' ' 46' ' ' TYR . 7.7 p -82.66 101.38 7.32 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 121.236 0.541 . . . . 0.0 110.778 179.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -89.82 164.46 14.62 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.123 -179.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 60.0 mm-40 -121.15 128.45 52.52 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.969 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.6 tp60 -67.59 -51.99 43.81 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.346 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 56.88 67.94 0.92 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.35 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -146.63 -60.34 0.3 Allowed 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.049 179.809 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 87.62 -134.19 12.3 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 120.959 -0.638 . . . . 0.0 112.45 -179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.023 0 CA-C-O 118.438 -1.201 . . . . 0.0 112.51 179.964 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.6 m120 . . . . . 0 N--CA 1.491 1.583 0 CA-C-O 120.693 0.282 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -77.84 87.34 4.06 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.3 -179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.407 ' HB3' ' HG2' ' A' ' 32' ' ' LYS . 13.7 m80 -156.31 109.94 2.71 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.661 179.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.476 HG13 HD11 ' A' ' 19' ' ' LEU . 21.3 pt -81.95 130.1 36.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-O 121.091 0.472 . . . . 0.0 111.31 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.4 m120 -92.31 132.16 36.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.55 -0.75 . . . . 0.0 111.456 -179.507 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.476 HD11 HG13 ' A' ' 17' ' ' ILE . 4.9 mp -137.94 132.07 31.81 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-N 116.196 -0.457 . . . . 0.0 111.082 179.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.66 100.47 11.17 Favored 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.487 179.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.7 t -82.72 117.76 29.22 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.323 -179.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.89 115.97 26.01 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.899 179.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.17 143.72 24.18 Favored Glycine 0 C--N 1.332 0.323 0 C-N-CA 121.027 -0.606 . . . . 0.0 112.824 -179.68 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 5.3 pt20 -60.23 -27.65 67.38 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 112.512 0.56 . . . . 0.0 112.512 -179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.62 39.1 1.03 Allowed 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 112.523 0.564 . . . . 0.0 112.523 -178.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.71 93.44 0.04 OUTLIER Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.026 -0.607 . . . . 0.0 113.588 178.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 62.1 p -168.44 161.68 11.93 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 120.802 0.334 . . . . 0.0 111.538 179.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.498 HG13 ' O ' ' A' ' 28' ' ' VAL . 8.3 p -152.27 109.65 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.14 179.717 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 19.7 t -137.62 135.28 46.31 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 116.271 -0.422 . . . . 0.0 111.222 -179.659 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 -104.71 139.62 39.25 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.118 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -128.72 153.12 47.67 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.196 179.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.407 ' HG2' ' HB3' ' A' ' 16' ' ' HIS . 2.7 tttt -129.46 124.14 33.31 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.904 179.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 30.3 pt -140.47 177.02 4.39 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.278 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.61 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.14 152.6 34.82 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.198 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.7 tmm_? -88.32 55.53 3.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 120.983 0.42 . . . . 0.0 111.16 179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -172.03 40.89 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.934 179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.2 t -149.33 142.59 16.09 Favored Pre-proline 0 CA--C 1.531 0.223 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.032 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.465 ' CA ' HG23 ' A' ' 71' ' ' THR . 55.4 Cg_endo -69.37 167.78 22.93 Favored 'Trans proline' 0 C--N 1.35 0.643 0 C-N-CA 122.795 2.33 . . . . 0.0 112.613 179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.649 HD12 ' CB ' ' A' ' 70' ' ' ASP . 12.4 mt -66.51 -12.83 59.5 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.285 -0.416 . . . . 0.0 111.851 179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.3 t -53.97 -36.23 62.65 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 120.605 0.24 . . . . 0.0 111.285 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -81.82 -39.09 24.51 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.374 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.503 HD23 ' CD2' ' A' ' 39' ' ' LEU . 20.3 tp -68.23 -40.9 81.91 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 120.76 0.314 . . . . 0.0 110.547 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.488 ' HG3' ' CD1' ' A' ' 59' ' ' PHE . 2.0 ttm -67.14 -34.39 77.49 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.19 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.1 mttt -69.93 -47.8 60.98 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-O 120.635 0.255 . . . . 0.0 110.828 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.05 -43.89 97.86 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.263 179.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.593 ' CE2' HG11 ' A' ' 85' ' ' VAL . 88.5 t80 -59.99 -44.52 94.46 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.861 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -66.4 -38.82 88.34 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 116.387 -0.369 . . . . 0.0 111.119 179.799 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.1 tt0 -74.96 -38.83 61.61 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.377 -0.374 . . . . 0.0 111.603 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -67.03 -46.6 73.93 Favored 'General case' 0 N--CA 1.464 0.251 0 N-CA-C 111.935 0.346 . . . . 0.0 111.935 -179.444 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -68.35 -64.6 0.83 Allowed 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.706 -0.224 . . . . 0.0 111.528 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 146.77 47.0 0.03 OUTLIER Glycine 0 C--N 1.332 0.318 0 C-N-CA 120.923 -0.656 . . . . 0.0 112.267 -179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.6 mt -127.33 -161.0 1.04 Allowed 'General case' 0 C--O 1.233 0.235 0 N-CA-C 110.157 -0.312 . . . . 0.0 110.157 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -120.96 157.89 28.92 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.769 0.318 . . . . 0.0 110.954 179.821 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.8 mtm -97.62 29.51 3.3 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.122 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -127.24 4.74 6.36 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.549 -0.296 . . . . 0.0 111.628 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.481 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.69 77.75 0.6 Allowed 'General case' 0 N--CA 1.452 -0.337 0 CA-C-O 121.147 0.499 . . . . 0.0 110.314 179.634 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.481 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.4 mm -147.12 158.96 9.47 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.408 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.663 179.893 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.47 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.7 ptp85 -154.92 145.45 22.21 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.239 179.319 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.488 ' CD1' ' HG3' ' A' ' 43' ' ' MET . 2.8 m-85 -117.28 164.78 14.3 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 116.096 -0.502 . . . . 0.0 111.006 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.1 mtt85 -148.96 119.77 7.58 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.157 179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 74.9 t80 -91.43 94.77 9.64 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.453 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 56.23 39.73 30.16 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.945 -179.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 85.92 21.37 53.17 Favored Glycine 0 CA--C 1.524 0.596 0 CA-C-N 115.961 -0.563 . . . . 0.0 113.336 -179.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -108.79 114.87 58.17 Favored Pre-proline 0 C--O 1.232 0.142 0 CA-C-N 116.97 0.385 . . . . 0.0 110.373 179.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -53.96 96.71 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 122.825 2.35 . . . . 0.0 112.329 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.412 HD11 ' HB3' ' A' ' 59' ' ' PHE . 10.7 pt -114.32 133.75 59.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.272 -179.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 63.9 m-80 -90.66 176.25 6.73 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.057 -0.519 . . . . 0.0 110.935 -179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -65.77 -15.88 63.27 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.575 -0.284 . . . . 0.0 111.509 179.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 6.6 p -89.42 32.74 0.84 Allowed 'General case' 0 CA--C 1.535 0.375 0 CA-C-O 120.563 0.22 . . . . 0.0 111.543 179.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.649 ' CB ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -74.25 155.7 37.99 Favored 'General case' 0 CA--C 1.527 0.079 0 CA-C-O 120.484 0.183 . . . . 0.0 110.793 179.752 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.465 HG23 ' CA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -166.0 -57.15 0.01 OUTLIER Pre-proline 0 N--CA 1.467 0.376 0 CA-C-N 116.409 -0.359 . . . . 0.0 111.434 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -46.67 -53.66 5.85 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.48 2.12 . . . . 0.0 113.152 -179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.62 -44.34 96.54 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-O 120.757 0.313 . . . . 0.0 111.045 179.689 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -60.42 -32.07 70.99 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.137 179.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -77.99 -33.2 51.46 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.688 0.28 . . . . 0.0 110.537 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -58.66 -41.34 85.87 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.286 -0.415 . . . . 0.0 110.766 179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.87 -177.3 1.94 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.227 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -148.35 -59.21 0.24 Allowed 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.432 -0.349 . . . . 0.0 111.415 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -136.85 23.34 3.09 Favored 'General case' 0 CA--C 1.531 0.222 0 N-CA-C 111.652 0.241 . . . . 0.0 111.652 -179.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -166.14 93.71 0.53 Allowed 'General case' 0 C--O 1.233 0.208 0 CA-C-O 120.788 0.328 . . . . 0.0 111.346 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.401 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 39.7 t0 -121.34 109.22 14.64 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.67 179.514 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 1.2 p -91.81 125.4 36.51 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.398 -179.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.476 HD13 ' HE2' ' A' ' 59' ' ' PHE . 0.9 OUTLIER -145.49 146.31 19.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.224 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.389 179.793 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -109.25 107.3 17.48 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.003 -0.544 . . . . 0.0 110.91 -179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.593 HG11 ' CE2' ' A' ' 46' ' ' TYR . 9.0 p -80.79 112.84 19.33 Favored 'Isoleucine or valine' 0 C--O 1.233 0.205 0 CA-C-O 121.243 0.544 . . . . 0.0 111.159 179.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 6.6 m-85 -96.47 158.86 15.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.954 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -139.19 151.69 46.79 Favored 'General case' 0 CA--C 1.53 0.189 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.731 -179.348 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -117.45 157.45 26.21 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.999 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 13.4 mt-30 60.27 31.62 20.51 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.114 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -142.84 -53.07 0.39 Allowed 'General case' 0 C--O 1.233 0.206 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.709 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -131.26 97.77 0.37 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 121.216 -0.516 . . . . 0.0 112.329 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.181 0 CA-C-O 118.723 -1.043 . . . . 0.0 112.91 -179.962 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 120.76 0.314 . . . . 0.0 111.532 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -113.97 164.22 14.08 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.389 -0.369 . . . . 0.0 110.613 179.636 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 12.5 m170 -139.36 129.66 25.44 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.467 -0.333 . . . . 0.0 111.134 -179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.676 HG22 ' O ' ' A' ' 78' ' ' GLU . 18.8 pt -80.29 126.51 39.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.166 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.118 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -85.94 106.21 16.97 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.039 -0.528 . . . . 0.0 111.348 -179.539 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.614 HD13 HD22 ' A' ' 42' ' ' LEU . 0.3 OUTLIER -105.23 125.23 50.75 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.416 179.866 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.4 mppt? -93.17 90.27 6.78 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.138 179.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.454 ' HA ' HD12 ' A' ' 83' ' ' ILE . 18.8 t -81.52 100.16 5.31 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 116.347 -0.388 . . . . 0.0 111.152 -179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -102.27 111.93 24.42 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.18 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.24 146.31 27.6 Favored Glycine 0 N--CA 1.45 -0.37 0 C-N-CA 120.953 -0.641 . . . . 0.0 112.455 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.04 55.76 1.86 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.826 0.346 . . . . 0.0 111.064 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -178.14 41.17 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.276 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 66.72 73.79 0.61 Allowed Glycine 0 C--N 1.336 0.57 0 C-N-CA 121.094 -0.574 . . . . 0.0 113.073 179.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 9.4 p -166.53 106.22 0.64 Allowed 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 116.761 0.281 . . . . 0.0 111.43 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 4.8 m -122.52 108.48 21.73 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.244 0 CA-C-O 120.944 0.402 . . . . 0.0 111.302 179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.1 t -121.01 149.93 23.95 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.294 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.316 -179.617 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.96 113.85 26.91 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.159 179.741 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -104.78 150.32 24.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.05 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 2.0 mttp -130.74 124.62 31.88 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.41 -179.728 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 4.1 pt -145.85 -180.0 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.395 179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -77.13 152.43 34.92 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.114 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.07 59.49 2.69 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-O 121.167 0.508 . . . . 0.0 111.04 179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -168.62 39.84 0.03 OUTLIER 'General case' 0 C--O 1.234 0.262 0 CA-C-N 115.782 -0.645 . . . . 0.0 110.677 179.684 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 4.9 t -151.27 145.01 17.56 Favored Pre-proline 0 CA--C 1.532 0.266 0 CA-C-N 115.987 -0.551 . . . . 0.0 111.021 -179.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 36.3 Cg_endo -64.34 163.92 24.86 Favored 'Trans proline' 0 C--N 1.352 0.716 0 C-N-CA 122.99 2.46 . . . . 0.0 112.509 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.773 HD23 HD21 ' A' ' 42' ' ' LEU . 12.3 mt -56.61 -27.45 58.2 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 116.325 -0.398 . . . . 0.0 112.046 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 19.3 p -51.66 -36.35 45.91 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 111.635 0.235 . . . . 0.0 111.635 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.9 tptt -58.48 -63.46 1.27 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.556 0.217 . . . . 0.0 110.927 179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.773 HD21 HD23 ' A' ' 39' ' ' LEU . 3.5 pp -65.53 -29.42 70.06 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.488 -0.323 . . . . 0.0 110.867 179.465 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.5 mmt -59.21 -49.06 79.28 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-O 120.607 0.241 . . . . 0.0 110.618 179.337 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 5.6 mtpm? -66.57 -39.1 88.32 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.876 179.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -69.33 -45.77 68.68 Favored 'General case' 0 CA--C 1.529 0.139 0 CA-C-N 116.445 -0.343 . . . . 0.0 111.506 179.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -61.86 -47.04 86.8 Favored 'General case' 0 N--CA 1.464 0.225 0 CA-C-N 116.554 -0.293 . . . . 0.0 111.111 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.422 ' HA ' HD12 ' A' ' 52' ' ' LEU . 42.3 p -62.08 -37.73 86.12 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.748 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.8 tt0 -76.01 -38.9 56.76 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.424 -0.353 . . . . 0.0 111.412 179.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.24 -52.65 64.69 Favored 'General case' 0 N--CA 1.466 0.342 0 N-CA-C 111.824 0.305 . . . . 0.0 111.824 -179.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.7 mm-40 -73.45 -70.19 0.38 Allowed 'General case' 0 N--CA 1.464 0.27 0 CA-C-O 120.714 0.292 . . . . 0.0 111.514 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 156.05 46.09 0.02 OUTLIER Glycine 0 C--N 1.331 0.287 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.068 -179.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.422 HD12 ' HA ' ' A' ' 47' ' ' SER . 1.5 mt -119.43 -159.92 0.79 Allowed 'General case' 0 CA--C 1.53 0.208 0 N-CA-C 110.043 -0.354 . . . . 0.0 110.043 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -128.32 161.36 29.58 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.628 -0.26 . . . . 0.0 110.85 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.08 27.81 3.47 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.121 179.425 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 mtt180 -131.09 8.49 4.75 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 111.868 0.321 . . . . 0.0 111.868 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.494 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.21 77.71 0.64 Allowed 'General case' 0 C--O 1.232 0.17 0 CA-C-O 121.251 0.548 . . . . 0.0 110.08 178.999 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.494 HD13 ' O ' ' A' ' 56' ' ' GLN . 10.8 mm -144.8 158.39 14.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.383 0 CA-C-N 115.251 -0.886 . . . . 0.0 110.636 179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 57' ' ' ILE . 26.2 ttt85 -149.53 141.71 24.04 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.033 179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 1.7 m-85 -119.29 160.7 21.72 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.387 -0.37 . . . . 0.0 110.894 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 48.7 mtt180 -146.17 109.99 4.89 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.392 -0.367 . . . . 0.0 111.464 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.621 ' HA ' HG22 ' A' ' 83' ' ' ILE . 56.7 t80 -89.27 101.91 14.58 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 116.361 -0.382 . . . . 0.0 110.118 179.083 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 t0 53.13 40.61 31.51 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.979 -179.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 99.39 -35.15 4.89 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.936 -0.65 . . . . 0.0 112.961 -179.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -70.44 112.77 14.01 Favored Pre-proline 0 CA--C 1.533 0.326 0 CA-C-N 116.658 0.229 . . . . 0.0 111.269 -179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_endo -73.2 144.45 37.31 Favored 'Trans proline' 0 C--N 1.352 0.722 0 C-N-CA 122.74 2.293 . . . . 0.0 112.873 -179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.544 ' N ' HD13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -144.94 173.87 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.245 0 CA-C-N 116.156 -0.475 . . . . 0.0 111.356 179.593 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 -109.16 178.52 4.43 Favored 'General case' 0 C--O 1.233 0.217 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.456 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 5.8 mt-10 -68.82 -12.78 61.89 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-N 116.416 -0.357 . . . . 0.0 111.431 179.582 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 23.8 p -89.79 28.32 1.37 Allowed 'General case' 0 N--CA 1.468 0.444 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.678 ' CB ' HD12 ' A' ' 39' ' ' LEU . 9.2 t0 -76.15 169.04 18.94 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-O 120.647 0.26 . . . . 0.0 111.183 179.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -171.3 -54.82 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.367 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -45.89 -53.31 5.86 Favored 'Trans proline' 0 C--N 1.358 1.033 0 C-N-CA 122.669 2.246 . . . . 0.0 113.242 179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.503 ' HA ' ' HG2' ' A' ' 76' ' ' GLU . . . -61.3 -35.45 77.38 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 121.12 0.486 . . . . 0.0 110.647 179.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.421 HE22 HD23 ' A' ' 39' ' ' LEU . 0.0 OUTLIER -73.49 -26.21 60.8 Favored 'General case' 0 CA--C 1.535 0.39 0 CA-C-N 115.541 -0.754 . . . . 0.0 111.477 179.567 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.443 HD22 ' HA ' ' A' ' 75' ' ' LEU . 0.3 OUTLIER -85.94 -36.61 19.76 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-O 120.621 0.248 . . . . 0.0 110.976 179.972 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . 0.503 ' HG2' ' HA ' ' A' ' 73' ' ' ALA . 11.5 pt-20 -66.23 -34.53 78.22 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.991 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.491 ' HE1' HD11 ' A' ' 19' ' ' LEU . 0.0 OUTLIER -69.28 178.18 2.48 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.4 -0.364 . . . . 0.0 110.822 179.661 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.676 ' O ' HG22 ' A' ' 17' ' ' ILE . 17.5 tt0 -136.48 -64.54 0.59 Allowed 'General case' 0 N--CA 1.462 0.135 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.066 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -134.24 -48.17 0.78 Allowed 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.318 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -92.76 114.37 26.91 Favored 'General case' 0 CA--C 1.529 0.151 0 CA-C-O 120.691 0.281 . . . . 0.0 111.418 -179.584 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -138.8 137.83 37.01 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.67 179.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -123.33 130.01 52.13 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.48 -179.403 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.621 HG22 ' HA ' ' A' ' 61' ' ' PHE . 1.2 pp -147.84 152.43 12.72 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.292 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.145 179.537 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -111.23 111.54 22.67 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.122 -179.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 85' ' ' VAL . 11.7 p -82.62 111.8 19.49 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 CA-C-O 121.253 0.549 . . . . 0.0 111.369 179.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -97.97 152.27 19.42 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.015 -179.744 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 9.3 mt-30 -128.73 121.85 29.37 Favored 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 116.418 -0.356 . . . . 0.0 111.059 179.913 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -68.63 156.94 37.2 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 116.211 -0.45 . . . . 0.0 111.589 -179.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -112.91 177.82 4.5 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 116.092 -0.504 . . . . 0.0 111.442 179.968 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 19.3 m 75.76 -64.78 0.35 Allowed 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.784 -0.644 . . . . 0.0 111.474 -179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 98.01 108.5 2.71 Favored Glycine 0 C--N 1.336 0.549 0 C-N-CA 120.861 -0.685 . . . . 0.0 112.779 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.099 0 CA-C-O 118.519 -1.156 . . . . 0.0 112.516 179.58 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.557 0 CA-C-O 120.695 0.283 . . . . 0.0 111.284 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -116.3 105.87 13.03 Favored 'General case' 0 C--O 1.233 0.2 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.346 -179.683 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 60.5 m80 -152.27 138.44 18.31 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.049 -0.523 . . . . 0.0 110.882 179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.628 HG22 ' HB2' ' A' ' 78' ' ' GLU . 25.4 pt -80.91 130.53 35.72 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 116.471 -0.331 . . . . 0.0 111.037 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.605 ' O ' HD13 ' A' ' 19' ' ' LEU . 2.8 m-20 -106.31 111.91 24.7 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.029 -179.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.899 HD12 ' HB3' ' A' ' 81' ' ' ASP . 0.4 OUTLIER -124.48 136.4 53.98 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.785 179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 9.4 mttp -97.25 97.4 9.13 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.248 -0.433 . . . . 0.0 110.318 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.553 HG22 HD11 ' A' ' 83' ' ' ILE . 24.3 t -82.5 108.49 15.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.009 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.55 123.56 38.06 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.237 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -81.96 153.27 32.43 Favored Glycine 0 CA--C 1.518 0.276 0 C-N-CA 121.065 -0.588 . . . . 0.0 112.458 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -28.0 53.55 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 111.586 0.217 . . . . 0.0 111.586 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -93.59 29.79 1.92 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 111.72 0.267 . . . . 0.0 111.72 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 62.43 72.6 0.63 Allowed Glycine 0 C--N 1.337 0.588 0 C-N-CA 121.028 -0.606 . . . . 0.0 113.098 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 17.9 m -150.5 92.97 1.91 Allowed 'General case' 0 N--CA 1.463 0.219 0 CA-C-O 120.756 0.312 . . . . 0.0 111.245 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.489 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.5 p -91.35 113.98 27.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-O 120.933 0.397 . . . . 0.0 111.054 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -116.61 138.65 46.5 Favored 'Isoleucine or valine' 0 C--O 1.232 0.184 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.159 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -86.24 143.93 27.69 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.141 -0.481 . . . . 0.0 111.129 179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -138.0 149.3 45.97 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.114 179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 6.4 mmmt -135.51 115.7 13.38 Favored 'General case' 0 N--CA 1.466 0.37 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.161 -179.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.544 HD12 ' O ' ' A' ' 34' ' ' LYS . 1.2 pt -147.16 -179.83 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.468 0.442 0 CA-C-O 120.834 0.349 . . . . 0.0 111.559 179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.544 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.13 151.43 25.73 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.156 -0.475 . . . . 0.0 110.848 179.783 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.435 ' HD2' HD13 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -93.16 29.16 1.95 Allowed 'General case' 0 N--CA 1.466 0.361 0 CA-C-O 120.797 0.332 . . . . 0.0 111.517 179.668 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 17.5 t-80 -122.44 37.48 4.38 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.981 0.42 . . . . 0.0 110.449 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 14.7 t -154.64 142.63 14.19 Favored Pre-proline 0 CA--C 1.531 0.232 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.631 -179.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.697 ' HA ' HG23 ' A' ' 71' ' ' THR . 33.9 Cg_endo -64.06 168.83 11.55 Favored 'Trans proline' 0 C--N 1.351 0.689 0 C-N-CA 122.656 2.237 . . . . 0.0 112.34 179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.638 HD11 HD12 ' A' ' 66' ' ' ILE . 13.1 mt -55.0 -24.65 25.26 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.617 -179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.5 t -51.72 -39.61 58.72 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 120.556 0.217 . . . . 0.0 111.254 179.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.1 ttmt -60.16 -54.95 39.84 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.602 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 3.8 tp -65.99 -34.15 77.44 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.84 179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.404 ' HG2' ' CE2' ' A' ' 59' ' ' PHE . 0.1 OUTLIER -59.87 -61.19 2.8 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.604 -0.271 . . . . 0.0 110.957 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.7 mttt -59.52 -40.74 88.11 Favored 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.205 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -65.06 -44.38 89.15 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 120.667 0.27 . . . . 0.0 111.373 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 61.7 t80 -65.68 -39.0 90.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.323 -0.399 . . . . 0.0 111.489 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.483 ' HA ' HD12 ' A' ' 52' ' ' LEU . 17.7 m -79.09 -48.27 14.65 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.541 -0.299 . . . . 0.0 111.358 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -58.69 -37.63 76.48 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.102 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 22.1 mtt180 -68.85 -45.05 72.09 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.437 -0.347 . . . . 0.0 111.31 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.01 -66.89 0.58 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.481 -179.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 145.87 46.77 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 121.046 -0.597 . . . . 0.0 112.038 -179.649 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.483 HD12 ' HA ' ' A' ' 47' ' ' SER . 1.6 mt -120.6 -159.32 0.79 Allowed 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 110.293 -0.262 . . . . 0.0 110.293 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -120.7 125.85 48.7 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.79 0.329 . . . . 0.0 110.91 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -61.5 -21.27 64.07 Favored 'General case' 0 CA--C 1.532 0.274 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.44 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.4 ttt180 -90.73 17.98 7.0 Favored 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.562 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.49 77.9 0.62 Allowed 'General case' 0 C--N 1.339 0.113 0 CA-C-O 121.289 0.566 . . . . 0.0 110.438 178.531 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.562 HD13 ' O ' ' A' ' 56' ' ' GLN . 13.5 mm -148.17 158.67 7.77 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 115.404 -0.816 . . . . 0.0 110.721 179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.471 ' N ' HG22 ' A' ' 57' ' ' ILE . 17.7 ttt85 -150.19 142.42 24.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.163 -0.471 . . . . 0.0 111.054 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.564 ' CD1' HD12 ' A' ' 83' ' ' ILE . 4.9 m-85 -117.82 130.77 56.48 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.419 179.518 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 22.1 mmm-85 -116.59 102.31 9.36 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.238 -0.437 . . . . 0.0 110.784 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -90.44 105.1 17.59 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.726 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 45.18 43.37 7.78 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.914 0.486 . . . . 0.0 111.906 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . 0.448 ' O ' ' HD3' ' A' ' 65' ' ' PRO . . . 82.86 2.17 90.64 Favored Glycine 0 CA--C 1.526 0.724 0 C-N-CA 121.071 -0.585 . . . . 0.0 113.318 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.2 mt-30 -99.47 104.55 27.9 Favored Pre-proline 0 CA--C 1.531 0.243 0 CA-C-N 117.21 0.505 . . . . 0.0 110.842 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.448 ' HD3' ' O ' ' A' ' 63' ' ' GLY . 52.9 Cg_exo -56.02 121.72 10.5 Favored 'Trans proline' 0 C--N 1.349 0.602 0 C-N-CA 122.999 2.466 . . . . 0.0 112.366 -179.904 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.638 HD12 HD11 ' A' ' 39' ' ' LEU . 24.6 pt -131.67 150.32 33.89 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.334 -0.393 . . . . 0.0 111.603 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -109.59 165.86 11.34 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.264 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -57.85 -26.1 61.61 Favored 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 116.341 -0.391 . . . . 0.0 111.412 179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -63.87 -14.48 53.63 Favored 'General case' 0 CA--C 1.535 0.38 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.784 179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.568 ' CB ' HD12 ' A' ' 39' ' ' LEU . 5.8 t70 -53.32 150.63 6.12 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 121.033 0.444 . . . . 0.0 111.655 -179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.697 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -163.35 -56.27 0.01 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.151 179.862 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_exo -51.52 -52.34 9.23 Favored 'Trans proline' 0 C--N 1.357 1.007 0 C-N-CA 122.46 2.107 . . . . 0.0 112.71 -179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.8 -35.99 79.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-O 120.992 0.425 . . . . 0.0 110.509 179.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.3 tt0 -69.33 -21.62 63.83 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.432 179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.435 HD13 ' HD2' ' A' ' 35' ' ' ARG . 1.1 mm? -78.07 -36.95 47.63 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 110.146 -0.316 . . . . 0.0 110.146 179.072 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -70.02 -36.38 75.04 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 116.081 -0.509 . . . . 0.0 110.858 179.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 8.1 mmt -106.76 97.02 6.86 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.328 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.628 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -139.96 67.91 1.37 Allowed 'General case' 0 CA--C 1.529 0.167 0 CA-C-N 116.26 -0.427 . . . . 0.0 111.408 -179.462 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.9 t70 -173.29 -64.07 0.02 OUTLIER 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.977 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -135.2 83.22 2.01 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.477 179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.899 ' HB3' HD12 ' A' ' 19' ' ' LEU . 11.8 t70 -127.07 135.17 50.41 Favored 'General case' 0 CA--C 1.53 0.197 0 CA-C-N 116.119 -0.491 . . . . 0.0 110.878 -179.572 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 30.2 p -115.98 144.32 44.24 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.405 -179.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.564 HD12 ' CD1' ' A' ' 59' ' ' PHE . 2.4 pt -141.05 165.13 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.187 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.604 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -115.57 104.65 11.94 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.748 179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.475 ' O ' HG13 ' A' ' 85' ' ' VAL . 13.3 p -80.17 115.5 22.74 Favored 'Isoleucine or valine' 0 C--O 1.233 0.212 0 CA-C-O 121.168 0.509 . . . . 0.0 111.418 -179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 2.8 m-85 -109.14 154.2 22.66 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.066 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 -142.56 157.17 44.99 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.138 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -67.18 -33.31 75.12 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.956 179.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 11.7 mt-30 -102.66 179.98 4.14 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-N 116.483 -0.326 . . . . 0.0 110.934 179.888 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 44.9 p -115.6 37.59 3.54 Favored 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.264 -0.426 . . . . 0.0 111.162 179.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 126.74 -151.04 18.03 Favored Glycine 0 C--N 1.333 0.407 0 C-N-CA 120.79 -0.719 . . . . 0.0 112.555 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.126 0 CA-C-O 118.405 -1.219 . . . . 0.0 112.664 179.884 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 21.3 m-20 . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 120.816 0.341 . . . . 0.0 111.063 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -139.02 176.41 8.71 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.148 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.482 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 47.2 m80 -142.88 160.57 40.08 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.729 0.3 . . . . 0.0 111.21 -179.93 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.73 HG12 HG23 ' A' ' 33' ' ' ILE . 6.8 pt -108.14 122.06 62.02 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 CA-C-O 121.1 0.476 . . . . 0.0 110.98 179.748 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 7.5 m-20 -80.33 102.04 9.32 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 115.84 -0.618 . . . . 0.0 111.339 -179.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 1.1 mp -103.57 138.17 40.62 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-O 120.873 0.368 . . . . 0.0 111.571 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -96.61 100.04 11.63 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.781 -0.645 . . . . 0.0 110.237 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.483 HG22 HD11 ' A' ' 83' ' ' ILE . 22.4 t -83.39 93.8 3.12 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.742 -179.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -94.59 125.23 39.11 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.286 -179.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -101.77 161.2 17.77 Favored Glycine 0 C--N 1.332 0.315 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.593 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -92.32 43.11 1.12 Allowed 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 120.944 0.402 . . . . 0.0 110.852 179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.92 34.38 0.21 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.4 179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.12 56.68 7.65 Favored Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.713 179.874 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 p -140.83 98.28 3.36 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.723 0.297 . . . . 0.0 111.185 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 2.8 m -115.07 92.65 2.18 Favored 'Isoleucine or valine' 0 C--O 1.233 0.226 0 CA-C-O 120.944 0.402 . . . . 0.0 110.928 179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.6 t -121.84 145.69 28.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.239 0 CA-C-N 115.987 -0.552 . . . . 0.0 111.321 -179.573 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -118.2 116.9 27.75 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.111 179.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -114.72 170.6 8.2 Favored 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.134 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.482 ' HG2' ' HB2' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -110.41 151.99 26.82 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.084 -179.932 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.73 HG23 HG12 ' A' ' 17' ' ' ILE . 6.2 tp -158.64 149.0 8.11 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.302 0 CA-C-N 116.119 -0.491 . . . . 0.0 111.247 -179.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.7 144.84 26.34 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.794 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 3.1 ptp85 -81.92 57.67 3.56 Favored 'General case' 0 N--CA 1.467 0.383 0 CA-C-O 120.97 0.414 . . . . 0.0 111.021 179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.95 23.73 0.66 Allowed 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.461 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.516 HG22 ' HD2' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -162.17 148.93 11.02 Favored Pre-proline 0 N--CA 1.465 0.307 0 CA-C-O 120.512 0.196 . . . . 0.0 110.764 179.912 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.516 ' HD2' HG22 ' A' ' 37' ' ' THR . 50.7 Cg_exo -54.08 161.18 5.28 Favored 'Trans proline' 0 C--N 1.352 0.733 0 C-N-CA 122.886 2.39 . . . . 0.0 112.59 179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.686 HD12 ' HB3' ' A' ' 70' ' ' ASP . 11.0 mt -61.28 -17.22 52.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.363 -0.381 . . . . 0.0 111.875 179.827 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -52.05 -37.58 54.12 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.478 0.18 . . . . 0.0 111.082 179.545 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.33 -43.01 88.02 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.625 -0.261 . . . . 0.0 110.893 179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -72.8 -47.42 46.62 Favored 'General case' 0 CA--C 1.529 0.165 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.879 179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 11.6 tmm? -59.65 -44.51 93.5 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.488 -0.324 . . . . 0.0 111.252 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.8 mttt -59.5 -49.71 76.71 Favored 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.746 179.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -66.33 -34.6 78.34 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.47 -0.332 . . . . 0.0 111.491 179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -72.5 -53.32 12.4 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.458 -0.337 . . . . 0.0 111.503 -179.626 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 1.5 m -60.21 -43.72 95.72 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.473 -0.33 . . . . 0.0 111.147 -179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -61.27 -42.88 99.38 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 120.706 0.289 . . . . 0.0 110.827 179.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -41.3 97.8 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 116.288 -0.415 . . . . 0.0 111.437 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -78.48 -71.99 0.4 Allowed 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.672 0.273 . . . . 0.0 111.242 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 155.24 45.58 0.02 OUTLIER Glycine 0 C--N 1.332 0.36 0 C-N-CA 121.118 -0.563 . . . . 0.0 112.151 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.4 mt -127.24 -164.94 1.41 Allowed 'General case' 0 C--O 1.233 0.225 0 CA-C-O 120.695 0.283 . . . . 0.0 110.516 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.2 m -143.72 176.45 9.23 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.979 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 16.2 ptt? -93.59 28.13 2.41 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.307 -0.406 . . . . 0.0 111.266 179.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 10.2 ptm180 -118.31 -3.67 10.98 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.063 0.394 . . . . 0.0 112.063 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.564 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -160.48 77.92 0.63 Allowed 'General case' 0 N--CA 1.453 -0.321 0 CA-C-O 121.192 0.52 . . . . 0.0 110.206 179.456 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.564 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.6 mm -144.98 157.86 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 115.243 -0.889 . . . . 0.0 110.921 179.852 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.436 ' N ' HG22 ' A' ' 57' ' ' ILE . 5.6 tpt180 -141.2 121.98 14.38 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.226 -0.443 . . . . 0.0 110.873 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 4.5 m-85 -111.8 127.47 55.82 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.507 179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.2 mmt180 -127.49 103.31 7.28 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.423 -179.543 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.855 ' HA ' HG22 ' A' ' 83' ' ' ILE . 61.3 t80 -81.12 101.38 9.59 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.249 -0.432 . . . . 0.0 110.021 179.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 56.01 35.04 24.85 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.099 -179.19 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 103.71 -38.14 3.39 Favored Glycine 0 C--N 1.335 0.528 0 C-N-CA 121.004 -0.617 . . . . 0.0 113.132 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.03 110.61 3.41 Favored Pre-proline 0 CA--C 1.533 0.319 0 CA-C-N 116.671 0.235 . . . . 0.0 111.202 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -71.17 129.5 16.21 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 123.086 2.524 . . . . 0.0 112.787 -179.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 2.5 pp -145.79 163.07 11.15 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.276 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.494 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 1.9 m120 -103.86 177.32 4.88 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.993 -0.549 . . . . 0.0 110.854 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 12.6 pm0 -64.73 -17.79 64.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.584 179.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 18.3 p -88.81 33.39 0.78 Allowed 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 111.742 0.275 . . . . 0.0 111.742 -179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.686 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.9 OUTLIER -83.46 177.46 8.45 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-O 120.658 0.266 . . . . 0.0 111.312 179.77 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.409 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -169.89 -54.25 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.316 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.333 -179.962 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.409 ' HD2' ' H ' ' A' ' 71' ' ' THR . 82.9 Cg_exo -47.63 -57.28 2.42 Favored 'Trans proline' 0 C--N 1.357 0.994 0 C-N-CA 122.409 2.073 . . . . 0.0 112.802 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -60.95 -41.87 97.13 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-O 120.78 0.324 . . . . 0.0 110.692 179.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.4 ' HB2' ' HG ' ' A' ' 39' ' ' LEU . 20.3 tm0? -57.27 -41.42 79.7 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.9 179.487 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -80.3 -32.44 38.05 Favored 'General case' 0 N--CA 1.461 0.123 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.733 179.379 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -29.3 60.65 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.923 179.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.6 mtt -65.16 173.92 2.25 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.966 0.412 . . . . 0.0 111.283 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.488 ' O ' HG22 ' A' ' 17' ' ' ILE . 14.5 pt-20 -135.2 -49.54 0.74 Allowed 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.412 179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -169.41 -41.72 0.02 OUTLIER 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.494 -0.321 . . . . 0.0 111.246 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.2 tt0 -108.35 106.87 17.21 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-O 120.717 0.294 . . . . 0.0 111.02 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -152.94 161.9 41.98 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.199 179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 7.7 t -140.43 156.8 46.25 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.323 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.855 HG22 ' HA ' ' A' ' 61' ' ' PHE . 0.8 OUTLIER -143.72 157.99 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.237 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.158 179.982 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -115.81 92.88 4.04 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.517 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.535 HG13 HD12 ' A' ' 83' ' ' ILE . 34.3 m -83.95 111.3 19.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.254 0 CA-C-O 121.135 0.493 . . . . 0.0 111.592 -179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -99.24 156.4 16.99 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.728 -0.669 . . . . 0.0 111.103 -179.763 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 16.6 mt-30 -132.04 148.43 52.5 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.417 -0.356 . . . . 0.0 111.145 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 7.1 mm100 -95.67 173.56 7.42 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.41 -0.359 . . . . 0.0 110.91 179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.96 38.42 3.94 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.476 -179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.63 94.08 0.05 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.268 -0.424 . . . . 0.0 111.432 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -100.92 -154.46 26.85 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 120.993 -0.622 . . . . 0.0 113.048 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.195 0 CA-C-O 118.671 -1.072 . . . . 0.0 113.119 -179.933 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.489 1.511 0 CA-C-O 120.685 0.278 . . . . 0.0 111.217 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -151.04 145.18 25.34 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.927 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m170 -124.47 116.8 23.1 Favored 'General case' 0 C--N 1.333 -0.131 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.569 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.593 HG22 ' HA ' ' A' ' 79' ' ' ASP . 8.1 pt -86.48 117.0 30.13 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.225 0 CA-C-O 120.843 0.354 . . . . 0.0 111.136 -179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 43.2 p-10 -90.02 92.56 9.04 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.309 0.576 . . . . 0.0 111.211 -179.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 10.0 mp -93.24 126.71 38.49 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 115.817 -0.629 . . . . 0.0 111.417 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 6.2 mmtp -84.18 128.45 34.57 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.808 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.553 HG22 HD11 ' A' ' 83' ' ' ILE . 21.8 t -109.94 114.38 46.84 Favored 'Isoleucine or valine' 0 C--O 1.233 0.232 0 CA-C-O 120.796 0.332 . . . . 0.0 111.334 -179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -103.0 120.81 41.3 Favored 'General case' 0 C--N 1.333 -0.145 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.985 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.33 144.7 26.01 Favored Glycine 0 C--N 1.332 0.313 0 C-N-CA 121.013 -0.613 . . . . 0.0 112.691 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.402 ' OE1' ' HA ' ' A' ' 86' ' ' PHE . 5.2 pm0 -54.98 -33.07 62.19 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 111.573 0.212 . . . . 0.0 111.573 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.0 t0 -70.0 -25.84 63.79 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.691 -0.231 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 128.87 -5.53 6.49 Favored Glycine 0 CA--C 1.527 0.783 0 C-N-CA 121.098 -0.573 . . . . 0.0 113.059 -179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 55.1 p -66.85 154.24 41.42 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 120.873 0.368 . . . . 0.0 111.536 -179.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -141.13 108.53 2.28 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.931 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.3 t -122.23 146.13 27.88 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.168 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 -104.32 148.66 26.12 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.215 -179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -148.66 151.08 34.33 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.083 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 1.6 ptmm? -136.0 134.72 38.84 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.089 179.928 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.744 HG12 HD12 ' A' ' 42' ' ' LEU . 4.7 pt -145.35 178.11 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.286 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.365 179.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -84.03 139.7 32.34 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.62 179.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.39 54.74 2.68 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 120.853 0.359 . . . . 0.0 111.109 -179.959 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.425 ' HD2' HD21 ' A' ' 75' ' ' LEU . 0.0 OUTLIER -158.97 32.87 0.21 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.274 179.901 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -151.92 157.19 34.39 Favored Pre-proline 0 N--CA 1.466 0.358 0 CA-C-O 120.632 0.253 . . . . 0.0 111.142 179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.575 ' HA ' HG23 ' A' ' 71' ' ' THR . 32.1 Cg_exo -58.32 163.98 9.46 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.932 2.421 . . . . 0.0 112.775 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.754 HD12 ' HB3' ' A' ' 70' ' ' ASP . 7.8 mt -62.46 -23.32 66.83 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.699 179.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 1.2 m -52.93 -32.1 43.8 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.831 -0.168 . . . . 0.0 111.335 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.85 -53.23 60.26 Favored 'General case' 0 N--CA 1.463 0.201 0 CA-C-O 120.652 0.263 . . . . 0.0 110.867 179.728 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.744 HD12 HG12 ' A' ' 33' ' ' ILE . 0.7 OUTLIER -75.18 -35.76 61.52 Favored 'General case' 0 CA--C 1.531 0.22 0 CA-C-N 116.323 -0.398 . . . . 0.0 110.897 179.478 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.585 ' HE1' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -62.51 -52.0 65.2 Favored 'General case' 0 N--CA 1.463 0.202 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.365 -179.873 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 25.6 mttm -60.31 -52.84 63.56 Favored 'General case' 0 C--N 1.332 -0.161 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.77 179.915 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -54.76 -34.52 62.68 Favored 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.248 179.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -71.49 -54.59 10.09 Favored 'General case' 0 CA--C 1.53 0.173 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.022 179.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -58.86 -37.07 75.69 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.107 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -72.06 -49.73 34.16 Favored 'General case' 0 CA--C 1.53 0.199 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.238 179.999 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 7.1 mtp180 -59.84 -49.55 77.28 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.577 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.5 mm-40 -65.29 -69.76 0.27 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-N 116.574 -0.284 . . . . 0.0 111.344 -179.494 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 139.08 45.66 0.07 OUTLIER Glycine 0 C--N 1.333 0.37 0 C-N-CA 120.997 -0.62 . . . . 0.0 112.048 -179.769 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.5 mt -114.41 -157.89 0.65 Allowed 'General case' 0 C--O 1.233 0.224 0 N-CA-C 110.342 -0.244 . . . . 0.0 110.342 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 31.2 m -126.05 156.04 40.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.846 0.355 . . . . 0.0 111.063 -179.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -93.57 28.78 2.18 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.174 179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -129.31 3.27 5.15 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 111.841 0.311 . . . . 0.0 111.841 179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.712 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -157.68 77.52 0.83 Allowed 'General case' 0 CA--C 1.521 -0.153 0 CA-C-O 121.068 0.461 . . . . 0.0 109.903 179.414 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.712 HD13 ' O ' ' A' ' 56' ' ' GLN . 7.4 mm -145.3 154.95 13.64 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.772 179.709 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.85 143.83 33.56 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.715 179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.617 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.5 OUTLIER -118.2 129.69 55.65 Favored 'General case' 0 C--O 1.233 0.212 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.414 179.492 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 21.3 mtt-85 -124.07 100.12 6.57 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-N 116.535 -0.302 . . . . 0.0 111.243 -179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.491 ' HA ' HG22 ' A' ' 83' ' ' ILE . 37.4 t80 -89.82 109.38 20.38 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.699 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 t70 56.9 37.15 28.62 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.134 -179.785 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.25 25.55 59.16 Favored Glycine 0 CA--C 1.523 0.589 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.923 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -121.53 125.02 26.97 Favored Pre-proline 0 CA--C 1.53 0.189 0 CA-C-N 116.875 0.337 . . . . 0.0 110.851 179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -69.0 127.27 14.93 Favored 'Trans proline' 0 C--N 1.351 0.681 0 C-N-CA 122.885 2.39 . . . . 0.0 112.738 -179.758 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.545 HD12 HD13 ' A' ' 39' ' ' LEU . 3.7 pt -146.49 161.55 9.92 Favored 'Isoleucine or valine' 0 C--O 1.234 0.241 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.379 179.917 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 3.1 m120 -107.9 174.14 6.01 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.039 -0.528 . . . . 0.0 110.977 179.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -80.93 1.14 32.26 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.655 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 28.2 p -92.38 0.87 57.48 Favored 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 111.941 0.349 . . . . 0.0 111.941 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.754 ' HB3' HD12 ' A' ' 39' ' ' LEU . 3.8 t0 -64.69 173.64 2.13 Favored 'General case' 0 CA--C 1.529 0.148 0 CA-C-O 120.812 0.339 . . . . 0.0 111.328 -179.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.575 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -167.75 -56.53 0.01 OUTLIER Pre-proline 0 CA--C 1.532 0.279 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.357 -179.661 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_exo -49.46 -44.37 35.04 Favored 'Trans proline' 0 C--N 1.356 0.955 0 C-N-CA 122.438 2.092 . . . . 0.0 112.808 -179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.456 ' HB3' ' OD2' ' A' ' 70' ' ' ASP . . . -71.57 -41.54 68.9 Favored 'General case' 0 C--O 1.232 0.144 0 CA-C-O 120.707 0.289 . . . . 0.0 110.799 179.473 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.35 -38.05 89.64 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.266 -0.424 . . . . 0.0 110.969 179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.425 HD21 ' HD2' ' A' ' 36' ' ' HIS . 0.2 OUTLIER -78.72 -33.4 46.76 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.719 179.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -68.79 -21.3 64.34 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.243 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 6.0 mtt -61.85 177.52 0.43 Allowed 'General case' 0 CA--C 1.534 0.333 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.983 179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -116.09 -63.5 1.44 Allowed 'General case' 0 C--O 1.233 0.203 0 N-CA-C 111.653 0.242 . . . . 0.0 111.653 -179.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.593 ' HA ' HG22 ' A' ' 17' ' ' ILE . 15.1 t0 -170.86 -54.44 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.167 -179.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 1.1 mt-10 -86.81 108.6 18.8 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.173 -179.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -151.56 164.28 37.18 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.006 -0.543 . . . . 0.0 111.208 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 6.2 t -144.14 149.53 36.65 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-O 120.927 0.394 . . . . 0.0 111.5 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.617 HD13 ' CE2' ' A' ' 59' ' ' PHE . 1.0 OUTLIER -140.0 175.07 7.37 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.282 0 CA-C-N 115.742 -0.663 . . . . 0.0 111.629 -179.416 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -127.52 102.63 6.95 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.415 179.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.421 HG13 ' O ' ' A' ' 85' ' ' VAL . 14.8 p -79.97 121.64 33.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.041 0.448 . . . . 0.0 111.184 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.402 ' HA ' ' OE1' ' A' ' 24' ' ' GLN . 3.7 m-85 -115.37 143.13 45.74 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.797 -179.826 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -136.51 129.92 31.71 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-O 120.746 0.308 . . . . 0.0 111.242 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.36 172.02 3.85 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.124 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -169.3 -52.54 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.914 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.1 p -84.57 65.56 9.07 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.776 179.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 128.15 133.35 3.7 Favored Glycine 0 C--N 1.333 0.41 0 C-N-CA 121.074 -0.584 . . . . 0.0 112.44 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.969 0 CA-C-O 118.351 -1.249 . . . . 0.0 112.729 179.979 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 N--CA 1.49 1.572 0 CA-C-O 120.747 0.308 . . . . 0.0 111.423 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -129.45 179.2 5.94 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.036 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.412 ' HB3' ' HB2' ' A' ' 32' ' ' LYS . 7.4 m80 -149.99 148.19 28.77 Favored 'General case' 0 C--O 1.233 0.199 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.12 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.617 HG13 HD13 ' A' ' 19' ' ' LEU . 14.9 pt -98.75 123.89 51.62 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 CA-C-O 120.928 0.394 . . . . 0.0 111.061 179.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 14.1 m-80 -83.76 102.02 12.0 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.121 -0.49 . . . . 0.0 110.933 -179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.617 HD13 HG13 ' A' ' 17' ' ' ILE . 8.0 mp -109.78 130.04 55.56 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.12 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 3.7 mptt -96.66 93.56 6.81 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.514 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.428 HG22 HD13 ' A' ' 83' ' ' ILE . 17.5 t -82.78 122.37 37.19 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.256 -0.429 . . . . 0.0 111.127 -179.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.81 118.22 36.18 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.271 -179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -89.7 138.15 14.45 Favored Glycine 0 C--N 1.332 0.309 0 C-N-CA 121.124 -0.56 . . . . 0.0 112.605 179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -56.69 -43.56 80.6 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.559 0.218 . . . . 0.0 111.332 179.766 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -59.68 -28.02 66.92 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 116.41 -0.359 . . . . 0.0 111.526 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.66 54.18 0.22 Allowed Glycine 0 C--N 1.336 0.535 0 C-N-CA 121.129 -0.558 . . . . 0.0 112.275 -179.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 51.6 p -134.89 103.81 5.74 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.815 0.34 . . . . 0.0 111.066 -179.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -109.9 95.89 4.2 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.904 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.05 137.16 52.91 Favored 'Isoleucine or valine' 0 C--O 1.234 0.256 0 CA-C-N 116.047 -0.524 . . . . 0.0 111.197 -179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 44.2 tt0 -94.19 87.26 5.2 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.916 179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -91.37 142.24 27.9 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.918 179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.412 ' HB2' ' HB3' ' A' ' 16' ' ' HIS . 1.5 pttt -114.64 138.72 50.33 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.048 -0.524 . . . . 0.0 111.214 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.854 HG12 HD12 ' A' ' 42' ' ' LEU . 1.7 pp -144.32 -179.74 1.19 Allowed 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.471 179.986 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.585 ' O ' HD12 ' A' ' 33' ' ' ILE . 0.0 OUTLIER -83.98 148.65 26.78 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.256 -179.885 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.95 28.44 1.57 Allowed 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 116.451 -0.34 . . . . 0.0 111.799 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.5 m80 -126.31 29.4 5.81 Favored 'General case' 0 CA--C 1.535 0.367 0 CA-C-O 120.695 0.283 . . . . 0.0 111.015 179.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -151.65 151.71 29.06 Favored Pre-proline 0 N--CA 1.463 0.215 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.63 179.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.51 ' HA ' HG23 ' A' ' 71' ' ' THR . 41.3 Cg_endo -67.71 156.8 64.57 Favored 'Trans proline' 0 C--N 1.349 0.554 0 C-N-CA 122.559 2.173 . . . . 0.0 112.242 179.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.551 HD12 ' OD2' ' A' ' 70' ' ' ASP . 8.2 mt -57.91 -22.46 48.62 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.155 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.426 ' O ' ' HG3' ' A' ' 43' ' ' MET . 41.8 t -49.76 -36.16 24.92 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.725 179.197 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.02 -46.55 61.95 Favored 'General case' 0 CA--C 1.53 0.18 0 CA-C-N 116.411 -0.359 . . . . 0.0 110.538 179.375 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.854 HD12 HG12 ' A' ' 33' ' ' ILE . 6.9 tt -62.6 -52.64 62.56 Favored 'General case' 0 N--CA 1.462 0.155 0 CA-C-N 116.444 -0.343 . . . . 0.0 110.696 179.458 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.426 ' HG3' ' O ' ' A' ' 40' ' ' SER . 0.0 OUTLIER -58.59 -35.43 72.39 Favored 'General case' 0 CA--C 1.529 0.172 0 CA-C-N 116.229 -0.441 . . . . 0.0 111.076 179.718 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -58.86 6.76 Favored 'General case' 0 CA--C 1.528 0.105 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.008 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -64.55 -43.04 95.22 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.586 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.429 ' HE2' HG11 ' A' ' 85' ' ' VAL . 78.7 t80 -60.15 -48.34 82.12 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.338 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 70.3 m -74.41 -34.81 63.37 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.501 -0.318 . . . . 0.0 111.234 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -69.03 -50.15 51.28 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-N 116.412 -0.358 . . . . 0.0 111.108 -179.947 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.0 mtt-85 -56.09 -36.45 68.15 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.486 -0.325 . . . . 0.0 111.011 179.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -70.81 -55.48 8.44 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.466 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.5 -18.43 0.89 Allowed Glycine 0 C--N 1.334 0.419 0 C-N-CA 120.908 -0.663 . . . . 0.0 112.492 -179.304 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.476 ' HB3' HD11 ' A' ' 57' ' ' ILE . 4.5 mm? -62.41 -178.73 0.2 Allowed 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 120.945 0.402 . . . . 0.0 110.894 179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -107.12 173.77 6.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.285 -179.701 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.3 ptt? -104.35 26.35 9.03 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.419 179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -138.62 13.38 2.74 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.458 ' O ' HD13 ' A' ' 57' ' ' ILE . 2.9 tt0 -160.66 77.88 0.61 Allowed 'General case' 0 C--O 1.232 0.168 0 CA-C-O 121.221 0.534 . . . . 0.0 110.225 179.352 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 58' ' ' ARG . 9.9 mm -149.12 160.88 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.418 179.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.485 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -156.77 139.6 15.21 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.612 0.244 . . . . 0.0 111.469 179.693 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.421 ' CE2' ' HB ' ' A' ' 85' ' ' VAL . 15.1 m-85 -117.47 160.83 20.57 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 120.776 0.322 . . . . 0.0 111.378 -179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 14.3 mmt180 -137.35 127.19 25.61 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.138 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.44 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 24.4 t80 -106.16 91.76 3.86 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.199 -0.455 . . . . 0.0 110.457 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 58.18 37.04 26.25 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.261 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 89.32 23.04 35.55 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 121.021 -0.609 . . . . 0.0 113.02 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.44 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 0.0 OUTLIER -114.81 103.95 54.49 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.756 0.278 . . . . 0.0 110.484 179.802 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -52.7 93.55 0.04 OUTLIER 'Trans proline' 0 C--N 1.352 0.74 0 C-N-CA 122.807 2.338 . . . . 0.0 112.138 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 14.7 pt -103.01 135.71 39.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.199 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.097 -179.733 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 27.7 p30 -79.93 157.73 26.82 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.829 179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -76.33 51.7 0.72 Allowed 'General case' 0 CA--C 1.534 0.365 0 CA-C-O 120.821 0.343 . . . . 0.0 110.978 179.515 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 9.1 t -166.56 25.36 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.493 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.717 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.551 ' OD2' HD12 ' A' ' 39' ' ' LEU . 3.2 p30 -77.03 -175.16 3.44 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-O 120.635 0.255 . . . . 0.0 110.922 179.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.51 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -167.82 -58.05 0.01 OUTLIER Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.515 -0.312 . . . . 0.0 111.271 -179.627 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 81.5 Cg_exo -45.7 -50.74 9.1 Favored 'Trans proline' 0 C--N 1.356 0.94 0 C-N-CA 122.591 2.194 . . . . 0.0 113.065 -179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -66.62 -49.46 66.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-O 120.771 0.32 . . . . 0.0 110.987 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.7 -29.31 69.26 Favored 'General case' 0 CA--C 1.532 0.273 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.261 179.71 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -78.58 -33.71 47.42 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.749 0.309 . . . . 0.0 110.414 179.462 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -58.53 -50.26 74.43 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.909 179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -84.74 148.25 26.46 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.537 179.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.616 ' CG ' HG22 ' A' ' 17' ' ' ILE . 3.8 tt0 -164.81 61.29 0.13 Allowed 'General case' 0 C--O 1.234 0.244 0 CA-C-N 116.198 -0.455 . . . . 0.0 111.036 -179.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.3 p30 -179.27 -60.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.45 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -142.22 96.74 3.0 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-O 120.753 0.311 . . . . 0.0 110.859 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.459 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 9.8 t70 -127.71 114.32 17.17 Favored 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.22 -0.446 . . . . 0.0 110.736 -179.769 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -91.29 131.37 36.84 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.882 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.428 HD13 HG22 ' A' ' 21' ' ' VAL . 0.3 OUTLIER -129.91 166.73 26.77 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.1 179.98 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.525 ' HB3' ' CE1' ' A' ' 86' ' ' PHE . 2.6 m-20 -133.84 105.87 7.01 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.663 179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.476 ' O ' HG13 ' A' ' 85' ' ' VAL . 9.8 p -92.83 112.99 27.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.215 0 CA-C-O 121.143 0.497 . . . . 0.0 111.324 -179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.525 ' CE1' ' HB3' ' A' ' 84' ' ' ASP . 92.6 m-85 -105.37 166.53 10.36 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.774 179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 6.6 pm0 -167.29 156.16 10.0 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.192 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER 63.07 93.85 0.05 Allowed 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.233 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -127.97 -176.9 3.92 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.916 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER 62.8 26.77 15.77 Favored 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 115.979 -0.555 . . . . 0.0 111.733 179.945 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 64.1 78.03 0.21 Allowed Glycine 0 C--N 1.337 0.624 0 C-N-CA 121.192 -0.528 . . . . 0.0 113.049 179.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.45 -1.194 . . . . 0.0 112.688 179.742 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 120.582 0.23 . . . . 0.0 111.433 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 t70 -157.02 86.39 0.97 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.439 -0.346 . . . . 0.0 111.382 -179.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.455 ' CG ' ' HG2' ' A' ' 32' ' ' LYS . 2.4 m170 -161.56 119.83 2.35 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.714 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.755 HG12 HG23 ' A' ' 33' ' ' ILE . 13.1 pt -80.96 130.06 36.5 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.231 0 CA-C-O 120.892 0.377 . . . . 0.0 111.063 179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 32.2 m-20 -81.5 116.72 21.42 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.041 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.422 HD21 ' CG1' ' A' ' 83' ' ' ILE . 7.9 tt -131.52 135.95 47.48 Favored 'General case' 0 CA--C 1.53 0.187 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.091 -179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.778 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.9 OUTLIER -104.25 106.04 16.4 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.293 179.49 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 23.4 t -82.42 124.44 39.29 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.152 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.14 -179.782 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.657 ' O ' HG12 ' A' ' 85' ' ' VAL . . . -104.83 177.67 4.78 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 116.069 -0.514 . . . . 0.0 110.931 179.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -143.13 148.95 20.87 Favored Glycine 0 C--N 1.332 0.358 0 C-N-CA 120.806 -0.712 . . . . 0.0 112.787 -179.849 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . 0.41 ' HG3' ' CE2' ' A' ' 86' ' ' PHE . 1.4 tt0 -52.37 -38.51 58.99 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-O 120.547 0.213 . . . . 0.0 111.433 179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -99.45 33.27 2.51 Favored 'General case' 0 CA--C 1.532 0.275 0 CA-C-N 116.544 -0.298 . . . . 0.0 111.588 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 70.77 83.72 0.2 Allowed Glycine 0 C--N 1.338 0.645 0 C-N-CA 120.966 -0.635 . . . . 0.0 112.785 179.604 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -142.59 68.18 1.31 Allowed 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.726 0.298 . . . . 0.0 111.493 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.6 t -84.54 107.8 16.03 Favored 'Isoleucine or valine' 0 C--O 1.233 0.225 0 CA-C-N 116.403 -0.362 . . . . 0.0 110.988 179.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 5.4 m -124.56 148.98 28.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.264 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.433 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 -93.07 110.88 22.37 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.844 179.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -112.75 165.66 12.09 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.176 -179.864 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.455 ' HG2' ' CG ' ' A' ' 16' ' ' HIS . 6.9 tttt -130.36 143.62 50.88 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.089 -0.505 . . . . 0.0 111.01 -179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.755 HG23 HG12 ' A' ' 17' ' ' ILE . 3.7 tt -154.91 148.44 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.08 -179.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.4 pttt -77.77 176.56 8.93 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.57 -0.286 . . . . 0.0 111.044 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -112.07 49.14 0.93 Allowed 'General case' 0 CA--C 1.533 0.29 0 CA-C-O 120.895 0.378 . . . . 0.0 111.453 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -157.59 33.24 0.27 Allowed 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 116.356 -0.383 . . . . 0.0 111.237 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -160.03 143.88 10.56 Favored Pre-proline 0 N--CA 1.466 0.344 0 CA-C-N 116.684 -0.234 . . . . 0.0 110.981 179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_exo -57.33 164.29 7.12 Favored 'Trans proline' 0 C--N 1.353 0.812 0 C-N-CA 122.809 2.339 . . . . 0.0 112.65 179.855 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.656 HD12 ' CB ' ' A' ' 70' ' ' ASP . 12.6 mt -60.24 -14.78 19.61 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.2 p -51.98 -33.14 36.68 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-O 120.467 0.175 . . . . 0.0 111.16 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 3.2 mmtt -57.06 -58.63 7.36 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.671 0.272 . . . . 0.0 110.543 179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.3 tp -61.76 -38.11 86.79 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.72 179.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -54.53 -55.13 32.37 Favored 'General case' 0 N--CA 1.462 0.151 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.988 179.871 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 49.8 mttt -61.41 -43.92 98.04 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.443 -0.344 . . . . 0.0 111.234 179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.31 -42.0 94.63 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.591 -0.277 . . . . 0.0 111.565 -179.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.636 ' CE1' HG11 ' A' ' 85' ' ' VAL . 51.3 t80 -78.13 -42.53 31.58 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 116.331 -0.395 . . . . 0.0 111.448 -179.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 88.5 p -65.47 -43.01 91.61 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.473 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.58 -34.89 62.98 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.902 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -54.42 -57.09 12.64 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-O 120.579 0.228 . . . . 0.0 111.464 -179.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -82.86 -47.8 11.45 Favored 'General case' 0 C--N 1.332 -0.183 0 CA-C-N 116.563 -0.29 . . . . 0.0 111.226 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 106.33 57.09 0.63 Allowed Glycine 0 C--N 1.334 0.458 0 C-N-CA 121.005 -0.617 . . . . 0.0 112.718 -179.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.48 HD12 ' OE1' ' A' ' 87' ' ' GLN . 3.5 mm? -91.15 -78.92 0.38 Allowed 'General case' 0 CA--C 1.532 0.274 0 CA-C-O 120.607 0.241 . . . . 0.0 110.4 179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -172.06 157.97 4.5 Favored 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.266 -0.425 . . . . 0.0 110.698 179.522 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -103.11 -37.34 7.78 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-O 120.692 0.282 . . . . 0.0 110.523 179.254 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -101.57 27.29 6.47 Favored 'General case' 0 CA--C 1.539 0.523 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.066 179.542 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.459 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.62 77.83 0.61 Allowed 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.084 0.468 . . . . 0.0 110.518 179.076 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.464 HG22 ' N ' ' A' ' 58' ' ' ARG . 10.8 mm -152.59 157.58 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.359 0 CA-C-N 115.487 -0.779 . . . . 0.0 110.466 179.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.464 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.2 OUTLIER -159.02 123.31 3.98 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 116.317 -0.401 . . . . 0.0 111.166 179.318 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -93.63 151.9 19.36 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.767 179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -132.03 127.09 35.43 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.266 -0.424 . . . . 0.0 111.246 -179.63 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -103.44 91.87 4.24 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.326 179.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.5 39.56 30.18 Favored 'General case' 0 CA--C 1.534 0.347 0 CA-C-N 115.972 -0.558 . . . . 0.0 111.127 -179.423 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.83 21.12 29.28 Favored Glycine 0 CA--C 1.522 0.518 0 C-N-CA 121.07 -0.586 . . . . 0.0 113.032 -179.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 -118.46 94.8 47.9 Favored Pre-proline 0 C--O 1.233 0.205 0 CA-C-N 116.855 0.327 . . . . 0.0 110.436 179.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_exo -52.96 105.88 0.13 Allowed 'Trans proline' 0 C--N 1.349 0.604 0 C-N-CA 122.972 2.448 . . . . 0.0 112.47 -179.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 12.7 pt -113.03 160.29 12.63 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.325 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.3 t-20 -103.68 164.4 11.7 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 115.901 -0.591 . . . . 0.0 111.096 -179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -68.13 -15.06 63.43 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 116.434 -0.348 . . . . 0.0 111.39 179.371 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 14.9 p -91.29 30.49 1.26 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.656 ' CB ' HD12 ' A' ' 39' ' ' LEU . 3.0 t70 -75.08 155.97 36.58 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.858 0.361 . . . . 0.0 111.35 179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.419 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.2 OUTLIER -160.68 -55.27 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 115.704 -0.68 . . . . 0.0 111.422 179.903 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.419 ' HD2' ' H ' ' A' ' 71' ' ' THR . 54.8 Cg_exo -52.41 -53.75 6.36 Favored 'Trans proline' 0 C--N 1.359 1.091 0 C-N-CA 122.356 2.037 . . . . 0.0 112.759 -179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.84 -37.42 86.75 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 120.868 0.366 . . . . 0.0 110.493 179.236 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -67.05 -20.11 65.78 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 115.902 -0.59 . . . . 0.0 111.452 179.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 10.9 mt -81.58 -35.19 30.47 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 110.087 -0.338 . . . . 0.0 110.087 178.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.92 -40.2 91.22 Favored 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.976 179.551 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -107.16 122.9 47.42 Favored 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.579 179.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.553 ' HB2' HG22 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -146.83 31.29 0.95 Allowed 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.523 -179.954 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -148.62 -51.29 0.16 Allowed 'General case' 0 C--O 1.235 0.336 0 CA-C-N 116.302 -0.408 . . . . 0.0 111.28 179.43 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -136.13 99.45 4.13 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-O 120.652 0.263 . . . . 0.0 110.905 179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -140.33 133.14 29.08 Favored 'General case' 0 C--O 1.234 0.237 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.935 179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.778 HG22 ' HB2' ' A' ' 20' ' ' LYS . 24.7 p -125.47 136.48 53.42 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.545 -179.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.422 ' CG1' HD21 ' A' ' 19' ' ' LEU . 0.6 OUTLIER -138.2 161.6 31.57 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.171 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.35 179.802 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.411 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 8.0 t0 -125.63 118.72 26.27 Favored 'General case' 0 N--CA 1.463 0.182 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.636 179.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.657 HG12 ' O ' ' A' ' 22' ' ' ALA . 13.6 p -82.7 121.34 35.65 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-O 121.232 0.539 . . . . 0.0 111.148 179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.418 ' HB2' ' CD ' ' A' ' 58' ' ' ARG . 9.4 m-85 -107.46 164.35 12.28 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.78 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . 0.48 ' OE1' HD12 ' A' ' 52' ' ' LEU . 19.2 mt-30 -129.11 126.25 38.93 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.239 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 1.9 mt-30 65.86 178.87 0.2 Allowed 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 116.244 -0.434 . . . . 0.0 111.45 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -138.85 99.89 3.91 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.15 179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 23.6 m -63.99 -38.0 89.46 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.926 179.575 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -167.08 -50.94 0.03 OUTLIER Glycine 0 C--N 1.333 0.387 0 C-N-CA 121.172 -0.537 . . . . 0.0 112.307 179.893 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.14 0 CA-C-O 118.654 -1.081 . . . . 0.0 112.758 -179.81 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 6.3 m120 . . . . . 0 N--CA 1.49 1.555 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -103.47 148.96 25.3 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.772 0.32 . . . . 0.0 111.453 -179.788 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 61.0 m80 -147.21 175.18 10.94 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.26 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 19.3 pt -104.77 128.66 58.27 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.301 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.156 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 26.3 m-20 -82.21 119.68 24.39 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.235 -179.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 42' ' ' LEU . 1.4 mt -123.86 116.95 23.77 Favored 'General case' 0 C--O 1.232 0.182 0 CA-C-O 120.75 0.309 . . . . 0.0 111.362 179.985 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -96.54 93.33 6.72 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.483 179.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.569 HG22 HD13 ' A' ' 83' ' ' ILE . 21.9 t -94.96 122.42 46.4 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.003 -179.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -93.68 123.45 37.02 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.268 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.431 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -83.8 148.55 24.81 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 121.166 -0.54 . . . . 0.0 112.831 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.7 tt0 -56.95 -37.83 72.1 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-O 120.49 0.186 . . . . 0.0 111.238 179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -60.21 -28.37 67.93 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.472 -0.331 . . . . 0.0 111.469 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 111.6 31.96 2.63 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 121.205 -0.521 . . . . 0.0 112.592 -179.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 52.0 m -110.86 144.86 39.24 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-O 120.756 0.312 . . . . 0.0 110.852 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.46 ' O ' HG13 ' A' ' 28' ' ' VAL . 11.8 p -112.02 117.13 54.42 Favored 'Isoleucine or valine' 0 C--O 1.233 0.233 0 CA-C-N 116.133 -0.485 . . . . 0.0 111.178 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.15 133.03 69.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.252 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.934 -179.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -117.82 106.55 13.13 Favored 'General case' 0 CA--C 1.53 0.194 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.007 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -97.86 155.56 17.0 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.139 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 11.4 mtmm -131.95 113.09 13.0 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.992 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.656 HD13 ' HB2' ' A' ' 42' ' ' LEU . 45.4 pt -129.29 178.54 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.412 -179.841 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -80.66 147.37 30.69 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.941 179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.8 ttm180 -89.02 54.72 3.09 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 116.297 -0.411 . . . . 0.0 111.232 -179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.6 m170 -159.84 35.27 0.18 Allowed 'General case' 0 CA--C 1.537 0.458 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.094 179.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.5 145.15 16.64 Favored Pre-proline 0 N--CA 1.465 0.308 0 CA-C-N 116.704 -0.225 . . . . 0.0 110.962 -179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.666 ' HA ' HG23 ' A' ' 71' ' ' THR . 47.8 Cg_exo -56.12 158.69 14.09 Favored 'Trans proline' 0 C--N 1.352 0.721 0 C-N-CA 122.902 2.402 . . . . 0.0 112.801 -179.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.661 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.6 mt -57.62 -23.74 52.73 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.805 179.928 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 7.4 t -47.77 -35.02 9.27 Favored 'General case' 0 N--CA 1.467 0.377 0 O-C-N 122.99 0.181 . . . . 0.0 111.342 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmt -60.08 -57.63 12.03 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.958 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.66 HD13 HD13 ' A' ' 19' ' ' LEU . 5.4 tt -71.11 -36.83 72.31 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.128 179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.536 ' CE ' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -58.37 -49.79 75.99 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.569 -0.287 . . . . 0.0 111.239 -179.855 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 14.2 mttt -62.6 -48.47 79.29 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.797 -0.183 . . . . 0.0 110.601 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.06 92.12 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.485 179.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.63 ' CE1' HG11 ' A' ' 85' ' ' VAL . 21.5 t80 -69.87 -45.62 67.29 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.02 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 3.8 t -68.35 -47.53 67.21 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 116.51 -0.314 . . . . 0.0 111.444 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.3 mt-10 -59.66 -40.66 88.46 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.553 -0.294 . . . . 0.0 110.99 179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.5 tpt180 -66.65 -39.42 88.21 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.057 179.573 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -70.83 -66.1 0.65 Allowed 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.574 -0.285 . . . . 0.0 111.293 -179.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 134.63 46.06 0.1 Allowed Glycine 0 C--N 1.335 0.478 0 C-N-CA 120.984 -0.626 . . . . 0.0 112.292 -179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 15.0 mt -119.78 -154.64 0.58 Allowed 'General case' 0 C--O 1.234 0.241 0 N-CA-C 110.274 -0.269 . . . . 0.0 110.274 -179.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . 0.408 ' O ' HD11 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -127.49 166.0 18.8 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-O 120.795 0.331 . . . . 0.0 111.077 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -95.88 25.98 4.37 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.263 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.47 ' O ' ' HG3' ' A' ' 56' ' ' GLN . 20.2 mtt180 -134.75 9.8 3.63 Favored 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.673 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -157.96 77.63 0.82 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-O 121.109 0.481 . . . . 0.0 109.738 178.938 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.673 HD13 ' O ' ' A' ' 56' ' ' GLN . 8.4 mm -144.66 155.22 14.54 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.814 179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.4 ttt180 -144.79 116.77 8.3 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 116.305 -0.407 . . . . 0.0 111.167 179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -98.55 101.64 13.13 Favored 'General case' 0 C--O 1.232 0.146 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.128 179.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -85.19 143.24 28.9 Favored 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.072 -179.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.423 ' O ' ' HB2' ' A' ' 64' ' ' GLN . 54.0 t80 -137.21 86.25 2.19 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.656 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER 51.67 37.61 20.53 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 121.001 0.429 . . . . 0.0 111.115 -179.488 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 94.26 18.48 36.19 Favored Glycine 0 CA--C 1.525 0.673 0 C-N-CA 121.13 -0.557 . . . . 0.0 113.143 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . 0.423 ' HB2' ' O ' ' A' ' 61' ' ' PHE . 1.7 mm100 -115.94 98.47 51.18 Favored Pre-proline 0 C--O 1.233 0.219 0 CA-C-N 116.996 0.398 . . . . 0.0 110.84 179.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -68.51 107.3 1.59 Allowed 'Trans proline' 0 C--N 1.35 0.615 0 C-N-CA 122.685 2.257 . . . . 0.0 112.265 -179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.9 pt -122.84 144.82 30.99 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.503 -179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -86.95 178.21 7.02 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.165 -179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -79.51 36.48 0.31 Allowed 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.455 -0.339 . . . . 0.0 111.881 179.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 67.2 p -136.71 17.38 3.08 Favored 'General case' 0 CA--C 1.533 0.314 0 N-CA-C 111.437 0.162 . . . . 0.0 111.437 179.424 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.661 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.1 t70 -67.25 162.88 21.68 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 121.006 0.431 . . . . 0.0 111.785 -179.552 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.666 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -163.13 -54.95 0.01 OUTLIER Pre-proline 0 CA--C 1.536 0.407 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.551 179.836 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.429 ' HD2' ' H ' ' A' ' 71' ' ' THR . 76.4 Cg_exo -50.45 -52.22 9.43 Favored 'Trans proline' 0 C--N 1.358 1.03 0 C-N-CA 122.441 2.094 . . . . 0.0 113.247 -179.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -63.23 -40.19 96.75 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 120.802 0.334 . . . . 0.0 110.956 179.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.93 -33.96 71.18 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 115.985 -0.552 . . . . 0.0 110.935 179.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.23 -34.56 59.22 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.593 179.398 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -57.85 -36.35 72.2 Favored 'General case' 0 CA--C 1.53 0.207 0 CA-C-N 116.341 -0.39 . . . . 0.0 110.939 179.764 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 4.8 mmt -70.09 179.25 2.4 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.357 -0.383 . . . . 0.0 111.242 179.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 4.6 pt-20 -132.03 -58.14 0.96 Allowed 'General case' 0 CA--C 1.531 0.215 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.484 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -145.82 -66.91 0.3 Allowed 'General case' 0 N--CA 1.462 0.153 0 CA-C-O 120.373 0.13 . . . . 0.0 111.317 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -76.0 119.85 20.52 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.94 -179.892 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -146.72 143.26 28.58 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.274 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -112.99 132.07 55.51 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.201 -179.469 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.579 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -138.11 167.79 21.33 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.919 179.778 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.464 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 2.7 m-20 -142.47 110.47 5.93 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.256 -179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.63 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.9 p -92.45 113.86 28.35 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.253 0 CA-C-O 121.022 0.439 . . . . 0.0 111.11 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.464 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 22.6 m-85 -130.8 170.48 14.33 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.883 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -85.89 151.51 23.72 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.507 -0.315 . . . . 0.0 110.898 179.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -74.14 0.08 Allowed 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.255 -179.759 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -116.85 -33.37 4.8 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 116.6 -0.273 . . . . 0.0 111.252 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.7 t 42.86 82.29 0.03 OUTLIER 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 123.238 0.615 . . . . 0.0 111.755 -179.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 117.82 42.32 0.62 Allowed Glycine 0 CA--C 1.519 0.314 0 CA-C-N 115.733 -0.667 . . . . 0.0 112.633 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.044 0 CA-C-O 118.477 -1.179 . . . . 0.0 112.514 -179.983 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 4.8 m120 . . . . . 0 N--CA 1.489 1.522 0 CA-C-O 120.57 0.224 . . . . 0.0 111.22 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 59.19 59.83 2.58 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.525 179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.434 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 29.3 m80 -155.42 107.68 2.67 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.609 179.69 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.676 HG12 HG23 ' A' ' 33' ' ' ILE . 6.8 pt -79.76 128.07 38.82 Favored 'Isoleucine or valine' 0 C--O 1.232 0.179 0 CA-C-N 116.298 -0.41 . . . . 0.0 110.724 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -84.05 119.09 24.54 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.195 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.478 HD11 ' HG2' ' A' ' 77' ' ' MET . 0.4 OUTLIER -122.28 137.26 54.91 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-O 120.859 0.362 . . . . 0.0 111.498 179.935 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.436 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.0 OUTLIER -101.73 97.26 7.68 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.365 179.472 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.586 HG22 HD11 ' A' ' 83' ' ' ILE . 21.5 t -85.51 118.46 32.34 Favored 'Isoleucine or valine' 0 C--O 1.233 0.188 0 CA-C-N 116.202 -0.453 . . . . 0.0 111.262 -179.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -107.49 113.58 27.02 Favored 'General case' 0 C--N 1.333 -0.139 0 CA-C-N 116.134 -0.484 . . . . 0.0 111.174 179.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.0 156.12 39.56 Favored Glycine 0 C--N 1.332 0.32 0 C-N-CA 120.883 -0.675 . . . . 0.0 112.569 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 -92.72 29.76 1.7 Allowed 'General case' 0 CA--C 1.533 0.317 0 N-CA-C 111.812 0.301 . . . . 0.0 111.812 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -133.38 26.05 4.13 Favored 'General case' 0 CA--C 1.533 0.325 0 CA-C-N 116.662 -0.244 . . . . 0.0 111.257 179.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 67.98 61.74 4.71 Favored Glycine 0 C--N 1.338 0.658 0 C-N-CA 120.896 -0.669 . . . . 0.0 112.604 -179.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -162.21 114.15 1.67 Allowed 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.797 0.332 . . . . 0.0 111.409 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.1 p -103.16 130.19 53.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.238 0 CA-C-N 116.123 -0.489 . . . . 0.0 111.217 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 17.0 t -147.36 153.38 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.43 -179.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -119.87 137.05 54.24 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.702 179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -122.96 154.09 38.86 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.434 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.0 OUTLIER -104.83 113.14 26.54 Favored 'General case' 0 C--O 1.233 0.187 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.738 179.837 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.676 HG23 HG12 ' A' ' 17' ' ' ILE . 8.9 tp -124.49 153.81 31.4 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 CA-C-N 116.211 -0.449 . . . . 0.0 111.346 -179.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.91 153.54 18.27 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.872 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.78 58.1 3.76 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.371 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.415 ' O ' HG23 ' A' ' 37' ' ' THR . 0.3 OUTLIER -164.62 32.63 0.07 Allowed 'General case' 0 CA--C 1.536 0.434 0 CA-C-N 116.425 -0.352 . . . . 0.0 111.534 179.64 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.415 HG23 ' O ' ' A' ' 36' ' ' HIS . 6.1 p -157.62 153.22 22.46 Favored Pre-proline 0 N--CA 1.465 0.319 0 CA-C-N 116.675 -0.239 . . . . 0.0 110.885 179.764 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -55.57 155.09 22.46 Favored 'Trans proline' 0 C--N 1.352 0.717 0 C-N-CA 122.735 2.29 . . . . 0.0 112.622 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.634 HD13 HD12 ' A' ' 66' ' ' ILE . 0.6 OUTLIER -61.4 -20.02 62.57 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.979 -179.923 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -50.84 -34.22 26.94 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.519 0.199 . . . . 0.0 110.957 179.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 15.1 mmmt -54.19 -42.95 70.29 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.908 179.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.7 tp -76.57 -45.54 30.01 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 116.416 -0.356 . . . . 0.0 110.746 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 2.1 ttp -57.08 -36.8 71.0 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.053 179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HD3' ' HB2' ' A' ' 54' ' ' MET . 27.9 mmtm -77.97 -54.0 6.79 Favored 'General case' 0 C--N 1.334 -0.093 0 CA-C-N 116.466 -0.334 . . . . 0.0 111.051 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -55.59 -32.34 62.98 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 111.774 0.287 . . . . 0.0 111.774 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.476 ' CE1' HG11 ' A' ' 85' ' ' VAL . 56.4 t80 -79.47 -52.69 7.71 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 116.594 -0.275 . . . . 0.0 111.485 -179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.9 p -66.31 -37.02 84.42 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.299 -179.68 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -68.08 -47.27 68.73 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.062 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.7 mtt180 -59.87 -49.09 79.06 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.376 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 70.1 mm-40 -64.39 -69.15 0.3 Allowed 'General case' 0 C--O 1.232 0.158 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.28 -179.679 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.2 38.24 0.13 Allowed Glycine 0 C--N 1.334 0.464 0 C-N-CA 120.775 -0.726 . . . . 0.0 112.943 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.617 HD22 ' N ' ' A' ' 52' ' ' LEU . 0.7 OUTLIER -107.99 -153.54 0.51 Allowed 'General case' 0 CA--C 1.531 0.236 0 CA-C-N 116.743 0.272 . . . . 0.0 110.563 179.982 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.9 p -95.96 119.68 34.89 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.522 -0.308 . . . . 0.0 110.932 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . 0.401 ' HB2' ' HD3' ' A' ' 44' ' ' LYS . 0.0 OUTLIER -72.86 -4.69 33.39 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 116.433 -0.349 . . . . 0.0 111.802 179.557 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 3.9 ptt180 -120.01 23.45 11.01 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 120.502 0.191 . . . . 0.0 111.216 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.468 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.76 77.78 0.6 Allowed 'General case' 0 C--O 1.232 0.178 0 CA-C-O 121.199 0.523 . . . . 0.0 110.452 179.173 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.485 HG22 ' N ' ' A' ' 58' ' ' ARG . 15.4 mm -150.86 160.11 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 CA-C-N 115.388 -0.824 . . . . 0.0 110.149 179.504 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.485 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -152.14 150.65 30.12 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-O 120.776 0.322 . . . . 0.0 111.447 179.752 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.484 ' CD1' HD12 ' A' ' 83' ' ' ILE . 64.8 m-85 -116.37 161.06 19.62 Favored 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.76 179.629 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 8.5 mtt180 -139.59 114.79 9.71 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.438 -179.739 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 65.1 t80 -108.46 101.42 10.6 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.306 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 83.1 m-20 53.18 46.95 25.5 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.076 -179.58 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 74.33 19.88 79.74 Favored Glycine 0 CA--C 1.524 0.642 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.001 -179.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -119.21 86.65 33.17 Favored Pre-proline 0 CA--C 1.531 0.245 0 CA-C-N 116.83 0.315 . . . . 0.0 110.84 179.986 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo -54.38 150.96 31.64 Favored 'Trans proline' 0 C--N 1.35 0.629 0 C-N-CA 123.037 2.491 . . . . 0.0 112.667 -179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.634 HD12 HD13 ' A' ' 39' ' ' LEU . 14.5 pt -141.01 171.57 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.634 -179.584 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -119.19 171.13 8.5 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.226 -179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.44 -30.82 63.45 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.887 179.462 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 42.4 p -78.92 8.22 5.91 Favored 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.575 ' HB3' HD12 ' A' ' 39' ' ' LEU . 1.1 m-20 -65.47 175.89 1.62 Allowed 'General case' 0 CA--C 1.531 0.212 0 CA-C-O 120.869 0.366 . . . . 0.0 111.457 -179.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.82 -55.74 0.0 OUTLIER Pre-proline 0 CA--C 1.533 0.303 0 CA-C-N 116.005 -0.543 . . . . 0.0 111.522 179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_exo -46.91 -51.99 8.39 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 122.346 2.031 . . . . 0.0 112.919 -179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.07 -45.9 91.48 Favored 'General case' 0 C--O 1.232 0.157 0 CA-C-O 120.828 0.347 . . . . 0.0 110.64 179.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.505 ' NE2' HD11 ' A' ' 17' ' ' ILE . 15.9 tp60 -58.71 -34.5 71.38 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.786 -0.643 . . . . 0.0 111.192 179.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.9 tt -79.48 -33.24 42.43 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-O 120.713 0.292 . . . . 0.0 110.529 179.362 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -62.76 -26.11 68.54 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 111.237 179.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.482 ' HB3' HD12 ' A' ' 17' ' ' ILE . 0.0 OUTLIER -58.34 160.23 5.42 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.952 0.406 . . . . 0.0 111.492 -179.929 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.619 ' O ' HG22 ' A' ' 17' ' ' ILE . 1.5 tt0 -125.02 -76.98 0.59 Allowed 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 115.973 -0.558 . . . . 0.0 110.879 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -158.57 26.62 0.23 Allowed 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 111.954 0.353 . . . . 0.0 111.954 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -174.86 102.87 0.09 Allowed 'General case' 0 C--O 1.232 0.176 0 CA-C-O 120.524 0.202 . . . . 0.0 111.259 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.406 ' HB2' ' HG ' ' A' ' 19' ' ' LEU . 3.7 m-20 -146.9 130.4 16.79 Favored 'General case' 0 N--CA 1.463 0.191 0 CA-C-O 120.875 0.369 . . . . 0.0 111.54 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.436 HG22 ' HB2' ' A' ' 20' ' ' LYS . 0.6 OUTLIER -102.92 144.33 31.36 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 116.013 -0.54 . . . . 0.0 111.367 -179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.586 HD11 HG22 ' A' ' 21' ' ' VAL . 3.3 pt -150.35 168.07 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.242 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.575 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -127.1 106.92 9.59 Favored 'General case' 0 C--O 1.232 0.173 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.295 179.494 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.476 HG11 ' CE1' ' A' ' 46' ' ' TYR . 13.8 p -83.06 119.13 31.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-O 121.052 0.453 . . . . 0.0 111.242 -179.667 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -102.67 125.41 49.39 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.36 179.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -137.09 97.92 3.62 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.175 -179.674 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 60.85 98.08 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.995 -0.548 . . . . 0.0 111.473 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 1.4 tp60 -157.58 -54.47 0.07 Allowed 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.004 -0.544 . . . . 0.0 111.098 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -145.46 94.44 2.51 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 116.429 -0.35 . . . . 0.0 110.641 -179.888 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -145.72 -149.24 4.96 Favored Glycine 0 C--N 1.334 0.421 0 C-N-CA 120.887 -0.673 . . . . 0.0 112.759 -179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.067 0 CA-C-O 118.384 -1.231 . . . . 0.0 112.497 179.921 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.569 0 CA-C-O 120.62 0.248 . . . . 0.0 111.007 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.3 m-20 -93.41 73.84 4.49 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.56 -179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.4 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 73.3 m80 -150.23 130.44 13.63 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.548 -0.296 . . . . 0.0 110.931 179.489 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.72 HG12 HG23 ' A' ' 33' ' ' ILE . 6.6 pt -86.63 127.14 40.64 Favored 'Isoleucine or valine' 0 C--O 1.233 0.214 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.709 179.596 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -81.35 94.37 6.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.299 -179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -93.01 132.14 37.37 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.205 -179.93 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -113.56 104.75 12.56 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.492 179.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.875 HG22 HD11 ' A' ' 83' ' ' ILE . 36.5 t -87.92 128.6 40.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.218 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.184 -179.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -127.24 147.12 50.22 Favored 'General case' 0 C--O 1.232 0.164 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.19 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -108.78 158.71 14.52 Favored Glycine 0 C--N 1.334 0.423 0 C-N-CA 121.147 -0.549 . . . . 0.0 112.58 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -63.74 -45.6 89.14 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-O 120.594 0.235 . . . . 0.0 111.435 179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.96 -28.2 67.46 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.303 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 126.9 50.63 0.16 Allowed Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.336 -0.459 . . . . 0.0 112.366 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.6 m -98.7 151.76 20.39 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.702 0.287 . . . . 0.0 111.118 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 28' ' ' VAL . 8.3 p -152.05 111.62 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 CA-C-N 116.191 -0.459 . . . . 0.0 111.358 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.54 HG21 ' CE1' ' A' ' 46' ' ' TYR . 14.7 m -137.25 156.87 34.32 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.257 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.402 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -127.35 128.56 46.09 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.879 179.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -137.65 151.5 48.34 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.06 179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -104.23 125.2 50.31 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.72 HG23 HG12 ' A' ' 17' ' ' ILE . 8.9 tp -136.62 153.1 30.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.187 -179.716 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.02 148.24 22.34 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.563 -0.289 . . . . 0.0 110.755 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.74 53.99 2.55 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 121.031 0.443 . . . . 0.0 111.006 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -150.58 29.32 0.69 Allowed 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.323 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -155.6 153.06 25.67 Favored Pre-proline 0 N--CA 1.463 0.22 0 CA-C-N 116.701 -0.227 . . . . 0.0 110.972 179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.32 162.02 42.27 Favored 'Trans proline' 0 C--N 1.351 0.686 0 C-N-CA 122.639 2.226 . . . . 0.0 112.287 179.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.605 HD12 ' HB3' ' A' ' 70' ' ' ASP . 8.3 mt -63.31 -19.54 64.69 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.94 -179.836 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.452 ' HB3' ' O ' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -48.71 -36.13 15.55 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.565 0.221 . . . . 0.0 111.23 179.479 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.18 -62.24 2.03 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.124 -179.93 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.425 ' CD2' HD22 ' A' ' 19' ' ' LEU . 12.6 tp -62.82 -33.86 76.1 Favored 'General case' 0 CA--C 1.53 0.201 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.883 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.414 ' HG2' ' CD1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -55.68 -61.97 2.0 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.504 -0.317 . . . . 0.0 110.685 179.548 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 1.8 mttt -59.5 -37.54 78.55 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.137 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -63.44 -42.56 98.67 Favored 'General case' 0 N--CA 1.463 0.214 0 CA-C-N 116.54 -0.3 . . . . 0.0 111.508 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.634 ' HE2' HG21 ' A' ' 85' ' ' VAL . 66.9 t80 -73.47 -45.54 53.5 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-N 116.495 -0.321 . . . . 0.0 111.439 -179.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 6.7 m -61.78 -50.01 74.07 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.586 -0.279 . . . . 0.0 111.409 -179.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -61.72 -50.51 72.12 Favored 'General case' 0 N--CA 1.463 0.194 0 CA-C-N 116.622 -0.263 . . . . 0.0 110.997 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.16 68.5 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.417 -0.356 . . . . 0.0 110.892 179.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -73.11 -52.11 15.46 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.084 179.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 137.73 -11.85 3.69 Favored Glycine 0 CA--C 1.521 0.425 0 C-N-CA 120.962 -0.637 . . . . 0.0 112.71 -179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 16.7 mt -74.71 -166.0 0.41 Allowed 'General case' 0 CA--C 1.533 0.319 0 CA-C-N 116.751 0.276 . . . . 0.0 110.631 179.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -117.18 169.17 9.66 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.476 -0.329 . . . . 0.0 111.092 -179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -97.5 29.62 3.21 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.113 179.396 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -129.22 3.05 5.18 Favored 'General case' 0 CA--C 1.537 0.443 0 N-CA-C 111.994 0.368 . . . . 0.0 111.994 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.512 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.48 77.99 0.63 Allowed 'General case' 0 C--O 1.234 0.247 0 CA-C-O 121.082 0.468 . . . . 0.0 110.275 179.318 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.512 HD13 ' O ' ' A' ' 56' ' ' GLN . 9.9 mm -141.97 157.78 20.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 CA-C-N 115.532 -0.758 . . . . 0.0 110.996 179.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.417 ' N ' HG22 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -136.63 133.48 36.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.933 0.397 . . . . 0.0 111.454 179.854 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.414 ' CD1' ' HG2' ' A' ' 43' ' ' MET . 2.4 m-85 -123.63 109.84 14.25 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.054 179.464 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 10.5 mtt180 -109.45 139.71 44.09 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-O 120.757 0.313 . . . . 0.0 111.4 -179.477 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.508 ' HA ' HG22 ' A' ' 83' ' ' ILE . 43.9 t80 -114.41 102.24 9.9 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.109 179.55 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 52.18 35.12 15.87 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.077 -179.475 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 93.71 24.93 19.35 Favored Glycine 0 CA--C 1.523 0.584 0 C-N-CA 121.078 -0.582 . . . . 0.0 113.022 -179.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.3 104.67 54.58 Favored Pre-proline 0 C--O 1.233 0.191 0 CA-C-N 116.878 0.339 . . . . 0.0 110.962 179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -69.84 109.04 2.23 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 122.754 2.302 . . . . 0.0 112.848 -179.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 25.8 pt -131.71 150.17 33.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.227 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.139 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -89.63 174.85 7.52 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.984 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.452 ' O ' ' HB3' ' A' ' 40' ' ' SER . 2.0 pt-20 -73.58 51.73 0.37 Allowed 'General case' 0 CA--C 1.535 0.371 0 CA-C-N 116.273 -0.421 . . . . 0.0 111.341 179.796 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 5.8 p -151.7 19.33 0.71 Allowed 'General case' 0 CA--C 1.534 0.327 0 CA-C-N 116.528 -0.306 . . . . 0.0 111.491 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.605 ' HB3' HD12 ' A' ' 39' ' ' LEU . 0.8 OUTLIER -68.75 173.02 5.59 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-O 120.84 0.352 . . . . 0.0 111.805 -179.572 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -168.11 -56.85 0.01 OUTLIER Pre-proline 0 CA--C 1.538 0.508 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.606 -179.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_exo -47.13 -51.68 9.01 Favored 'Trans proline' 0 C--N 1.359 1.107 0 C-N-CA 122.548 2.165 . . . . 0.0 113.044 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -61.48 -39.55 91.34 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-O 120.931 0.396 . . . . 0.0 110.593 179.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -61.5 -38.73 88.39 Favored 'General case' 0 CA--C 1.532 0.283 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.012 179.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 43.5 tp -80.18 -34.84 37.18 Favored 'General case' 0 N--CA 1.463 0.197 0 CA-C-O 120.695 0.283 . . . . 0.0 110.642 179.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -59.2 -29.72 67.69 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.926 179.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.434 ' HG2' ' HB2' ' A' ' 81' ' ' ASP . 0.3 OUTLIER -66.77 -177.81 0.65 Allowed 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.312 -0.404 . . . . 0.0 111.405 -179.951 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -146.46 -53.91 0.25 Allowed 'General case' 0 C--O 1.235 0.292 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.275 179.905 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -146.12 -53.81 0.26 Allowed 'General case' 0 C--N 1.333 -0.118 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.117 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -87.82 128.33 35.33 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.842 0.354 . . . . 0.0 110.868 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.434 ' HB2' ' HG2' ' A' ' 77' ' ' MET . 42.4 t0 -149.78 126.3 10.9 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.907 -179.559 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 10.5 p -125.6 131.58 52.68 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.14 179.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.875 HD11 HG22 ' A' ' 21' ' ' VAL . 0.9 OUTLIER -136.52 164.18 31.68 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 116.105 -0.498 . . . . 0.0 111.725 179.805 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -126.2 106.36 9.49 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.332 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.634 HG21 ' HE2' ' A' ' 46' ' ' TYR . 33.1 m -84.83 118.48 31.99 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.241 0 CA-C-O 121.027 0.442 . . . . 0.0 111.181 -179.764 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 75.1 m-85 -105.29 173.58 6.25 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.513 -179.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -133.49 165.34 25.11 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.076 -0.511 . . . . 0.0 111.058 179.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 72.78 130.27 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.175 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -115.52 -68.24 0.94 Allowed 'General case' 0 CA--C 1.532 0.251 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.194 -179.941 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 30.5 m 60.65 97.43 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.779 0.323 . . . . 0.0 111.116 179.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -75.29 -137.73 0.59 Allowed Glycine 0 C--N 1.335 0.5 0 C-N-CA 120.924 -0.655 . . . . 0.0 112.825 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.121 0 CA-C-O 118.475 -1.181 . . . . 0.0 112.443 -179.712 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 1.9 t30 . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 120.74 0.305 . . . . 0.0 111.629 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -70.0 149.86 47.26 Favored 'General case' 0 C--O 1.234 0.26 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.175 179.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 31.0 m80 -133.46 139.25 46.59 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.233 -0.44 . . . . 0.0 110.854 179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.563 HG22 ' HA ' ' A' ' 79' ' ' ASP . 18.8 pt -80.54 126.9 39.72 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-O 121.048 0.451 . . . . 0.0 111.539 -179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.9 m120 -87.57 105.27 17.21 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.752 -0.658 . . . . 0.0 111.021 -179.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.404 ' HG ' ' HB3' ' A' ' 81' ' ' ASP . 1.5 mp -111.62 124.94 53.36 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.03 179.81 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.451 ' HB2' HG22 ' A' ' 82' ' ' THR . 0.3 OUTLIER -96.79 102.43 14.21 Favored 'General case' 0 C--O 1.233 0.224 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.45 179.649 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.674 HG22 HD11 ' A' ' 83' ' ' ILE . 13.4 t -82.4 123.16 38.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.243 0 CA-C-N 116.282 -0.417 . . . . 0.0 111.222 -179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -117.42 102.95 9.64 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 116.141 -0.482 . . . . 0.0 111.098 179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -82.76 153.67 31.55 Favored Glycine 0 C--N 1.332 0.333 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.468 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -59.91 -33.6 72.07 Favored 'General case' 0 C--O 1.233 0.201 0 N-CA-C 111.422 0.156 . . . . 0.0 111.422 179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -61.29 -31.65 71.49 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 116.613 -0.267 . . . . 0.0 111.443 179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.15 83.4 0.97 Allowed Glycine 0 C--N 1.338 0.65 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.548 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 19.7 t -157.93 152.06 24.34 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-O 120.674 0.273 . . . . 0.0 111.247 179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.3 t -141.28 93.11 0.6 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.264 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.893 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.3 t -112.19 137.15 46.07 Favored 'Isoleucine or valine' 0 C--O 1.233 0.198 0 CA-C-N 116.144 -0.48 . . . . 0.0 111.067 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 1.6 pm0 -99.65 87.29 3.53 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 116.187 -0.46 . . . . 0.0 110.949 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -80.32 132.64 35.84 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.115 -0.493 . . . . 0.0 111.018 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.4 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 13.8 mtmm -111.97 96.51 6.09 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.887 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.479 HD11 HD11 ' A' ' 17' ' ' ILE . 3.1 pt -107.0 179.02 0.87 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.208 0 CA-C-N 116.044 -0.526 . . . . 0.0 111.223 -179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.62 149.39 22.3 Favored 'General case' 0 C--O 1.233 0.19 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.823 179.669 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 10.4 ttm180 -85.93 51.49 2.22 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.856 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 59.6 m-70 -154.96 34.13 0.39 Allowed 'General case' 0 CA--C 1.535 0.382 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.906 179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -153.17 153.31 29.36 Favored Pre-proline 0 C--O 1.233 0.198 0 CA-C-N 116.51 -0.314 . . . . 0.0 110.785 -179.78 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.543 ' HA ' HG23 ' A' ' 71' ' ' THR . 57.7 Cg_endo -70.7 163.84 37.59 Favored 'Trans proline' 0 C--N 1.348 0.517 0 C-N-CA 122.63 2.22 . . . . 0.0 112.405 179.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.654 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.6 mt -59.58 -24.68 63.97 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.597 179.822 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -52.52 -33.73 46.52 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 120.638 0.256 . . . . 0.0 111.287 179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.99 -57.62 7.38 Favored 'General case' 0 CA--C 1.529 0.162 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.276 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.415 HD12 HG12 ' A' ' 33' ' ' ILE . 9.6 tt -63.64 -43.57 96.4 Favored 'General case' 0 N--CA 1.463 0.213 0 CA-C-N 116.509 -0.314 . . . . 0.0 111.116 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.665 ' SD ' HG21 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -58.2 -50.18 74.46 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.415 -179.752 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -61.62 -53.25 58.68 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.699 -0.228 . . . . 0.0 111.039 -179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.79 -30.69 65.87 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.722 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 87.6 t80 -79.63 -53.67 6.61 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.639 -0.255 . . . . 0.0 111.045 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.0 t -58.83 -36.35 74.4 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 116.362 -0.381 . . . . 0.0 111.12 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 1.7 mt-10 -72.93 -41.99 63.94 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.421 -179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.51 -43.01 93.5 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.59 -0.277 . . . . 0.0 111.498 -179.83 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 22.2 mm-40 -71.83 -76.27 0.11 Allowed 'General case' 0 CA--C 1.531 0.231 0 CA-C-N 116.705 -0.225 . . . . 0.0 111.267 -179.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 152.18 39.86 0.03 OUTLIER Glycine 0 C--N 1.334 0.451 0 C-N-CA 121.056 -0.592 . . . . 0.0 112.158 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.554 HD22 ' N ' ' A' ' 52' ' ' LEU . 2.9 mm? -96.78 -166.78 1.45 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 120.813 0.34 . . . . 0.0 110.256 -179.841 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -117.64 159.34 23.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.949 179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -94.93 25.81 3.95 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 116.235 -0.438 . . . . 0.0 111.358 179.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 12.4 ttm105 -139.61 14.7 2.53 Favored 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.458 179.772 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.662 ' O ' HD13 ' A' ' 57' ' ' ILE . 2.5 pt20 -160.8 77.66 0.59 Allowed 'General case' 0 N--CA 1.455 -0.214 0 CA-C-O 121.269 0.557 . . . . 0.0 110.076 179.124 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.665 HG21 ' SD ' ' A' ' 43' ' ' MET . 9.4 mm -145.47 157.2 13.11 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.471 0 CA-C-N 115.49 -0.777 . . . . 0.0 110.795 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.413 ' N ' HG22 ' A' ' 57' ' ' ILE . 54.6 ttt180 -157.37 130.23 7.59 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.154 -0.476 . . . . 0.0 110.82 179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.427 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.2 OUTLIER -103.43 148.5 25.83 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.576 179.468 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 6.6 mtt180 -145.43 127.15 15.26 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.194 -179.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 36.4 t80 -100.14 98.74 9.41 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.246 179.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 56.72 37.7 28.99 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 116.101 -0.499 . . . . 0.0 111.081 -179.449 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 88.47 24.95 31.98 Favored Glycine 0 C--N 1.336 0.539 0 C-N-CA 121.114 -0.565 . . . . 0.0 113.069 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 16.8 mt-30 -117.03 108.79 43.6 Favored Pre-proline 0 C--O 1.232 0.174 0 CA-C-N 116.98 0.39 . . . . 0.0 110.659 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_exo -52.1 115.8 2.39 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 123.044 2.496 . . . . 0.0 112.679 -179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.427 HG13 ' HB3' ' A' ' 59' ' ' PHE . 10.6 pt -139.16 148.0 24.14 Favored 'Isoleucine or valine' 0 C--O 1.233 0.231 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.267 -179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.2 m120 -94.9 170.45 9.42 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.734 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.412 ' HB3' ' HG3' ' A' ' 43' ' ' MET . 0.3 OUTLIER -83.11 23.77 0.84 Allowed 'General case' 0 CA--C 1.533 0.305 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.539 179.225 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 2.5 p -116.46 11.76 14.97 Favored 'General case' 0 CA--C 1.532 0.251 0 O-C-N 122.457 -0.152 . . . . 0.0 111.111 179.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.654 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.7 t70 -65.79 168.64 7.56 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 120.898 0.38 . . . . 0.0 111.188 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.543 HG23 ' HA ' ' A' ' 38' ' ' PRO . 0.0 OUTLIER -168.39 -55.22 0.0 OUTLIER Pre-proline 0 CA--C 1.536 0.424 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.341 -179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -49.92 -48.05 21.04 Favored 'Trans proline' 0 C--N 1.357 1.017 0 C-N-CA 122.53 2.153 . . . . 0.0 112.789 179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -64.92 -37.87 89.07 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.627 179.356 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 5.7 tp-100 -58.25 -33.38 69.32 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 115.899 -0.591 . . . . 0.0 110.905 179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -78.33 -32.49 49.2 Favored 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.725 179.217 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 4.3 tt0 -58.66 -39.78 81.59 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-N 116.338 -0.392 . . . . 0.0 110.734 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -67.26 175.85 2.5 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.201 179.557 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.481 ' O ' HG22 ' A' ' 17' ' ' ILE . 4.2 pt-20 -123.47 -52.44 1.82 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.457 -0.338 . . . . 0.0 111.573 -179.951 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . 0.563 ' HA ' HG22 ' A' ' 17' ' ' ILE . 11.2 m-20 -159.73 -57.13 0.06 Allowed 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.875 -179.817 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -75.07 117.06 16.49 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.145 179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.404 ' HB3' ' HG ' ' A' ' 19' ' ' LEU . 27.4 t70 -158.92 153.15 23.82 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.868 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.451 HG22 ' HB2' ' A' ' 20' ' ' LYS . 32.6 p -137.7 145.65 42.81 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.399 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.674 HD11 HG22 ' A' ' 21' ' ' VAL . 1.0 OUTLIER -145.25 154.37 13.86 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.528 179.587 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.0 t0 -118.42 121.19 39.73 Favored 'General case' 0 C--O 1.233 0.222 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.078 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.486 ' O ' HG13 ' A' ' 85' ' ' VAL . 13.8 p -94.12 111.56 25.41 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 CA-C-O 121.19 0.519 . . . . 0.0 110.849 178.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -95.88 146.26 24.72 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.112 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -125.06 107.78 11.15 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.369 -0.378 . . . . 0.0 111.038 179.828 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -118.77 163.77 16.38 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.293 -0.412 . . . . 0.0 111.074 -179.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -140.07 -70.42 0.39 Allowed 'General case' 0 C--O 1.233 0.185 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.021 179.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 19.1 m -149.85 102.34 3.13 Favored 'General case' 0 C--O 1.233 0.216 0 CA-C-N 116.347 -0.388 . . . . 0.0 110.768 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -84.05 111.2 3.42 Favored Glycine 0 C--N 1.334 0.448 0 C-N-CA 120.957 -0.64 . . . . 0.0 112.509 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.157 0 CA-C-O 118.535 -1.147 . . . . 0.0 112.485 179.961 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.2 m120 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 120.83 0.348 . . . . 0.0 111.255 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -109.9 129.0 55.7 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.977 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -167.29 123.9 1.16 Allowed 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.37 -0.377 . . . . 0.0 111.324 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.696 HG22 ' O ' ' A' ' 78' ' ' GLU . 22.6 pt -80.65 129.64 37.21 Favored 'Isoleucine or valine' 0 C--O 1.234 0.286 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.158 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -98.81 104.65 16.72 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.399 -179.159 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.75 139.3 35.62 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.466 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.606 ' HB2' HG23 ' A' ' 82' ' ' THR . 0.0 OUTLIER -111.3 105.46 14.12 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 115.978 -0.556 . . . . 0.0 110.354 179.549 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.674 HG13 ' CD1' ' A' ' 83' ' ' ILE . 22.0 t -90.32 129.7 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.269 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.307 -179.649 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -115.98 113.7 23.61 Favored 'General case' 0 C--O 1.232 0.155 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.372 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.432 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -79.86 146.18 28.02 Favored Glycine 0 C--N 1.333 0.366 0 C-N-CA 121.089 -0.577 . . . . 0.0 113.01 -179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -56.15 -51.83 66.57 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.503 0.192 . . . . 0.0 111.428 179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -63.42 -23.72 67.53 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.407 -179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 121.13 88.94 1.03 Allowed Glycine 0 C--N 1.339 0.704 0 C-N-CA 120.926 -0.654 . . . . 0.0 112.579 179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 88.4 p -153.76 127.38 8.72 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-O 120.705 0.288 . . . . 0.0 111.252 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.8 t -117.86 97.11 5.01 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.218 -0.447 . . . . 0.0 110.874 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.4 t -118.43 135.78 57.74 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.223 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.24 -179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -110.09 115.86 30.52 Favored 'General case' 0 N--CA 1.463 0.212 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.082 179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 1.9 m-85 -104.75 165.04 11.34 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.113 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 9.9 mtpp -135.23 111.59 9.77 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.202 -0.454 . . . . 0.0 110.994 -179.825 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.47 ' O ' HG12 ' A' ' 17' ' ' ILE . 27.1 pt -129.14 173.56 13.68 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.315 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.371 179.66 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.69 158.99 19.91 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.462 -0.336 . . . . 0.0 110.809 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . 0.453 ' HD3' ' HA ' ' A' ' 75' ' ' LEU . 0.0 OUTLIER -90.76 52.56 2.21 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-O 120.831 0.348 . . . . 0.0 111.265 -179.901 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -160.59 35.48 0.16 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.034 179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.4 ' HA ' ' HD3' ' A' ' 38' ' ' PRO . 0.1 OUTLIER -155.88 148.26 17.68 Favored Pre-proline 0 N--CA 1.467 0.407 0 CA-C-O 120.485 0.183 . . . . 0.0 111.142 -179.978 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 37' ' ' THR . 35.6 Cg_exo -62.08 165.03 15.41 Favored 'Trans proline' 0 C--N 1.352 0.757 0 C-N-CA 122.977 2.451 . . . . 0.0 112.878 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.51 HD12 ' CB ' ' A' ' 70' ' ' ASP . 8.8 mt -62.77 -17.87 61.74 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.885 179.728 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 83.9 p -50.94 -34.59 29.29 Favored 'General case' 0 N--CA 1.464 0.239 0 N-CA-C 111.585 0.217 . . . . 0.0 111.585 179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -54.44 45.51 Favored 'General case' 0 N--CA 1.463 0.184 0 N-CA-C 110.291 -0.263 . . . . 0.0 110.291 179.522 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 1.3 tt -66.47 -41.12 89.5 Favored 'General case' 0 CA--C 1.53 0.208 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.346 178.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.616 ' HE3' ' HB3' ' A' ' 68' ' ' GLU . 7.4 mmm -59.3 -53.72 55.0 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.521 179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 19.9 mttm -55.12 -54.0 48.78 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 116.505 -0.316 . . . . 0.0 111.095 -179.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -60.73 -37.3 81.28 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.385 -0.37 . . . . 0.0 111.409 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.437 ' O ' ' HG2' ' A' ' 49' ' ' ARG . 71.6 t80 -69.6 -37.15 76.77 Favored 'General case' 0 CA--C 1.533 0.309 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.414 -179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 12.7 p -76.94 -34.36 57.64 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 120.668 0.271 . . . . 0.0 111.03 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.0 tt0 -78.16 -37.14 46.58 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.389 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 46' ' ' TYR . 0.0 OUTLIER -60.17 -36.31 77.3 Favored 'General case' 0 N--CA 1.466 0.372 0 N-CA-C 111.683 0.253 . . . . 0.0 111.683 -179.773 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.93 -70.62 0.62 Allowed 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 116.615 -0.266 . . . . 0.0 111.396 -179.536 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.33 46.27 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.951 -0.642 . . . . 0.0 111.944 -179.578 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -112.02 -160.03 0.7 Allowed 'General case' 0 C--O 1.233 0.227 0 N-CA-C 110.135 -0.321 . . . . 0.0 110.135 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 t -130.47 163.33 27.22 Favored 'General case' 0 C--O 1.232 0.172 0 CA-C-O 120.9 0.381 . . . . 0.0 111.191 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.6 ttp -93.11 26.75 2.71 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.289 179.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 42.9 ttt-85 -135.49 14.36 3.45 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.474 179.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.508 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.7 OUTLIER -160.85 77.93 0.59 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 121.267 0.556 . . . . 0.0 110.541 179.049 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.548 HG21 ' SD ' ' A' ' 43' ' ' MET . 8.3 mm -148.46 158.78 7.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.377 -0.829 . . . . 0.0 110.747 179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.455 ' N ' HG22 ' A' ' 57' ' ' ILE . 6.3 tpt180 -142.28 134.24 27.25 Favored 'General case' 0 C--O 1.231 0.114 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.155 179.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.45 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -121.83 124.97 45.42 Favored 'General case' 0 C--O 1.232 0.168 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.302 179.411 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 3.5 mtp180 -124.4 120.82 33.19 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.519 -0.31 . . . . 0.0 111.055 -179.688 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 13.4 t80 -100.55 95.29 6.61 Favored 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.455 179.729 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 53.49 41.65 32.07 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.119 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 87.46 25.66 32.56 Favored Glycine 0 CA--C 1.523 0.543 0 C-N-CA 120.999 -0.619 . . . . 0.0 112.969 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 20.6 tt0 -114.98 94.5 38.54 Favored Pre-proline 0 C--O 1.232 0.177 0 N-CA-C 110.336 -0.246 . . . . 0.0 110.336 179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -56.16 93.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.352 0.737 0 C-N-CA 122.901 2.401 . . . . 0.0 112.458 -179.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 27.1 pt -114.34 166.11 8.58 Favored 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.191 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 19.4 m-20 -110.14 175.23 5.51 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.777 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.616 ' HB3' ' HE3' ' A' ' 43' ' ' MET . 1.4 pm0 -65.48 -14.9 62.0 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-N 116.453 -0.339 . . . . 0.0 111.654 179.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 80.5 p -91.08 29.39 1.4 Allowed 'General case' 0 CA--C 1.536 0.413 0 N-CA-C 111.933 0.345 . . . . 0.0 111.933 -179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.51 ' CB ' HD12 ' A' ' 39' ' ' LEU . 3.0 t70 -73.59 167.48 21.26 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 120.407 0.146 . . . . 0.0 111.114 179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.492 ' N ' ' HD2' ' A' ' 72' ' ' PRO . 17.2 m -169.0 -58.59 0.0 OUTLIER Pre-proline 0 N--CA 1.468 0.453 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.772 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 71' ' ' THR . 5.3 Cg_endo -47.24 -51.22 9.82 Favored 'Trans proline' 0 C--N 1.358 1.04 0 C-N-CA 122.943 2.428 . . . . 0.0 112.773 -179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.404 ' HB3' ' OD2' ' A' ' 70' ' ' ASP . . . -60.22 -41.16 92.47 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.053 0.454 . . . . 0.0 110.261 179.014 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 4.8 tt0 -67.94 -33.14 74.11 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.092 179.42 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 35' ' ' ARG . 0.5 OUTLIER -75.68 -38.94 58.27 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-O 120.83 0.348 . . . . 0.0 110.426 179.779 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -59.74 -40.66 88.81 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.059 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 30.9 mmt -70.61 176.35 4.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.322 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.696 ' O ' HG22 ' A' ' 17' ' ' ILE . 1.4 pm0 -129.71 -47.17 1.15 Allowed 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.481 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -149.16 -64.54 0.23 Allowed 'General case' 0 N--CA 1.461 0.099 0 CA-C-O 120.523 0.201 . . . . 0.0 111.219 179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -67.62 106.73 2.28 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.006 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 42.7 t0 -145.76 117.28 8.04 Favored 'General case' 0 CA--C 1.531 0.232 0 CA-C-O 120.832 0.349 . . . . 0.0 111.111 -179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.606 HG23 ' HB2' ' A' ' 20' ' ' LYS . 0.0 OUTLIER -115.22 146.26 41.61 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.467 -179.426 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.674 ' CD1' HG13 ' A' ' 21' ' ' VAL . 2.2 pp -146.88 161.33 9.06 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.586 179.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -115.76 100.01 7.72 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.738 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.49 ' O ' HG13 ' A' ' 85' ' ' VAL . 14.3 p -79.85 113.59 19.45 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.2 0 CA-C-O 121.164 0.506 . . . . 0.0 110.874 179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -104.71 125.59 50.95 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.112 -179.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 10.9 tt0 -84.92 121.5 27.84 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-O 120.812 0.339 . . . . 0.0 111.177 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -83.39 112.49 19.98 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.713 179.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -65.2 141.2 58.74 Favored 'General case' 0 C--O 1.233 0.191 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.096 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.4 m -123.76 103.48 8.4 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.762 -179.778 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -162.99 -53.78 0.02 OUTLIER Glycine 0 CA--C 1.519 0.29 0 C-N-CA 121.154 -0.546 . . . . 0.0 112.497 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.303 -1.276 . . . . 0.0 112.403 179.882 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 69.4 m-80 . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 120.633 0.254 . . . . 0.0 111.167 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -125.65 149.15 48.68 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.968 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . 0.404 ' HB3' ' HG3' ' A' ' 32' ' ' LYS . 5.7 m170 -160.93 143.55 12.69 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.672 179.933 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.698 HG12 HG23 ' A' ' 33' ' ' ILE . 8.5 pt -92.45 129.6 42.8 Favored 'Isoleucine or valine' 0 C--O 1.234 0.27 0 CA-C-O 121.152 0.501 . . . . 0.0 111.174 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -82.36 119.6 24.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 115.652 -0.704 . . . . 0.0 111.286 -179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.753 HD23 HD11 ' A' ' 83' ' ' ILE . 0.5 OUTLIER -129.93 124.74 33.83 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.079 179.668 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 1.9 mptt -107.93 108.87 20.2 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.261 179.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 21.9 t -81.07 113.1 19.98 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.036 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.404 ' O ' ' HA ' ' A' ' 84' ' ' ASP . . . -101.4 105.26 16.28 Favored 'General case' 0 C--O 1.233 0.186 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.051 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.47 146.27 27.24 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 121.095 -0.574 . . . . 0.0 112.384 179.887 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -56.56 -24.52 47.73 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -91.73 40.71 1.05 Allowed 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.738 0.304 . . . . 0.0 111.455 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 57.29 39.04 89.62 Favored Glycine 0 C--N 1.336 0.556 0 C-N-CA 121.076 -0.583 . . . . 0.0 113.061 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 7.1 t -102.05 114.56 28.79 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.778 0.289 . . . . 0.0 110.97 -179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 21.4 t -122.33 98.95 6.25 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.983 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 24.7 t -126.79 134.6 65.86 Favored 'Isoleucine or valine' 0 C--O 1.233 0.203 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.055 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.4 tt0 -84.39 149.48 25.98 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.035 179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -154.31 132.91 12.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 116.165 -0.47 . . . . 0.0 111.016 179.808 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.404 ' HG3' ' HB3' ' A' ' 16' ' ' HIS . 0.1 OUTLIER -94.69 149.65 21.02 Favored 'General case' 0 C--O 1.233 0.204 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.744 179.794 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.698 HG23 HG12 ' A' ' 17' ' ' ILE . 7.8 tp -157.12 148.52 10.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.563 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 11.4 pttt -76.96 165.77 24.23 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.947 179.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -101.23 48.88 0.88 Allowed 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 116.346 -0.388 . . . . 0.0 111.126 179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -156.05 32.83 0.34 Allowed 'General case' 0 CA--C 1.535 0.387 0 CA-C-N 116.34 -0.391 . . . . 0.0 111.198 179.833 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -152.45 149.25 22.33 Favored Pre-proline 0 C--O 1.234 0.248 0 CA-C-N 116.452 -0.34 . . . . 0.0 110.94 179.948 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -70.16 170.31 17.36 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.786 2.324 . . . . 0.0 112.722 -179.849 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.833 HD12 ' HB2' ' A' ' 70' ' ' ASP . 6.2 mt -58.14 -22.34 50.7 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.544 179.542 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 2.1 t -49.9 -39.2 39.06 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.638 0.256 . . . . 0.0 110.758 178.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -46.46 87.73 Favored 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 116.372 -0.377 . . . . 0.0 111.173 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.3 tp -70.66 -47.52 59.54 Favored 'General case' 0 CA--C 1.53 0.184 0 CA-C-N 116.454 -0.339 . . . . 0.0 110.732 179.555 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.99 -43.7 86.73 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.528 -0.305 . . . . 0.0 111.122 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -60.68 -50.76 72.19 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-N 116.56 -0.291 . . . . 0.0 110.949 179.703 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -67.65 -45.72 74.48 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 116.44 -0.345 . . . . 0.0 111.69 -179.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.479 ' CE2' HG11 ' A' ' 85' ' ' VAL . 81.7 t80 -61.97 -45.41 93.77 Favored 'General case' 0 N--CA 1.465 0.279 0 CA-C-N 116.558 -0.292 . . . . 0.0 111.248 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 7.9 t -69.53 -37.79 77.25 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.936 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 15.3 tt0 -72.74 -37.63 67.66 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.164 179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.0 ttt180 -63.77 -33.8 76.47 Favored 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.506 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -81.34 -75.13 0.3 Allowed 'General case' 0 N--CA 1.463 0.177 0 CA-C-O 120.612 0.244 . . . . 0.0 111.312 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 150.49 45.8 0.02 OUTLIER Glycine 0 C--N 1.333 0.413 0 C-N-CA 121.08 -0.581 . . . . 0.0 112.102 -179.67 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 9.9 mt -114.27 -160.31 0.73 Allowed 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.713 0.292 . . . . 0.0 110.254 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.9 -179.49 5.86 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.905 179.98 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 2.2 mtm -100.04 30.61 3.67 Favored 'General case' 0 CA--C 1.534 0.332 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.093 179.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -124.46 0.26 8.24 Favored 'General case' 0 CA--C 1.535 0.387 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.543 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.32 77.75 0.63 Allowed 'General case' 0 N--CA 1.455 -0.186 0 CA-C-O 121.251 0.548 . . . . 0.0 110.242 179.266 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.543 HD13 ' O ' ' A' ' 56' ' ' GLN . 8.1 mm -144.28 156.7 15.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 115.207 -0.906 . . . . 0.0 110.668 179.793 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.407 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.2 tpt180 -158.65 126.84 5.22 Favored 'General case' 0 C--N 1.333 -0.134 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.972 179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -112.63 144.14 42.63 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.283 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.468 ' O ' HG22 ' A' ' 83' ' ' ILE . 4.7 mtt180 -131.66 135.98 47.33 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.109 -179.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -123.85 113.63 18.79 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.532 179.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.0 t0 56.25 37.05 28.47 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 116.024 -0.534 . . . . 0.0 111.053 -179.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.66 22.67 63.84 Favored Glycine 0 CA--C 1.525 0.658 0 C-N-CA 121.043 -0.599 . . . . 0.0 113.11 -179.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -119.21 127.41 26.5 Favored Pre-proline 0 C--O 1.231 0.128 0 CA-C-N 116.775 0.287 . . . . 0.0 110.871 -179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -70.25 110.07 2.56 Favored 'Trans proline' 0 C--N 1.348 0.545 0 C-N-CA 122.759 2.306 . . . . 0.0 112.34 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.511 HD12 ' CD1' ' A' ' 39' ' ' LEU . 31.4 pt -116.61 176.61 2.49 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 CA-C-N 115.983 -0.553 . . . . 0.0 111.132 179.786 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -133.28 179.41 6.22 Favored 'General case' 0 C--O 1.235 0.331 0 CA-C-N 116.16 -0.473 . . . . 0.0 111.155 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -79.87 40.08 0.45 Allowed 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.474 179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 40.5 p -141.14 16.59 2.26 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 116.67 -0.241 . . . . 0.0 111.149 179.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.833 ' HB2' HD12 ' A' ' 39' ' ' LEU . 0.2 OUTLIER -72.94 168.8 18.23 Favored 'General case' 0 C--N 1.34 0.179 0 CA-C-O 120.762 0.315 . . . . 0.0 111.453 -179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -167.38 -57.34 0.01 OUTLIER Pre-proline 0 CA--C 1.534 0.334 0 CA-C-N 116.125 -0.489 . . . . 0.0 111.421 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo -47.76 -51.42 9.82 Favored 'Trans proline' 0 C--N 1.359 1.079 0 C-N-CA 122.433 2.089 . . . . 0.0 113.095 -179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -62.49 -41.39 98.78 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-O 120.835 0.35 . . . . 0.0 110.73 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.07 -29.34 69.68 Favored 'General case' 0 CA--C 1.532 0.282 0 CA-C-N 115.857 -0.611 . . . . 0.0 111.267 179.423 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 3.6 mp -79.98 -31.8 39.82 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.611 0.244 . . . . 0.0 110.709 179.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -61.85 -40.49 95.54 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 116.35 -0.386 . . . . 0.0 111.28 179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -104.49 149.27 25.6 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.49 -0.323 . . . . 0.0 110.94 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -168.81 51.34 0.04 OUTLIER 'General case' 0 CA--C 1.532 0.261 0 CA-C-O 120.844 0.354 . . . . 0.0 111.647 179.883 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.7 p-10 -170.79 -54.4 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 116.187 -0.461 . . . . 0.0 111.131 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 2.0 mp0 -142.07 95.03 2.74 Favored 'General case' 0 C--O 1.232 0.152 0 CA-C-N 116.442 -0.345 . . . . 0.0 110.648 179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -127.98 135.14 49.51 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.146 -179.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -117.23 133.45 55.98 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 115.949 -0.568 . . . . 0.0 110.73 179.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.753 HD11 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -123.96 165.01 21.19 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.202 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.859 -179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.476 ' HB3' ' CE2' ' A' ' 86' ' ' PHE . 0.4 OUTLIER -129.43 104.04 7.26 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.767 -179.795 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.479 HG11 ' CE2' ' A' ' 46' ' ' TYR . 14.6 p -86.46 117.48 31.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-O 121.132 0.492 . . . . 0.0 111.136 179.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.476 ' CE2' ' HB3' ' A' ' 84' ' ' ASP . 79.6 m-85 -108.43 150.88 26.8 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.454 -179.541 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -119.66 166.08 13.66 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 116.552 -0.294 . . . . 0.0 111.021 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 67.49 179.25 0.23 Allowed 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.299 -179.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 4.0 tt0 -86.24 -62.51 1.5 Allowed 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.516 -0.311 . . . . 0.0 110.976 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 45.7 p 44.97 78.03 0.07 Allowed 'General case' 0 N--CA 1.466 0.344 0 O-C-N 123.399 0.437 . . . . 0.0 111.713 179.794 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -96.76 36.78 3.71 Favored Glycine 0 CA--C 1.522 0.469 0 C-N-CA 120.501 -0.857 . . . . 0.0 112.857 179.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.087 0 CA-C-O 118.369 -1.24 . . . . 0.0 112.832 179.514 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 54.9 t30 . . . . . 0 N--CA 1.49 1.555 0 CA-C-O 120.52 0.2 . . . . 0.0 111.388 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -88.42 119.17 28.61 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.941 179.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -140.99 124.1 16.43 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.904 179.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.41 ' O ' ' HA ' ' A' ' 32' ' ' LYS . 14.4 pt -80.23 126.51 39.46 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.154 0 CA-C-O 120.958 0.409 . . . . 0.0 111.221 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -92.62 93.45 8.52 Favored 'General case' 0 CA--C 1.531 0.212 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.513 -179.324 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.04 122.1 40.76 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-O 120.806 0.336 . . . . 0.0 111.006 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.37 103.56 13.65 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-N 116.068 -0.514 . . . . 0.0 110.577 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.441 HG11 ' CD1' ' A' ' 46' ' ' TYR . 17.2 t -88.69 110.52 21.38 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.205 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -116.36 111.81 20.61 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.9 179.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -87.0 149.63 22.33 Favored Glycine 0 C--N 1.333 0.393 0 C-N-CA 120.899 -0.667 . . . . 0.0 112.545 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.0 pt20 -55.08 -31.97 61.59 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 111.792 0.293 . . . . 0.0 111.792 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -64.18 -28.2 69.59 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 116.619 -0.264 . . . . 0.0 111.411 179.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 114.12 48.3 0.57 Allowed Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.115 -0.564 . . . . 0.0 112.617 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.2 m -125.69 113.27 17.11 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.594 0.235 . . . . 0.0 110.998 179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 5.7 m -112.29 125.71 69.6 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.246 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.228 179.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 15.7 m -135.51 168.2 23.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 116.104 -0.498 . . . . 0.0 111.48 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -122.61 95.66 4.72 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.04 179.906 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -92.85 137.5 32.31 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.01 179.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 17' ' ' ILE . 35.3 mtpt -126.85 111.87 14.68 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.994 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 2.6 pt -132.4 178.88 4.97 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 CA-C-N 116.231 -0.441 . . . . 0.0 111.416 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -75.98 155.36 35.08 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 116.177 -0.465 . . . . 0.0 110.961 179.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.06 30.16 2.22 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 116.319 -0.4 . . . . 0.0 111.424 179.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 9.7 m-70 -136.29 35.23 2.76 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.709 0.29 . . . . 0.0 110.808 179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 12.6 t -145.93 138.22 13.59 Favored Pre-proline 0 CA--C 1.529 0.158 0 CA-C-N 116.555 -0.293 . . . . 0.0 110.743 179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -52.41 156.51 8.17 Favored 'Trans proline' 0 C--N 1.349 0.596 0 C-N-CA 122.694 2.263 . . . . 0.0 112.572 -179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.864 HD12 ' HB2' ' A' ' 70' ' ' ASP . 12.7 mt -54.03 -22.51 10.79 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.21 -0.45 . . . . 0.0 111.944 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 t -52.3 -36.83 54.11 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-O 120.572 0.225 . . . . 0.0 110.977 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.15 -53.66 55.6 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.655 179.709 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 8.9 tt -67.08 -41.37 86.5 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.791 179.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.421 ' HG2' ' HB3' ' A' ' 68' ' ' GLU . 0.1 OUTLIER -56.0 -58.12 9.25 Favored 'General case' 0 C--O 1.231 0.106 0 CA-C-N 116.431 -0.35 . . . . 0.0 111.133 179.963 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 2.5 mtpm? -56.64 -42.2 78.5 Favored 'General case' 0 C--N 1.333 -0.127 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.83 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -61.58 -35.25 77.28 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 116.348 -0.387 . . . . 0.0 111.32 179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.441 ' CD1' HG11 ' A' ' 21' ' ' VAL . 83.1 t80 -77.14 -52.14 9.78 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.601 -179.761 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 2.0 p -60.93 -39.22 88.62 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-O 120.573 0.225 . . . . 0.0 111.195 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -69.16 -40.96 77.86 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.035 179.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 9.6 mtp180 -72.67 -40.67 66.1 Favored 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.294 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -73.66 -66.47 0.7 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.389 -179.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 141.28 46.73 0.05 OUTLIER Glycine 0 C--N 1.332 0.334 0 C-N-CA 120.935 -0.65 . . . . 0.0 112.081 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 7.9 mt -123.08 -159.61 0.85 Allowed 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 110.228 -0.286 . . . . 0.0 110.228 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -124.86 163.65 21.74 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.913 179.908 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 5.8 mtm -97.97 27.81 4.31 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.239 179.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 2.5 mtt180 -132.59 8.45 4.22 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 111.768 0.284 . . . . 0.0 111.768 179.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.507 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.5 77.97 0.62 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-O 121.228 0.537 . . . . 0.0 110.233 179.084 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.507 HD13 ' O ' ' A' ' 56' ' ' GLN . 11.7 mm -143.69 158.16 16.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.347 -0.842 . . . . 0.0 110.586 179.826 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.442 ' N ' HG22 ' A' ' 57' ' ' ILE . 4.1 tpt180 -142.12 123.38 14.73 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.438 -0.346 . . . . 0.0 111.145 179.597 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.666 ' CE2' HD13 ' A' ' 83' ' ' ILE . 0.1 OUTLIER -107.13 136.04 47.64 Favored 'General case' 0 C--O 1.232 0.166 0 CA-C-N 116.276 -0.42 . . . . 0.0 110.655 179.494 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.4 mtm-85 -135.42 140.3 44.83 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.367 -179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.456 ' CD2' HG23 ' A' ' 83' ' ' ILE . 1.8 t80 -120.23 101.63 7.95 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.273 179.484 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.45 34.76 24.83 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.085 -0.507 . . . . 0.0 111.22 -179.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 102.26 -27.94 18.13 Favored Glycine 0 CA--C 1.522 0.485 0 C-N-CA 120.865 -0.683 . . . . 0.0 112.983 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 3.9 mp0 -68.51 113.44 15.61 Favored Pre-proline 0 CA--C 1.53 0.2 0 CA-C-N 116.906 0.353 . . . . 0.0 111.007 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -75.13 118.9 5.39 Favored 'Trans proline' 0 C--N 1.349 0.597 0 C-N-CA 122.592 2.195 . . . . 0.0 112.366 -179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.601 HD12 ' CD1' ' A' ' 39' ' ' LEU . 25.3 pt -124.32 174.39 8.54 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.316 -179.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 17.3 m-80 -112.76 178.12 4.4 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.282 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.421 ' HB3' ' HG2' ' A' ' 43' ' ' MET . 0.5 OUTLIER -84.24 16.69 2.86 Favored 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.673 179.567 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -127.15 15.72 7.27 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.575 0.226 . . . . 0.0 111.098 179.412 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.864 ' HB2' HD12 ' A' ' 39' ' ' LEU . 0.4 OUTLIER -72.8 118.29 15.55 Favored 'General case' 0 C--O 1.23 0.073 0 CA-C-O 120.753 0.311 . . . . 0.0 110.832 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.468 ' HB ' ' HD3' ' A' ' 72' ' ' PRO . 0.7 OUTLIER -112.0 -50.46 0.05 OUTLIER Pre-proline 0 CA--C 1.536 0.417 0 CA-C-N 115.886 -0.597 . . . . 0.0 112.063 -179.737 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.468 ' HD3' ' HB ' ' A' ' 71' ' ' THR . 74.3 Cg_exo -50.38 -58.45 1.68 Allowed 'Trans proline' 0 C--N 1.36 1.133 0 C-N-CA 122.216 1.944 . . . . 0.0 112.513 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -65.1 -37.95 89.14 Favored 'General case' 0 N--CA 1.462 0.174 0 CA-C-O 120.9 0.381 . . . . 0.0 110.038 178.911 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.6 tm0? -54.39 -45.24 72.83 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.757 -0.656 . . . . 0.0 110.547 179.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 5.1 tt -76.32 -31.93 58.42 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.58 179.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -56.28 -27.97 57.11 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.11 179.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 29.9 mmt -60.13 168.55 1.89 Allowed 'General case' 0 N--CA 1.466 0.326 0 CA-C-O 120.723 0.297 . . . . 0.0 110.92 179.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -124.19 -62.01 1.31 Allowed 'General case' 0 C--O 1.233 0.232 0 CA-C-N 116.477 -0.328 . . . . 0.0 111.138 179.621 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -156.41 -60.96 0.1 Allowed 'General case' 0 CA--C 1.528 0.12 0 CA-C-N 116.553 -0.294 . . . . 0.0 111.453 -179.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -88.85 111.71 22.37 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.995 -179.444 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -140.14 146.71 39.17 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.239 -179.526 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -116.78 137.92 51.85 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 116.222 -0.444 . . . . 0.0 111.283 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.666 HD13 ' CE2' ' A' ' 59' ' ' PHE . 0.4 OUTLIER -152.33 158.71 4.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.274 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.323 -179.979 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -131.17 120.02 22.71 Favored 'General case' 0 C--O 1.233 0.184 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.649 179.566 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 11.4 p -85.68 120.95 36.62 Favored 'Isoleucine or valine' 0 C--O 1.233 0.187 0 CA-C-O 121.048 0.451 . . . . 0.0 111.083 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 33.5 m-85 -108.14 158.37 17.48 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.217 -179.585 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.5 169.45 8.45 Favored 'General case' 0 C--O 1.232 0.178 0 CA-C-N 116.171 -0.468 . . . . 0.0 111.058 179.834 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -96.27 33.1 1.82 Allowed 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.329 -0.396 . . . . 0.0 111.29 179.795 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.7 tp60 -135.52 76.87 1.64 Allowed 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.397 -0.365 . . . . 0.0 110.657 179.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 1.3 m -134.05 -62.65 0.75 Allowed 'General case' 0 C--O 1.234 0.239 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.007 -179.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 82.62 -104.83 2.56 Favored Glycine 0 C--N 1.335 0.478 0 C-N-CA 121.029 -0.605 . . . . 0.0 112.748 179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.335 -1.258 . . . . 0.0 112.514 -179.743 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 . . . . . 0 N--CA 1.489 1.491 0 CA-C-O 120.832 0.348 . . . . 0.0 110.962 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -122.19 90.67 3.35 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 116.154 -0.475 . . . . 0.0 110.967 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 6.0 m80 -146.76 158.97 44.04 Favored 'General case' 0 C--O 1.233 0.194 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.154 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.553 HD11 HG13 ' A' ' 33' ' ' ILE . 12.8 pt -100.92 124.78 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.188 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.773 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -90.69 111.1 22.31 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-N 116.279 -0.418 . . . . 0.0 111.113 -179.666 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.453 HD22 HG13 ' A' ' 83' ' ' ILE . 0.9 OUTLIER -109.65 125.38 52.54 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.381 -0.372 . . . . 0.0 111.465 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.735 ' HB2' HG22 ' A' ' 82' ' ' THR . 8.3 mttp -95.91 104.68 16.63 Favored 'General case' 0 C--O 1.232 0.18 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.366 179.438 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.628 ' HA ' HD12 ' A' ' 83' ' ' ILE . 12.6 t -89.31 120.11 37.5 Favored 'Isoleucine or valine' 0 C--O 1.233 0.207 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.158 -179.714 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -118.08 92.14 3.75 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 116.027 -0.533 . . . . 0.0 110.963 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -80.03 166.03 49.7 Favored Glycine 0 C--N 1.33 0.249 0 C-N-CA 120.918 -0.658 . . . . 0.0 112.546 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 2.6 tt0 -84.75 48.21 1.5 Allowed 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 120.73 0.3 . . . . 0.0 111.19 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -148.58 32.5 0.79 Allowed 'General case' 0 CA--C 1.532 0.262 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.071 179.897 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 58.98 30.58 66.86 Favored Glycine 0 C--N 1.336 0.552 0 C-N-CA 120.941 -0.647 . . . . 0.0 112.541 -179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.25 135.47 54.02 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-O 120.702 0.287 . . . . 0.0 111.026 -179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.482 HG23 ' O ' ' A' ' 28' ' ' VAL . 15.6 m -144.23 103.71 0.78 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.217 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.194 179.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 18.3 t -125.13 141.52 44.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.189 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.185 -179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -103.85 102.75 12.56 Favored 'General case' 0 CA--C 1.531 0.215 0 CA-C-O 120.99 0.424 . . . . 0.0 110.954 179.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.15 143.27 31.45 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.787 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.1 ptpt -119.95 136.18 54.62 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.844 0.354 . . . . 0.0 111.27 -179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.553 HG13 HD11 ' A' ' 17' ' ' ILE . 2.3 pt -135.12 179.55 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.022 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.7 159.46 26.65 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.85 179.816 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -94.69 43.59 1.1 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.049 0.452 . . . . 0.0 110.932 179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -151.3 35.46 0.58 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.961 -179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -148.44 141.91 15.82 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 116.463 -0.335 . . . . 0.0 110.752 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.459 ' HA ' HG23 ' A' ' 71' ' ' THR . 37.1 Cg_endo -65.19 173.59 5.96 Favored 'Trans proline' 0 C--N 1.35 0.621 0 C-N-CA 122.728 2.285 . . . . 0.0 112.525 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.683 HD12 ' CB ' ' A' ' 70' ' ' ASP . 11.2 mt -56.1 -24.18 38.7 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.382 179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.4 t -50.4 -40.52 50.2 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 116.775 -0.193 . . . . 0.0 111.342 179.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 1.8 tptt -58.72 -58.6 7.86 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 116.702 -0.226 . . . . 0.0 111.022 -179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 42' ' ' LEU . 1.3 tm? -59.44 -42.93 93.08 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-N 116.508 -0.315 . . . . 0.0 110.818 179.481 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . 0.469 ' HG2' ' CE1' ' A' ' 59' ' ' PHE . 0.0 OUTLIER -60.59 -54.7 42.28 Favored 'General case' 0 N--CA 1.462 0.164 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.141 179.915 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -60.7 -50.52 73.17 Favored 'General case' 0 C--N 1.333 -0.115 0 CA-C-N 116.579 -0.282 . . . . 0.0 111.007 179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -57.35 -41.94 81.03 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.449 -0.341 . . . . 0.0 111.382 179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.444 ' CZ ' HG11 ' A' ' 21' ' ' VAL . 67.7 t80 -69.61 -53.17 20.08 Favored 'General case' 0 C--O 1.233 0.193 0 CA-C-N 116.372 -0.376 . . . . 0.0 111.158 -179.955 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -59.19 -44.58 92.21 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.135 -179.948 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -59.99 -45.59 92.22 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.851 179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.82 -34.77 78.55 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 116.303 -0.408 . . . . 0.0 111.126 179.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -74.9 -75.81 0.16 Allowed 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 116.468 -0.333 . . . . 0.0 111.224 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 151.77 46.63 0.02 OUTLIER Glycine 0 C--N 1.334 0.45 0 C-N-CA 121.01 -0.614 . . . . 0.0 112.196 -179.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 5.2 mt -124.9 -163.26 1.16 Allowed 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.625 0.25 . . . . 0.0 110.416 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 14.5 m -115.96 170.97 8.08 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.032 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 1.7 ptm -102.38 22.89 12.64 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.432 179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -137.67 15.72 2.91 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 111.786 0.291 . . . . 0.0 111.786 179.799 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.568 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.1 OUTLIER -160.62 78.03 0.62 Allowed 'General case' 0 N--CA 1.453 -0.289 0 CA-C-O 121.163 0.506 . . . . 0.0 110.168 179.174 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.568 HD13 ' O ' ' A' ' 56' ' ' GLN . 14.6 mm -146.44 157.98 11.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.403 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.604 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.447 ' N ' HG22 ' A' ' 57' ' ' ILE . 2.7 tpt180 -142.93 109.0 5.21 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.328 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.469 ' CE1' ' HG2' ' A' ' 43' ' ' MET . 9.3 m-85 -105.23 151.17 24.42 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.342 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 56.2 mtt180 -146.21 136.87 24.17 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-O 120.882 0.372 . . . . 0.0 111.294 179.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . 0.586 ' HA ' HG22 ' A' ' 83' ' ' ILE . 67.0 t80 -96.58 94.81 7.56 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.155 179.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 53.03 35.78 20.38 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.193 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 112.9 -30.21 7.58 Favored Glycine 0 C--N 1.336 0.581 0 C-N-CA 120.946 -0.645 . . . . 0.0 113.253 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 -75.56 112.98 22.04 Favored Pre-proline 0 CA--C 1.533 0.312 0 CA-C-N 116.859 0.33 . . . . 0.0 111.431 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -59.96 137.62 77.16 Favored 'Trans proline' 0 C--N 1.352 0.754 0 C-N-CA 122.914 2.409 . . . . 0.0 112.988 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.469 HD12 ' CD1' ' A' ' 39' ' ' LEU . 17.8 pt -147.56 158.68 8.82 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.228 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.996 179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -137.44 176.18 8.94 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.504 -0.317 . . . . 0.0 111.302 179.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.85 81.35 0.3 Allowed 'General case' 0 N--CA 1.466 0.354 0 CA-C-O 121.078 0.466 . . . . 0.0 110.316 179.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 3.0 t -177.66 -28.09 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.714 -0.676 . . . . 0.0 112.018 -179.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.683 ' CB ' HD12 ' A' ' 39' ' ' LEU . 1.6 t70 -51.89 167.15 0.12 Allowed 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 120.933 0.397 . . . . 0.0 111.733 -179.485 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.471 ' H ' ' HD2' ' A' ' 72' ' ' PRO . 0.0 OUTLIER -162.17 -55.99 0.01 OUTLIER Pre-proline 0 CA--C 1.535 0.367 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.263 179.844 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . 0.471 ' HD2' ' H ' ' A' ' 71' ' ' THR . 93.6 Cg_exo -45.19 -48.29 11.47 Favored 'Trans proline' 0 C--N 1.356 0.951 0 C-N-CA 122.385 2.057 . . . . 0.0 112.806 -179.996 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -67.0 -40.36 87.32 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.056 0.455 . . . . 0.0 110.063 179.019 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . 0.664 ' HG2' ' HE3' ' A' ' 77' ' ' MET . 13.9 tm0? -58.25 -34.61 70.65 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-N 115.573 -0.739 . . . . 0.0 110.819 178.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -75.26 -32.4 61.06 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.472 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.52 -43.62 84.45 Favored 'General case' 0 CA--C 1.529 0.166 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.836 179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . 0.664 ' HE3' ' HG2' ' A' ' 74' ' ' GLN . 3.8 ptt? -74.77 150.8 39.25 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.843 179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.68 -43.9 0.48 Allowed 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 112.145 0.424 . . . . 0.0 112.145 -179.936 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -122.94 -67.74 0.93 Allowed 'General case' 0 CA--C 1.529 0.145 0 N-CA-C 111.718 0.266 . . . . 0.0 111.718 -179.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -94.46 127.59 40.47 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 120.869 0.366 . . . . 0.0 111.312 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -157.76 143.86 17.49 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.591 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . 0.735 HG22 ' HB2' ' A' ' 20' ' ' LYS . 57.8 p -137.36 149.06 46.71 Favored 'General case' 0 C--O 1.233 0.185 0 CA-C-O 120.915 0.388 . . . . 0.0 111.477 -179.643 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' A' ' 21' ' ' VAL . 1.1 pp -154.6 152.76 9.04 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.819 -0.628 . . . . 0.0 110.619 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -109.79 133.11 53.51 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.127 179.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.515 ' O ' HG13 ' A' ' 85' ' ' VAL . 8.4 p -107.95 103.6 15.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 121.273 0.559 . . . . 0.0 111.239 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 23.4 m-30 -103.38 169.07 8.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.534 -0.757 . . . . 0.0 110.653 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -137.19 139.77 41.32 Favored 'General case' 0 C--O 1.233 0.207 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.162 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -88.3 168.4 12.72 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.117 179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -161.53 160.73 29.42 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 116.103 -0.498 . . . . 0.0 111.026 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -109.86 78.65 1.14 Allowed 'General case' 0 C--O 1.234 0.252 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.455 179.708 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . -85.02 133.07 11.5 Favored Glycine 0 C--N 1.333 0.396 0 C-N-CA 120.992 -0.623 . . . . 0.0 112.751 -179.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.377 -1.235 . . . . 0.0 112.48 179.999 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASN . . . . . . . . . . . . . 2.4 m-20 . . . . . 0 N--CA 1.492 1.658 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -127.53 74.99 1.56 Allowed 'General case' 0 C--O 1.233 0.19 0 CA-C-O 120.877 0.37 . . . . 0.0 110.94 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 54.4 m80 -144.77 152.02 39.73 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.949 -179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.653 HG22 ' O ' ' A' ' 78' ' ' GLU . 18.2 pt -98.86 124.32 52.0 Favored 'Isoleucine or valine' 0 C--O 1.232 0.165 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.119 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASN . . . . . 0.451 ' C ' HD22 ' A' ' 19' ' ' LEU . 29.5 m-20 -84.41 122.4 28.9 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.056 -179.816 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.492 HD12 HD11 ' A' ' 83' ' ' ILE . 4.3 mm? -119.56 117.28 27.94 Favored 'General case' 0 C--O 1.233 0.229 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.258 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.06 95.27 10.01 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.325 179.392 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.649 HG22 HD12 ' A' ' 83' ' ' ILE . 21.3 t -83.88 122.1 37.31 Favored 'Isoleucine or valine' 0 C--O 1.233 0.22 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.3 -179.538 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -99.68 119.29 37.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.227 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . 0.403 ' HA2' HG13 ' A' ' 85' ' ' VAL . . . -83.6 136.38 14.91 Favored Glycine 0 C--N 1.332 0.319 0 C-N-CA 121.212 -0.518 . . . . 0.0 112.752 -179.928 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -63.23 -35.81 81.58 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 179.836 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -58.4 -32.68 68.86 Favored 'General case' 0 CA--C 1.531 0.25 0 CA-C-N 116.593 -0.276 . . . . 0.0 111.292 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.89 45.67 0.2 Allowed Glycine 0 C--N 1.333 0.385 0 C-N-CA 121.193 -0.527 . . . . 0.0 112.389 -179.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.52 160.8 38.66 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-O 120.662 0.268 . . . . 0.0 110.969 -179.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.0 t -142.03 101.57 0.96 Allowed 'Isoleucine or valine' 0 C--O 1.233 0.222 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.139 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.401 ' HB ' ' CE1' ' A' ' 46' ' ' TYR . 21.4 t -105.59 147.17 11.61 Favored 'Isoleucine or valine' 0 C--O 1.233 0.2 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.075 179.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -114.86 122.77 47.34 Favored 'General case' 0 C--O 1.232 0.179 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.221 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 2.3 m-85 -129.99 146.36 51.68 Favored 'General case' 0 C--O 1.233 0.189 0 CA-C-N 116.224 -0.444 . . . . 0.0 110.86 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -126.92 144.42 51.0 Favored 'General case' 0 C--O 1.233 0.206 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.37 -179.745 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 11.8 pt -145.11 178.96 1.29 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.367 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -85.49 148.25 26.06 Favored 'General case' 0 N--CA 1.464 0.252 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.629 179.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 1.0 OUTLIER -85.8 56.65 4.06 Favored 'General case' 0 CA--C 1.533 0.293 0 CA-C-O 120.884 0.373 . . . . 0.0 111.245 -179.877 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 3.7 m-70 -165.05 35.41 0.06 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.002 179.742 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.95 146.85 16.38 Favored Pre-proline 0 N--CA 1.466 0.372 0 CA-C-O 120.629 0.252 . . . . 0.0 111.307 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -55.4 161.63 7.09 Favored 'Trans proline' 0 C--N 1.35 0.637 0 C-N-CA 123.051 2.5 . . . . 0.0 113.102 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.576 ' CD1' HD12 ' A' ' 66' ' ' ILE . 10.5 mt -59.74 -22.31 61.9 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 116.079 -0.51 . . . . 0.0 111.739 179.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -51.08 -31.36 18.68 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 116.728 -0.214 . . . . 0.0 111.245 179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.79 -61.63 2.3 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.594 -0.275 . . . . 0.0 110.902 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 9.1 tt -66.78 -45.26 79.01 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.054 179.745 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' MET . . . . . . . . . . . . . 1.5 mmm -53.86 -41.55 67.62 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 116.404 -0.362 . . . . 0.0 111.328 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 30.4 mttt -66.09 -57.9 6.67 Favored 'General case' 0 N--CA 1.463 0.195 0 CA-C-N 116.616 -0.265 . . . . 0.0 110.949 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ALA . . . . . 0.417 ' O ' ' HB2' ' A' ' 49' ' ' ARG . . . -59.55 -34.24 72.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.927 -179.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.401 ' CE1' ' HB ' ' A' ' 29' ' ' VAL . 35.0 t80 -60.34 -60.81 3.22 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 116.627 -0.26 . . . . 0.0 111.231 -179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -63.52 -28.3 69.86 Favored 'General case' 0 N--CA 1.465 0.288 0 CA-C-N 116.389 -0.368 . . . . 0.0 111.271 179.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -74.43 -56.6 4.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.484 -179.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.417 ' HB2' ' O ' ' A' ' 45' ' ' ALA . 0.0 OUTLIER -57.13 -41.32 78.83 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.444 -0.344 . . . . 0.0 111.467 -179.636 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -73.16 -72.41 0.25 Allowed 'General case' 0 C--O 1.232 0.177 0 CA-C-N 116.566 -0.288 . . . . 0.0 111.137 -179.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 138.06 41.81 0.09 OUTLIER Glycine 0 C--N 1.335 0.492 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.779 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.609 HD22 ' N ' ' A' ' 52' ' ' LEU . 1.4 mm? -103.74 -152.5 0.45 Allowed 'General case' 0 CA--C 1.532 0.287 0 CA-C-O 120.544 0.211 . . . . 0.0 110.559 -179.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -112.83 122.44 47.67 Favored 'General case' 0 N--CA 1.461 0.098 0 CA-C-O 120.747 0.308 . . . . 0.0 110.929 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 9.2 tpt -63.34 -26.43 68.76 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 116.253 -0.431 . . . . 0.0 111.487 179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -101.3 25.9 7.75 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 111.659 0.244 . . . . 0.0 111.659 -179.822 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLN . . . . . 0.591 ' O ' HD13 ' A' ' 57' ' ' ILE . 0.0 OUTLIER -160.7 78.04 0.61 Allowed 'General case' 0 N--CA 1.456 -0.161 0 CA-C-O 121.126 0.488 . . . . 0.0 110.467 179.125 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.591 HD13 ' O ' ' A' ' 56' ' ' GLN . 20.2 mm -146.88 159.14 9.86 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.331 0 CA-C-N 115.442 -0.799 . . . . 0.0 110.847 179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.484 ' N ' HG22 ' A' ' 57' ' ' ILE . 1.9 ttm-85 -141.0 135.34 31.04 Favored 'General case' 0 CA--C 1.529 0.153 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.732 179.82 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PHE . . . . . 0.425 ' HB3' HG13 ' A' ' 66' ' ' ILE . 0.7 OUTLIER -120.96 143.03 49.22 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.551 -0.295 . . . . 0.0 111.027 179.986 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 4.0 mtt180 -135.04 119.33 17.78 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 116.229 -0.442 . . . . 0.0 111.378 -179.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -107.15 103.52 12.94 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.268 179.465 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 56.74 38.2 29.34 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.91 -179.441 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 79.94 28.52 49.97 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 121.159 -0.543 . . . . 0.0 112.966 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -124.72 107.1 29.11 Favored Pre-proline 0 C--O 1.233 0.213 0 CA-C-N 116.849 0.324 . . . . 0.0 110.856 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -53.06 129.34 32.82 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 123.082 2.521 . . . . 0.0 112.855 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . 0.576 HD12 ' CD1' ' A' ' 39' ' ' LEU . 11.0 pt -146.95 145.83 19.07 Favored 'Isoleucine or valine' 0 C--O 1.234 0.262 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.467 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -99.31 173.72 6.64 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.712 179.454 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.78 47.9 0.44 Allowed 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 120.672 0.273 . . . . 0.0 111.608 179.694 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 17.5 p -148.35 18.01 1.06 Allowed 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.572 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.53 ' CB ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -74.41 176.7 6.53 Favored 'General case' 0 CA--C 1.531 0.229 0 CA-C-O 120.847 0.356 . . . . 0.0 111.748 -179.826 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -164.23 -56.7 0.01 OUTLIER Pre-proline 0 N--CA 1.466 0.349 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.365 179.715 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -48.37 -48.63 16.46 Favored 'Trans proline' 0 C--N 1.356 0.924 0 C-N-CA 122.562 2.175 . . . . 0.0 112.887 -179.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -69.15 -42.14 76.36 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.759 0.314 . . . . 0.0 110.836 179.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 24.7 tm0? -57.73 -37.99 74.52 Favored 'General case' 0 CA--C 1.53 0.174 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.684 179.3 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 1.1 mp -76.69 -31.99 57.61 Favored 'General case' 0 C--N 1.333 -0.13 0 CA-C-N 116.425 -0.352 . . . . 0.0 110.518 179.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -58.48 -30.93 67.37 Favored 'General case' 0 CA--C 1.533 0.3 0 CA-C-N 116.408 -0.36 . . . . 0.0 110.831 179.359 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 13.5 mtt -62.47 170.78 2.24 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 120.911 0.386 . . . . 0.0 111.407 179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 0.653 ' O ' HG22 ' A' ' 17' ' ' ILE . 25.5 tt0 -137.92 -52.97 0.63 Allowed 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.425 -179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASP . . . . . . . . . . . . . 1.1 t0 -156.61 -61.71 0.1 Allowed 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 111.706 0.262 . . . . 0.0 111.706 -179.958 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 23.3 mt-10 -96.82 120.47 37.21 Favored 'General case' 0 C--O 1.233 0.202 0 CA-C-O 120.755 0.312 . . . . 0.0 111.172 -179.575 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -152.14 159.28 43.66 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.266 179.981 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -122.91 151.1 42.1 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.158 -0.474 . . . . 0.0 111.458 -179.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.649 HD12 HG22 ' A' ' 21' ' ' VAL . 1.2 mt -144.51 168.07 10.56 Favored 'Isoleucine or valine' 0 C--O 1.233 0.228 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.923 179.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.453 ' H ' HG22 ' A' ' 83' ' ' ILE . 16.4 m-20 -137.86 97.2 3.37 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.677 179.893 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.503 HG12 HG12 ' A' ' 21' ' ' VAL . 13.4 p -82.08 119.8 32.35 Favored 'Isoleucine or valine' 0 C--O 1.233 0.219 0 CA-C-O 121.033 0.444 . . . . 0.0 111.138 179.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 1.1 m-85 -99.34 129.13 45.52 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.983 -179.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 -109.46 143.34 39.21 Favored 'General case' 0 C--O 1.233 0.203 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.89 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -132.61 152.66 51.57 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.926 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' GLN . . . . . . . . . . . . . 14.2 mp0 -115.37 -55.2 2.48 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.195 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 26.0 m -101.02 -60.28 1.55 Allowed 'General case' 0 C--O 1.233 0.223 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.129 -179.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 139.16 160.38 8.34 Favored Glycine 0 C--N 1.333 0.389 0 C-N-CA 120.814 -0.707 . . . . 0.0 112.793 -179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.09 0 CA-C-O 118.496 -1.169 . . . . 0.0 112.453 -179.894 . . . . . . . . 0 0 . 1 stop_ save_